data_18802 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18802 _Entry.PDB_ID 2M09 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 18802 _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 26 26 ALA N N 26 124.085 124.085 120.905 3.180 18802 2 1 1 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.213 0.079 18802 3 1 1 . 1 1 26 26 ALA C C 26 177.101 177.101 177.921 -0.820 18802 4 1 1 . 1 1 26 26 ALA CA C 26 52.921 52.921 54.029 -1.108 18802 5 1 1 . 1 1 26 26 ALA CB C 26 19.426 19.426 18.266 1.160 18802 6 1 1 . 1 1 26 26 ALA H H 26 8.498 8.498 9.116 -0.618 18802 7 1 1 . 1 1 27 27 MET N N 27 119.630 119.630 116.590 3.040 18802 8 1 1 . 1 1 27 27 MET HA H 27 4.391 4.391 4.450 -0.059 18802 9 1 1 . 1 1 27 27 MET C C 27 176.296 176.296 175.914 0.382 18802 10 1 1 . 1 1 27 27 MET CA C 27 55.834 55.834 56.944 -1.110 18802 11 1 1 . 1 1 27 27 MET CB C 27 32.663 32.663 33.054 -0.391 18802 12 1 1 . 1 1 27 27 MET H H 27 8.441 8.441 8.439 0.002 18802 13 1 1 . 1 1 28 28 GLU N N 28 122.376 122.376 122.196 0.180 18802 14 1 1 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.416 -0.202 18802 15 1 1 . 1 1 28 28 GLU C C 28 176.310 176.310 175.158 1.152 18802 16 1 1 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.250 0.569 18802 17 1 1 . 1 1 28 28 GLU CB C 28 30.252 30.252 29.240 1.012 18802 18 1 1 . 1 1 28 28 GLU H H 28 8.336 8.336 8.289 0.047 18802 19 1 1 . 1 1 29 29 GLN N N 29 122.010 122.010 124.026 -2.016 18802 20 1 1 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.406 -0.115 18802 21 1 1 . 1 1 29 29 GLN C C 29 175.765 175.765 173.769 1.996 18802 22 1 1 . 1 1 29 29 GLN CA C 29 55.839 55.839 55.354 0.485 18802 23 1 1 . 1 1 29 29 GLN CB C 29 29.559 29.559 31.714 -2.155 18802 24 1 1 . 1 1 29 29 GLN H H 29 8.347 8.347 8.372 -0.025 18802 25 1 1 . 1 1 30 30 LYS N N 30 123.090 123.090 128.352 -5.262 18802 26 1 1 . 1 1 30 30 LYS HA H 30 4.336 4.336 5.045 -0.709 18802 27 1 1 . 1 1 30 30 LYS C C 30 176.474 176.474 176.314 0.160 18802 28 1 1 . 1 1 30 30 LYS CA C 30 56.391 56.391 55.648 0.743 18802 29 1 1 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.691 0.302 18802 30 1 1 . 1 1 30 30 LYS H H 30 8.327 8.327 8.625 -0.298 18802 31 1 1 . 1 1 31 31 THR N N 31 116.800 116.800 121.908 -5.108 18802 32 1 1 . 1 1 31 31 THR HA H 31 4.273 4.273 4.356 -0.083 18802 33 1 1 . 1 1 31 31 THR C C 31 174.071 174.071 174.242 -0.171 18802 34 1 1 . 1 1 31 31 THR CA C 31 62.103 62.103 61.826 0.277 18802 35 1 1 . 1 1 31 31 THR CB C 31 69.899 69.899 69.478 0.421 18802 36 1 1 . 1 1 31 31 THR H H 31 8.160 8.160 9.299 -1.139 18802 37 1 1 . 1 1 32 32 VAL N N 32 124.108 124.108 127.563 -3.455 18802 38 1 1 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.266 -0.200 18802 39 1 1 . 1 1 32 32 VAL C C 32 175.573 175.573 174.582 0.991 18802 40 1 1 . 1 1 32 32 VAL CA C 32 62.344 62.344 60.236 2.107 18802 41 1 1 . 1 1 32 32 VAL CB C 32 32.912 32.912 34.355 -1.442 18802 42 1 1 . 1 1 32 32 VAL H H 32 8.192 8.192 8.526 -0.334 18802 43 1 1 . 1 1 33 33 ILE N N 33 127.371 127.371 126.447 0.924 18802 44 1 1 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.498 -0.074 18802 45 1 1 . 1 1 33 33 ILE C C 33 174.335 174.335 174.267 0.068 18802 46 1 1 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.316 1.078 18802 47 1 1 . 1 1 33 33 ILE CB C 33 38.799 38.799 36.756 2.043 18802 48 1 1 . 1 1 33 33 ILE H H 33 8.275 8.275 8.390 -0.115 18802 49 1 1 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.520 -0.217 18802 50 1 1 . 1 1 34 34 PRO C C 34 177.261 177.261 177.519 -0.258 18802 51 1 1 . 1 1 34 34 PRO CA C 34 63.672 63.672 62.817 0.855 18802 52 1 1 . 1 1 34 34 PRO CB C 34 32.177 32.177 32.233 -0.056 18802 53 1 1 . 1 1 35 35 GLY N N 35 109.540 109.540 112.251 -2.711 18802 54 1 1 . 1 1 35 35 GLY C C 35 173.906 173.906 174.684 -0.778 18802 55 1 1 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.909 0.361 18802 56 1 1 . 1 1 35 35 GLY H H 35 8.376 8.376 8.577 -0.201 18802 57 1 1 . 1 1 36 36 MET N N 36 120.834 120.834 121.373 -0.539 18802 58 1 1 . 1 1 36 36 MET HA H 36 4.780 4.780 4.832 -0.052 18802 59 1 1 . 1 1 36 36 MET C C 36 174.235 174.235 173.831 0.404 18802 60 1 1 . 1 1 36 36 MET CA C 36 53.258 53.258 51.835 1.423 18802 61 1 1 . 1 1 36 36 MET CB C 36 32.734 32.734 33.032 -0.298 18802 62 1 1 . 1 1 36 36 MET H H 36 7.986 7.986 8.040 -0.054 18802 63 1 1 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.646 -0.184 18802 64 1 1 . 1 1 37 37 PRO C C 37 176.736 176.736 176.249 0.487 18802 65 1 1 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.374 0.884 18802 66 1 1 . 1 1 37 37 PRO CB C 37 32.200 32.200 32.053 0.147 18802 67 1 1 . 1 1 38 38 THR N N 38 115.642 115.642 114.557 1.085 18802 68 1 1 . 1 1 38 38 THR HA H 38 4.226 4.226 4.542 -0.316 18802 69 1 1 . 1 1 38 38 THR C C 38 174.164 174.164 174.191 -0.027 18802 70 1 1 . 1 1 38 38 THR CA C 38 62.462 62.462 61.254 1.208 18802 71 1 1 . 1 1 38 38 THR CB C 38 69.874 69.874 70.203 -0.329 18802 72 1 1 . 1 1 38 38 THR H H 38 8.189 8.189 8.231 -0.042 18802 73 1 1 . 1 1 39 39 VAL N N 39 123.700 123.700 126.990 -3.290 18802 74 1 1 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.312 -0.233 18802 75 1 1 . 1 1 39 39 VAL C C 39 175.177 175.177 175.296 -0.119 18802 76 1 1 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.447 0.544 18802 77 1 1 . 1 1 39 39 VAL CB C 39 32.898 32.898 32.133 0.765 18802 78 1 1 . 1 1 39 39 VAL H H 39 8.036 8.036 8.674 -0.638 18802 79 1 1 . 1 1 40 40 ILE N N 40 127.780 127.780 128.647 -0.867 18802 80 1 1 . 1 1 40 40 ILE HA H 40 4.177 4.177 3.974 0.203 18802 81 1 1 . 1 1 40 40 ILE C C 40 173.894 173.894 174.623 -0.729 18802 82 1 1 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.725 -1.814 18802 83 1 1 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.780 0.853 18802 84 1 1 . 1 1 40 40 ILE H H 40 8.236 8.236 8.356 -0.120 18802 85 1 1 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.630 -0.139 18802 86 1 1 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.121 0.503 18802 87 1 1 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.045 0.057 18802 88 1 1 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.404 -0.149 18802 89 1 1 . 1 1 42 42 PRO C C 42 177.721 177.721 178.217 -0.496 18802 90 1 1 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.191 -0.391 18802 91 1 1 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.864 0.491 18802 92 1 1 . 1 1 43 43 GLY N N 43 107.305 107.305 109.232 -1.927 18802 93 1 1 . 1 1 43 43 GLY C C 43 174.642 174.642 173.998 0.644 18802 94 1 1 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.766 0.952 18802 95 1 1 . 1 1 43 43 GLY H H 43 8.321 8.321 8.565 -0.244 18802 96 1 1 . 1 1 44 44 LEU N N 44 120.897 120.897 121.493 -0.596 18802 97 1 1 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.525 0.004 18802 98 1 1 . 1 1 44 44 LEU C C 44 178.580 178.580 176.532 2.048 18802 99 1 1 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.267 0.283 18802 100 1 1 . 1 1 44 44 LEU CB C 44 42.579 42.579 43.043 -0.464 18802 101 1 1 . 1 1 44 44 LEU H H 44 8.043 8.043 7.617 0.426 18802 102 1 1 . 1 1 45 45 THR N N 45 113.195 113.195 111.337 1.858 18802 103 1 1 . 1 1 45 45 THR HA H 45 4.386 4.386 4.592 -0.206 18802 104 1 1 . 1 1 45 45 THR C C 45 175.377 175.377 175.588 -0.211 18802 105 1 1 . 1 1 45 45 THR CA C 45 61.188 61.188 60.273 0.915 18802 106 1 1 . 1 1 45 45 THR CB C 45 71.043 71.043 71.051 -0.008 18802 107 1 1 . 1 1 45 45 THR H H 45 8.427 8.427 8.109 0.318 18802 108 1 1 . 1 1 46 46 ARG N N 46 121.322 121.322 121.982 -0.660 18802 109 1 1 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.009 0.028 18802 110 1 1 . 1 1 46 46 ARG C C 46 179.309 179.309 178.034 1.275 18802 111 1 1 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.167 0.217 18802 112 1 1 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.285 0.531 18802 113 1 1 . 1 1 46 46 ARG H H 46 8.832 8.832 8.939 -0.107 18802 114 1 1 . 1 1 47 47 GLU N N 47 119.109 119.109 119.392 -0.283 18802 115 1 1 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.133 -0.124 18802 116 1 1 . 1 1 47 47 GLU C C 47 178.931 178.931 178.950 -0.019 18802 117 1 1 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.615 0.661 18802 118 1 1 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.704 0.587 18802 119 1 1 . 1 1 47 47 GLU H H 47 8.754 8.754 8.552 0.202 18802 120 1 1 . 1 1 48 48 GLN N N 48 119.556 119.556 119.822 -0.266 18802 121 1 1 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.040 0.026 18802 122 1 1 . 1 1 48 48 GLN C C 48 179.286 179.286 178.174 1.112 18802 123 1 1 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.572 -0.357 18802 124 1 1 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.327 1.340 18802 125 1 1 . 1 1 48 48 GLN H H 48 7.711 7.711 7.928 -0.217 18802 126 1 1 . 1 1 49 49 GLU N N 49 122.227 122.227 120.754 1.473 18802 127 1 1 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.966 -0.093 18802 128 1 1 . 1 1 49 49 GLU C C 49 177.879 177.879 178.993 -1.114 18802 129 1 1 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.992 -0.034 18802 130 1 1 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.460 0.318 18802 131 1 1 . 1 1 49 49 GLU H H 49 8.730 8.730 8.686 0.044 18802 132 1 1 . 1 1 50 50 ARG N N 50 119.109 119.109 118.744 0.365 18802 133 1 1 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.048 0.021 18802 134 1 1 . 1 1 50 50 ARG C C 50 177.567 177.567 178.536 -0.969 18802 135 1 1 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.305 -0.079 18802 136 1 1 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.390 -0.294 18802 137 1 1 . 1 1 50 50 ARG H H 50 7.906 7.906 7.630 0.276 18802 138 1 1 . 1 1 51 51 ALA N N 51 119.411 119.411 122.818 -3.407 18802 139 1 1 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.868 -0.064 18802 140 1 1 . 1 1 51 51 ALA C C 51 178.740 178.740 179.187 -0.447 18802 141 1 1 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.017 0.218 18802 142 1 1 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.273 -0.014 18802 143 1 1 . 1 1 51 51 ALA H H 51 7.956 7.956 8.019 -0.063 18802 144 1 1 . 1 1 52 52 TYR N N 52 119.160 119.160 120.126 -0.966 18802 145 1 1 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.194 -0.136 18802 146 1 1 . 1 1 52 52 TYR C C 52 177.367 177.367 177.613 -0.246 18802 147 1 1 . 1 1 52 52 TYR CA C 52 61.605 61.605 60.873 0.732 18802 148 1 1 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.381 0.328 18802 149 1 1 . 1 1 52 52 TYR H H 52 7.854 7.854 8.092 -0.238 18802 150 1 1 . 1 1 53 53 ILE N N 53 119.173 119.173 119.166 0.007 18802 151 1 1 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.092 0.510 18802 152 1 1 . 1 1 53 53 ILE C C 53 178.711 178.711 177.716 0.995 18802 153 1 1 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.223 -1.035 18802 154 1 1 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.951 0.363 18802 155 1 1 . 1 1 53 53 ILE H H 53 7.809 7.809 8.075 -0.266 18802 156 1 1 . 1 1 54 54 VAL N N 54 121.549 121.549 117.820 3.729 18802 157 1 1 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.861 -0.387 18802 158 1 1 . 1 1 54 54 VAL C C 54 177.992 177.992 177.618 0.374 18802 159 1 1 . 1 1 54 54 VAL CA C 54 66.995 66.995 65.286 1.709 18802 160 1 1 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.096 0.135 18802 161 1 1 . 1 1 54 54 VAL H H 54 8.572 8.572 8.472 0.100 18802 162 1 1 . 1 1 55 55 GLN N N 55 119.997 119.997 120.258 -0.261 18802 163 1 1 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.883 -0.182 18802 164 1 1 . 1 1 55 55 GLN C C 55 178.604 178.604 178.298 0.306 18802 165 1 1 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.099 1.096 18802 166 1 1 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.641 -0.499 18802 167 1 1 . 1 1 55 55 GLN H H 55 8.183 8.183 7.971 0.211 18802 168 1 1 . 1 1 56 56 LEU N N 56 119.605 119.605 119.315 0.290 18802 169 1 1 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.876 0.070 18802 170 1 1 . 1 1 56 56 LEU C C 56 180.439 180.439 179.117 1.322 18802 171 1 1 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.669 0.566 18802 172 1 1 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.510 0.339 18802 173 1 1 . 1 1 56 56 LEU H H 56 7.586 7.586 7.451 0.135 18802 174 1 1 . 1 1 57 57 GLN N N 57 120.332 120.332 118.576 1.756 18802 175 1 1 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.951 0.158 18802 176 1 1 . 1 1 57 57 GLN C C 57 179.166 179.166 179.013 0.153 18802 177 1 1 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.953 0.437 18802 178 1 1 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.659 0.831 18802 179 1 1 . 1 1 57 57 GLN H H 57 8.046 8.046 7.721 0.325 18802 180 1 1 . 1 1 58 58 ILE N N 58 120.945 120.945 120.777 0.168 18802 181 1 1 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.537 -0.132 18802 182 1 1 . 1 1 58 58 ILE C C 58 179.368 179.368 177.841 1.527 18802 183 1 1 . 1 1 58 58 ILE CA C 58 67.066 67.066 66.029 1.036 18802 184 1 1 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.792 0.464 18802 185 1 1 . 1 1 58 58 ILE H H 58 8.778 8.778 8.659 0.119 18802 186 1 1 . 1 1 59 59 GLU N N 59 122.689 122.689 119.896 2.793 18802 187 1 1 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.909 0.138 18802 188 1 1 . 1 1 59 59 GLU C C 59 178.901 178.901 178.528 0.373 18802 189 1 1 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.525 0.339 18802 190 1 1 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.976 0.560 18802 191 1 1 . 1 1 59 59 GLU H H 59 8.305 8.305 8.476 -0.171 18802 192 1 1 . 1 1 60 60 ASP N N 60 121.505 121.505 121.157 0.348 18802 193 1 1 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.452 -0.015 18802 194 1 1 . 1 1 60 60 ASP C C 60 178.312 178.312 178.955 -0.643 18802 195 1 1 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.104 1.011 18802 196 1 1 . 1 1 60 60 ASP CB C 60 42.248 42.248 40.715 1.533 18802 197 1 1 . 1 1 60 60 ASP H H 60 8.142 8.142 8.210 -0.068 18802 198 1 1 . 1 1 61 61 LEU N N 61 118.666 118.666 120.951 -2.285 18802 199 1 1 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.910 0.015 18802 200 1 1 . 1 1 61 61 LEU C C 61 178.866 178.866 178.854 0.012 18802 201 1 1 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.303 -0.001 18802 202 1 1 . 1 1 61 61 LEU CB C 61 42.610 42.610 41.954 0.656 18802 203 1 1 . 1 1 61 61 LEU H H 61 8.425 8.425 8.607 -0.182 18802 204 1 1 . 1 1 62 62 THR N N 62 115.786 115.786 114.969 0.817 18802 205 1 1 . 1 1 62 62 THR HA H 62 3.771 3.771 3.919 -0.148 18802 206 1 1 . 1 1 62 62 THR C C 62 175.988 175.988 176.250 -0.262 18802 207 1 1 . 1 1 62 62 THR CA C 62 67.649 67.649 67.017 0.632 18802 208 1 1 . 1 1 62 62 THR CB C 62 68.848 68.848 68.513 0.335 18802 209 1 1 . 1 1 62 62 THR H H 62 8.340 8.340 8.263 0.077 18802 210 1 1 . 1 1 63 63 ARG N N 63 122.111 122.111 121.798 0.313 18802 211 1 1 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.953 0.036 18802 212 1 1 . 1 1 63 63 ARG C C 63 179.715 179.715 177.682 2.033 18802 213 1 1 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.803 0.283 18802 214 1 1 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.180 -0.369 18802 215 1 1 . 1 1 63 63 ARG H H 63 8.024 8.024 8.410 -0.386 18802 216 1 1 . 1 1 64 64 LYS N N 64 120.824 120.824 119.951 0.873 18802 217 1 1 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.068 -0.214 18802 218 1 1 . 1 1 64 64 LYS C C 64 178.707 178.707 179.185 -0.478 18802 219 1 1 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.555 1.000 18802 220 1 1 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.283 0.895 18802 221 1 1 . 1 1 64 64 LYS H H 64 8.130 8.130 7.595 0.535 18802 222 1 1 . 1 1 65 65 LEU N N 65 118.497 118.497 115.357 3.140 18802 223 1 1 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.120 -0.151 18802 224 1 1 . 1 1 65 65 LEU C C 65 179.023 179.023 178.323 0.700 18802 225 1 1 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.378 -0.097 18802 226 1 1 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.477 0.913 18802 227 1 1 . 1 1 65 65 LEU H H 65 8.108 8.108 7.688 0.420 18802 228 1 1 . 1 1 66 66 ARG N N 66 119.000 119.000 117.999 1.001 18802 229 1 1 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.155 0.059 18802 230 1 1 . 1 1 66 66 ARG C C 66 178.064 178.064 178.279 -0.215 18802 231 1 1 . 1 1 66 66 ARG CA C 66 58.224 58.224 58.450 -0.226 18802 232 1 1 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.618 0.005 18802 233 1 1 . 1 1 66 66 ARG H H 66 8.102 8.102 8.180 -0.078 18802 234 1 1 . 1 1 67 67 THR N N 67 109.849 109.849 109.593 0.256 18802 235 1 1 . 1 1 67 67 THR HA H 67 4.313 4.313 4.437 -0.124 18802 236 1 1 . 1 1 67 67 THR C C 67 175.834 175.834 175.291 0.543 18802 237 1 1 . 1 1 67 67 THR CA C 67 62.681 62.681 61.732 0.949 18802 238 1 1 . 1 1 67 67 THR CB C 67 70.768 70.768 70.026 0.742 18802 239 1 1 . 1 1 67 67 THR H H 67 7.956 7.956 8.105 -0.149 18802 240 1 1 . 1 1 68 68 GLY N N 68 110.673 110.673 110.913 -0.240 18802 241 1 1 . 1 1 68 68 GLY C C 68 173.968 173.968 173.545 0.423 18802 242 1 1 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.015 1.015 18802 243 1 1 . 1 1 68 68 GLY H H 68 8.016 8.016 7.991 0.025 18802 244 1 1 . 1 1 69 69 ASP N N 69 121.490 121.490 120.866 0.624 18802 245 1 1 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.790 -0.135 18802 246 1 1 . 1 1 69 69 ASP C C 69 175.983 175.983 176.103 -0.120 18802 247 1 1 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.799 0.056 18802 248 1 1 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.576 0.070 18802 249 1 1 . 1 1 69 69 ASP H H 69 8.048 8.048 7.859 0.189 18802 250 1 1 . 1 1 70 70 LEU N N 70 120.838 120.838 124.727 -3.889 18802 251 1 1 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.600 -0.461 18802 252 1 1 . 1 1 70 70 LEU C C 70 177.530 177.530 177.772 -0.242 18802 253 1 1 . 1 1 70 70 LEU CA C 70 55.280 55.280 54.266 1.014 18802 254 1 1 . 1 1 70 70 LEU CB C 70 42.136 42.136 43.076 -0.940 18802 255 1 1 . 1 1 70 70 LEU H H 70 7.988 7.988 7.715 0.273 18802 256 1 1 . 1 1 71 71 GLY N N 71 108.059 108.059 106.722 1.337 18802 257 1 1 . 1 1 71 71 GLY C C 71 173.936 173.936 174.616 -0.680 18802 258 1 1 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.731 -0.173 18802 259 1 1 . 1 1 71 71 GLY H H 71 8.341 8.341 8.392 -0.051 18802 260 1 1 . 1 1 72 72 ILE N N 72 121.037 121.037 120.776 0.261 18802 261 1 1 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.370 0.024 18802 262 1 1 . 1 1 72 72 ILE C C 72 174.227 174.227 174.325 -0.098 18802 263 1 1 . 1 1 72 72 ILE CA C 72 58.539 58.539 58.228 0.311 18802 264 1 1 . 1 1 72 72 ILE CB C 72 38.810 38.810 38.071 0.739 18802 265 1 1 . 1 1 72 72 ILE H H 72 7.793 7.793 7.718 0.075 18802 266 1 1 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.774 -0.152 18802 267 1 1 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.713 -0.073 18802 268 1 1 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.169 -0.065 18802 269 1 1 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.443 -0.071 18802 270 1 1 . 1 1 74 74 PRO C C 74 176.423 176.423 176.197 0.226 18802 271 1 1 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.500 0.541 18802 272 1 1 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.331 -0.301 18802 273 1 1 . 1 1 75 75 ASN N N 75 119.550 119.550 119.211 0.339 18802 274 1 1 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.707 0.222 18802 275 1 1 . 1 1 75 75 ASN C C 75 174.066 174.066 175.543 -1.477 18802 276 1 1 . 1 1 75 75 ASN CA C 75 51.151 51.151 51.562 -0.411 18802 277 1 1 . 1 1 75 75 ASN CB C 75 38.924 38.924 37.352 1.573 18802 278 1 1 . 1 1 75 75 ASN H H 75 8.422 8.422 8.409 0.013 18802 279 1 1 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.300 -0.007 18802 280 1 1 . 1 1 76 76 PRO C C 76 177.322 177.322 178.071 -0.749 18802 281 1 1 . 1 1 76 76 PRO CA C 76 64.384 64.384 64.805 -0.421 18802 282 1 1 . 1 1 76 76 PRO CB C 76 32.236 32.236 31.970 0.266 18802 283 1 1 . 1 1 77 77 GLU N N 77 118.523 118.523 117.434 1.089 18802 284 1 1 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.121 0.055 18802 285 1 1 . 1 1 77 77 GLU C C 77 176.403 176.403 178.260 -1.857 18802 286 1 1 . 1 1 77 77 GLU CA C 77 56.977 56.977 58.660 -1.683 18802 287 1 1 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.312 1.548 18802 288 1 1 . 1 1 77 77 GLU H H 77 8.426 8.426 8.780 -0.354 18802 289 1 1 . 1 1 78 78 ASP N N 78 120.581 120.581 119.099 1.482 18802 290 1 1 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.417 0.126 18802 291 1 1 . 1 1 78 78 ASP C C 78 176.085 176.085 176.804 -0.719 18802 292 1 1 . 1 1 78 78 ASP CA C 78 54.544 54.544 56.189 -1.645 18802 293 1 1 . 1 1 78 78 ASP CB C 78 41.239 41.239 41.041 0.198 18802 294 1 1 . 1 1 78 78 ASP H H 78 7.941 7.941 7.725 0.216 18802 295 1 1 . 1 1 79 79 ARG N N 79 121.043 121.043 117.691 3.352 18802 296 1 1 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.192 0.133 18802 297 1 1 . 1 1 79 79 ARG C C 79 176.123 176.123 177.169 -1.046 18802 298 1 1 . 1 1 79 79 ARG CA C 79 55.927 55.927 56.046 -0.119 18802 299 1 1 . 1 1 79 79 ARG CB C 79 30.650 30.650 28.992 1.658 18802 300 1 1 . 1 1 79 79 ARG H H 79 8.066 8.066 7.463 0.603 18802 301 1 1 . 1 1 80 80 SER N N 80 118.338 118.338 119.237 -0.899 18802 302 1 1 . 1 1 80 80 SER HA H 80 4.672 4.672 4.555 0.117 18802 303 1 1 . 1 1 80 80 SER C C 80 172.577 172.577 172.987 -0.410 18802 304 1 1 . 1 1 80 80 SER CA C 80 56.564 56.564 58.056 -1.492 18802 305 1 1 . 1 1 80 80 SER CB C 80 63.415 63.415 63.039 0.376 18802 306 1 1 . 1 1 80 80 SER H H 80 8.281 8.281 7.698 0.583 18802 307 1 1 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.395 0.025 18802 308 1 1 . 1 1 81 81 PRO C C 81 176.727 176.727 175.890 0.837 18802 309 1 1 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.986 -0.723 18802 310 1 1 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.101 -0.049 18802 311 1 1 . 1 1 82 82 SER N N 82 117.341 117.341 119.339 -1.998 18802 312 1 1 . 1 1 82 82 SER HA H 82 4.693 4.693 4.974 -0.281 18802 313 1 1 . 1 1 82 82 SER C C 82 172.803 172.803 172.523 0.280 18802 314 1 1 . 1 1 82 82 SER CA C 82 56.288 56.288 56.405 -0.117 18802 315 1 1 . 1 1 82 82 SER CB C 82 63.500 63.500 63.314 0.186 18802 316 1 1 . 1 1 82 82 SER H H 82 8.280 8.280 8.147 0.133 18802 317 1 1 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.539 -0.228 18802 318 1 1 . 1 1 83 83 PRO C C 83 176.273 176.273 176.107 0.166 18802 319 1 1 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.746 0.369 18802 320 1 1 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.252 -0.153 18802 321 1 1 . 1 1 84 84 GLU N N 84 122.213 122.213 121.492 0.721 18802 322 1 1 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.483 0.010 18802 323 1 1 . 1 1 84 84 GLU C C 84 174.546 174.546 175.076 -0.530 18802 324 1 1 . 1 1 84 84 GLU CA C 84 54.529 54.529 54.653 -0.124 18802 325 1 1 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.502 0.436 18802 326 1 1 . 1 1 84 84 GLU H H 84 8.230 8.230 8.351 -0.121 18802 327 1 1 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.220 0.195 18802 328 1 1 . 1 1 85 85 PRO C C 85 176.024 176.024 175.977 0.047 18802 329 1 1 . 1 1 85 85 PRO CA C 85 63.242 63.242 63.670 -0.428 18802 330 1 1 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.040 0.149 18802 331 1 1 . 1 1 86 86 ILE N N 86 120.281 120.281 121.534 -1.253 18802 332 1 1 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.254 -0.192 18802 333 1 1 . 1 1 86 86 ILE C C 86 175.419 175.419 175.074 0.345 18802 334 1 1 . 1 1 86 86 ILE CA C 86 61.029 61.029 61.163 -0.134 18802 335 1 1 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.614 -0.356 18802 336 1 1 . 1 1 86 86 ILE H H 86 7.980 7.980 8.066 -0.086 18802 337 1 1 . 1 1 87 87 TYR N N 87 123.089 123.089 123.631 -0.542 18802 338 1 1 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.710 0.107 18802 339 1 1 . 1 1 87 87 TYR C C 87 175.920 175.920 175.819 0.101 18802 340 1 1 . 1 1 87 87 TYR CA C 87 57.197 57.197 57.330 -0.133 18802 341 1 1 . 1 1 87 87 TYR CB C 87 40.178 40.178 40.043 0.135 18802 342 1 1 . 1 1 87 87 TYR H H 87 8.194 8.194 8.499 -0.305 18802 343 1 1 . 1 1 88 88 ASN N N 88 120.117 120.117 119.905 0.212 18802 344 1 1 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.889 -0.144 18802 345 1 1 . 1 1 88 88 ASN C C 88 176.275 176.275 176.797 -0.522 18802 346 1 1 . 1 1 88 88 ASN CA C 88 52.286 52.286 52.757 -0.471 18802 347 1 1 . 1 1 88 88 ASN CB C 88 39.082 39.082 39.329 -0.247 18802 348 1 1 . 1 1 88 88 ASN H H 88 8.386 8.386 8.950 -0.564 18802 349 1 1 . 1 1 89 89 SER N N 89 115.826 115.826 115.507 0.319 18802 350 1 1 . 1 1 89 89 SER HA H 89 4.248 4.248 4.283 -0.035 18802 351 1 1 . 1 1 89 89 SER C C 89 175.066 175.066 174.766 0.300 18802 352 1 1 . 1 1 89 89 SER CA C 89 60.012 60.012 60.930 -0.918 18802 353 1 1 . 1 1 89 89 SER CB C 89 63.400 63.400 63.094 0.306 18802 354 1 1 . 1 1 89 89 SER H H 89 8.371 8.371 8.867 -0.496 18802 355 1 1 . 1 1 90 90 GLU N N 90 121.062 121.062 119.368 1.694 18802 356 1 1 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.316 -0.038 18802 357 1 1 . 1 1 90 90 GLU C C 90 176.936 176.936 177.163 -0.227 18802 358 1 1 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.196 0.585 18802 359 1 1 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.046 1.017 18802 360 1 1 . 1 1 90 90 GLU H H 90 8.018 8.018 8.097 -0.079 18802 361 1 1 . 1 1 91 91 GLY N N 91 108.499 108.499 108.897 -0.398 18802 362 1 1 . 1 1 91 91 GLY C C 91 174.115 174.115 173.594 0.521 18802 363 1 1 . 1 1 91 91 GLY CA C 91 45.744 45.744 44.976 0.768 18802 364 1 1 . 1 1 91 91 GLY H H 91 8.199 8.199 7.837 0.362 18802 365 1 1 . 1 1 92 92 LYS N N 92 120.638 120.638 120.984 -0.346 18802 366 1 1 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.394 -0.085 18802 367 1 1 . 1 1 92 92 LYS C C 92 176.453 176.453 175.201 1.252 18802 368 1 1 . 1 1 92 92 LYS CA C 92 55.856 55.856 55.518 0.338 18802 369 1 1 . 1 1 92 92 LYS CB C 92 33.109 33.109 33.391 -0.282 18802 370 1 1 . 1 1 92 92 LYS H H 92 7.956 7.956 7.885 0.071 18802 371 1 1 . 1 1 93 93 ARG N N 93 122.999 122.999 125.982 -2.983 18802 372 1 1 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.308 -0.117 18802 373 1 1 . 1 1 93 93 ARG C C 93 176.325 176.325 175.031 1.294 18802 374 1 1 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.031 1.351 18802 375 1 1 . 1 1 93 93 ARG CB C 93 30.656 30.656 31.573 -0.917 18802 376 1 1 . 1 1 93 93 ARG H H 93 8.403 8.403 8.570 -0.167 18802 377 1 1 . 1 1 94 94 LEU N N 94 124.100 124.100 120.778 3.322 18802 378 1 1 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.627 -0.364 18802 379 1 1 . 1 1 94 94 LEU C C 94 176.993 176.993 174.796 2.197 18802 380 1 1 . 1 1 94 94 LEU CA C 94 55.034 55.034 52.905 2.129 18802 381 1 1 . 1 1 94 94 LEU CB C 94 42.941 42.941 44.425 -1.484 18802 382 1 1 . 1 1 94 94 LEU H H 94 8.283 8.283 8.121 0.162 18802 383 1 1 . 1 1 95 95 ASN N N 95 119.593 119.593 117.600 1.993 18802 384 1 1 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.882 -0.135 18802 385 1 1 . 1 1 95 95 ASN C C 95 175.598 175.598 174.536 1.062 18802 386 1 1 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.754 -1.074 18802 387 1 1 . 1 1 95 95 ASN CB C 95 38.723 38.723 39.309 -0.586 18802 388 1 1 . 1 1 95 95 ASN H H 95 8.460 8.460 8.192 0.268 18802 389 1 1 . 1 1 96 96 THR N N 96 114.100 114.100 116.241 -2.141 18802 390 1 1 . 1 1 96 96 THR HA H 96 4.226 4.226 4.417 -0.191 18802 391 1 1 . 1 1 96 96 THR C C 96 175.186 175.186 176.227 -1.041 18802 392 1 1 . 1 1 96 96 THR CA C 96 62.203 62.203 64.971 -2.768 18802 393 1 1 . 1 1 96 96 THR CB C 96 69.880 69.880 69.885 -0.005 18802 394 1 1 . 1 1 96 96 THR H H 96 8.031 8.031 8.507 -0.476 18802 395 1 1 . 1 1 97 97 ARG N N 97 122.587 122.587 119.957 2.630 18802 396 1 1 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.378 -0.265 18802 397 1 1 . 1 1 97 97 ARG C C 97 177.938 177.938 177.860 0.078 18802 398 1 1 . 1 1 97 97 ARG CA C 97 58.412 58.412 59.557 -1.145 18802 399 1 1 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.565 0.732 18802 400 1 1 . 1 1 97 97 ARG H H 97 8.502 8.502 8.397 0.105 18802 401 1 1 . 1 1 98 98 GLU N N 98 121.548 121.548 121.128 0.420 18802 402 1 1 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.162 -0.145 18802 403 1 1 . 1 1 98 98 GLU C C 98 177.113 177.113 178.763 -1.650 18802 404 1 1 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.607 -0.927 18802 405 1 1 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.782 0.884 18802 406 1 1 . 1 1 98 98 GLU H H 98 8.517 8.517 8.796 -0.279 18802 407 1 1 . 1 1 99 99 PHE N N 99 121.388 121.388 119.509 1.879 18802 408 1 1 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.321 0.001 18802 409 1 1 . 1 1 99 99 PHE C C 99 177.070 177.070 177.373 -0.303 18802 410 1 1 . 1 1 99 99 PHE CA C 99 60.075 60.075 60.816 -0.741 18802 411 1 1 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.133 0.353 18802 412 1 1 . 1 1 99 99 PHE H H 99 8.176 8.176 8.117 0.059 18802 413 1 1 . 1 1 100 100 ARG N N 100 120.211 120.211 119.774 0.437 18802 414 1 1 . 1 1 100 100 ARG C C 100 178.159 178.159 178.667 -0.508 18802 415 1 1 . 1 1 100 100 ARG CA C 100 58.533 58.533 59.986 -1.453 18802 416 1 1 . 1 1 100 100 ARG CB C 100 30.588 30.588 30.175 0.413 18802 417 1 1 . 1 1 100 100 ARG H H 100 8.377 8.377 8.081 0.296 18802 418 1 1 . 1 1 101 101 THR N N 101 115.416 115.416 116.196 -0.780 18802 419 1 1 . 1 1 101 101 THR HA H 101 4.022 4.022 4.045 -0.023 18802 420 1 1 . 1 1 101 101 THR C C 101 175.301 175.301 176.848 -1.547 18802 421 1 1 . 1 1 101 101 THR CA C 101 65.141 65.141 66.366 -1.225 18802 422 1 1 . 1 1 101 101 THR CB C 101 69.305 69.305 68.388 0.917 18802 423 1 1 . 1 1 101 101 THR H H 101 7.992 7.992 7.958 0.034 18802 424 1 1 . 1 1 102 102 ARG N N 102 122.212 122.212 120.907 1.305 18802 425 1 1 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.860 0.447 18802 426 1 1 . 1 1 102 102 ARG C C 102 177.644 177.644 178.471 -0.827 18802 427 1 1 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.900 0.711 18802 428 1 1 . 1 1 102 102 ARG CB C 102 29.808 29.808 29.933 -0.126 18802 429 1 1 . 1 1 102 102 ARG H H 102 8.369 8.369 8.420 -0.051 18802 430 1 1 . 1 1 103 103 LYS N N 103 117.591 117.591 119.803 -2.212 18802 431 1 1 . 1 1 103 103 LYS HA H 103 3.960 3.960 4.016 -0.056 18802 432 1 1 . 1 1 103 103 LYS C C 103 178.913 178.913 178.677 0.236 18802 433 1 1 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.248 0.802 18802 434 1 1 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.511 0.630 18802 435 1 1 . 1 1 103 103 LYS H H 103 7.941 7.941 8.277 -0.336 18802 436 1 1 . 1 1 104 104 LYS N N 104 119.769 119.769 119.825 -0.056 18802 437 1 1 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.060 0.086 18802 438 1 1 . 1 1 104 104 LYS C C 104 179.377 179.377 178.847 0.530 18802 439 1 1 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.682 0.297 18802 440 1 1 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.777 0.414 18802 441 1 1 . 1 1 104 104 LYS H H 104 7.615 7.615 7.569 0.046 18802 442 1 1 . 1 1 105 105 LEU N N 105 120.500 120.500 118.982 1.518 18802 443 1 1 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.942 0.175 18802 444 1 1 . 1 1 105 105 LEU C C 105 179.481 179.481 178.966 0.515 18802 445 1 1 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.130 0.131 18802 446 1 1 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.593 0.411 18802 447 1 1 . 1 1 105 105 LEU H H 105 8.057 8.057 7.919 0.138 18802 448 1 1 . 1 1 106 106 GLU N N 106 118.803 118.803 118.945 -0.142 18802 449 1 1 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.971 0.018 18802 450 1 1 . 1 1 106 106 GLU C C 106 180.577 180.577 179.202 1.375 18802 451 1 1 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.772 0.038 18802 452 1 1 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.227 0.782 18802 453 1 1 . 1 1 106 106 GLU H H 106 8.652 8.652 8.029 0.623 18802 454 1 1 . 1 1 107 107 GLU N N 107 122.396 122.396 119.018 3.378 18802 455 1 1 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.256 -0.150 18802 456 1 1 . 1 1 107 107 GLU C C 107 178.457 178.457 179.166 -0.709 18802 457 1 1 . 1 1 107 107 GLU CA C 107 59.826 59.826 59.179 0.647 18802 458 1 1 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.314 0.247 18802 459 1 1 . 1 1 107 107 GLU H H 107 8.281 8.281 8.272 0.009 18802 460 1 1 . 1 1 108 108 GLU N N 108 120.976 120.976 119.689 1.287 18802 461 1 1 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.055 0.037 18802 462 1 1 . 1 1 108 108 GLU C C 108 179.343 179.343 179.025 0.318 18802 463 1 1 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.169 0.527 18802 464 1 1 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.257 0.313 18802 465 1 1 . 1 1 108 108 GLU H H 108 8.321 8.321 8.064 0.257 18802 466 1 1 . 1 1 109 109 ARG N N 109 118.559 118.559 119.937 -1.378 18802 467 1 1 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.939 -0.147 18802 468 1 1 . 1 1 109 109 ARG C C 109 177.178 177.178 178.316 -1.138 18802 469 1 1 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.718 0.765 18802 470 1 1 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.291 -0.142 18802 471 1 1 . 1 1 109 109 ARG H H 109 8.594 8.594 8.260 0.334 18802 472 1 1 . 1 1 110 110 HIS N N 110 119.632 119.632 118.479 1.153 18802 473 1 1 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.297 0.044 18802 474 1 1 . 1 1 110 110 HIS C C 110 177.578 177.578 177.198 0.380 18802 475 1 1 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.267 1.350 18802 476 1 1 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.107 0.402 18802 477 1 1 . 1 1 110 110 HIS H H 110 8.465 8.465 8.661 -0.196 18802 478 1 1 . 1 1 111 111 ASN N N 111 119.587 119.587 118.449 1.138 18802 479 1 1 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.297 -0.019 18802 480 1 1 . 1 1 111 111 ASN C C 111 178.630 178.630 177.858 0.772 18802 481 1 1 . 1 1 111 111 ASN CA C 111 56.281 56.281 56.421 -0.140 18802 482 1 1 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.328 -0.633 18802 483 1 1 . 1 1 111 111 ASN H H 111 8.323 8.323 8.217 0.106 18802 484 1 1 . 1 1 112 112 LEU N N 112 122.320 122.320 120.367 1.953 18802 485 1 1 . 1 1 112 112 LEU HA H 112 4.116 4.116 4.010 0.106 18802 486 1 1 . 1 1 112 112 LEU C C 112 178.539 178.539 178.758 -0.219 18802 487 1 1 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.742 0.236 18802 488 1 1 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.748 0.846 18802 489 1 1 . 1 1 112 112 LEU H H 112 7.966 7.966 7.599 0.367 18802 490 1 1 . 1 1 113 113 ILE N N 113 121.495 121.495 120.850 0.645 18802 491 1 1 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.743 -0.507 18802 492 1 1 . 1 1 113 113 ILE C C 113 176.959 176.959 178.524 -1.565 18802 493 1 1 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.675 1.379 18802 494 1 1 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.170 1.433 18802 495 1 1 . 1 1 113 113 ILE H H 113 8.472 8.472 8.672 -0.200 18802 496 1 1 . 1 1 114 114 THR N N 114 115.066 115.066 115.591 -0.525 18802 497 1 1 . 1 1 114 114 THR HA H 114 3.718 3.718 4.024 -0.306 18802 498 1 1 . 1 1 114 114 THR C C 114 176.559 176.559 176.802 -0.243 18802 499 1 1 . 1 1 114 114 THR CA C 114 66.700 66.700 67.278 -0.579 18802 500 1 1 . 1 1 114 114 THR CB C 114 68.759 68.759 68.108 0.651 18802 501 1 1 . 1 1 114 114 THR H H 114 8.075 8.075 8.435 -0.360 18802 502 1 1 . 1 1 115 115 GLU N N 115 123.259 123.259 122.262 0.997 18802 503 1 1 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.058 -0.126 18802 504 1 1 . 1 1 115 115 GLU C C 115 178.191 178.191 178.581 -0.390 18802 505 1 1 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.259 0.081 18802 506 1 1 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.431 -0.032 18802 507 1 1 . 1 1 115 115 GLU H H 115 7.368 7.368 7.515 -0.147 18802 508 1 1 . 1 1 116 116 MET N N 116 119.844 119.844 119.944 -0.100 18802 509 1 1 . 1 1 116 116 MET HA H 116 4.014 4.014 3.962 0.052 18802 510 1 1 . 1 1 116 116 MET C C 116 177.888 177.888 178.157 -0.269 18802 511 1 1 . 1 1 116 116 MET CA C 116 57.183 57.183 59.235 -2.052 18802 512 1 1 . 1 1 116 116 MET CB C 116 32.126 32.126 32.469 -0.343 18802 513 1 1 . 1 1 116 116 MET H H 116 8.373 8.373 8.537 -0.164 18802 514 1 1 . 1 1 117 117 VAL N N 117 117.572 117.572 119.902 -2.330 18802 515 1 1 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.212 -0.316 18802 516 1 1 . 1 1 117 117 VAL C C 117 177.567 177.567 178.205 -0.638 18802 517 1 1 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.153 -1.283 18802 518 1 1 . 1 1 117 117 VAL CB C 117 32.002 32.002 30.992 1.010 18802 519 1 1 . 1 1 117 117 VAL H H 117 8.279 8.279 8.671 -0.392 18802 520 1 1 . 1 1 118 118 ALA N N 118 120.560 120.560 121.932 -1.372 18802 521 1 1 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.151 -0.015 18802 522 1 1 . 1 1 118 118 ALA C C 118 179.595 179.595 179.573 0.022 18802 523 1 1 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.881 -0.778 18802 524 1 1 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.672 -0.422 18802 525 1 1 . 1 1 118 118 ALA H H 118 7.074 7.074 7.532 -0.458 18802 526 1 1 . 1 1 119 119 LEU N N 119 117.987 117.987 116.919 1.068 18802 527 1 1 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.135 0.005 18802 528 1 1 . 1 1 119 119 LEU C C 119 177.863 177.863 177.025 0.838 18802 529 1 1 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.648 0.024 18802 530 1 1 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.755 0.479 18802 531 1 1 . 1 1 119 119 LEU H H 119 7.525 7.525 7.899 -0.374 18802 532 1 1 . 1 1 120 120 ASN N N 120 115.338 115.338 115.778 -0.440 18802 533 1 1 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.141 -0.123 18802 534 1 1 . 1 1 120 120 ASN C C 120 172.510 172.510 173.871 -1.361 18802 535 1 1 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.262 -0.161 18802 536 1 1 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.692 -1.387 18802 537 1 1 . 1 1 120 120 ASN H H 120 8.467 8.467 8.060 0.407 18802 538 1 1 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.583 0.073 18802 539 1 1 . 1 1 121 121 PRO C C 121 177.020 177.020 176.908 0.112 18802 540 1 1 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.596 -0.298 18802 541 1 1 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.356 -0.057 18802 542 1 1 . 1 1 122 122 ASP N N 122 115.744 115.744 117.625 -1.881 18802 543 1 1 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.666 0.003 18802 544 1 1 . 1 1 122 122 ASP C C 122 176.004 176.004 176.127 -0.123 18802 545 1 1 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.697 0.669 18802 546 1 1 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.594 -0.270 18802 547 1 1 . 1 1 122 122 ASP H H 122 7.600 7.600 8.001 -0.401 18802 548 1 1 . 1 1 123 123 PHE N N 123 122.722 122.722 121.674 1.048 18802 549 1 1 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.414 -0.279 18802 550 1 1 . 1 1 123 123 PHE C C 123 173.954 173.954 174.087 -0.133 18802 551 1 1 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.763 0.230 18802 552 1 1 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.681 -0.085 18802 553 1 1 . 1 1 123 123 PHE H H 123 7.940 7.940 7.442 0.498 18802 554 1 1 . 1 1 124 124 LYS N N 124 129.400 129.400 128.597 0.803 18802 555 1 1 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.400 0.159 18802 556 1 1 . 1 1 124 124 LYS C C 124 172.622 172.622 173.873 -1.251 18802 557 1 1 . 1 1 124 124 LYS CA C 124 51.815 51.815 51.989 -0.174 18802 558 1 1 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.898 0.683 18802 559 1 1 . 1 1 124 124 LYS H H 124 7.602 7.602 8.303 -0.701 18802 560 1 1 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.137 -0.048 18802 561 1 1 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.234 -0.239 18802 562 1 1 . 1 1 125 125 PRO CB C 125 31.067 31.067 30.880 0.187 18802 563 1 1 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.337 0.037 18802 564 1 1 . 1 1 126 126 PRO C C 126 177.630 177.630 177.596 0.034 18802 565 1 1 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.981 -0.168 18802 566 1 1 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.216 0.105 18802 567 1 1 . 1 1 127 127 ALA N N 127 123.830 123.830 123.763 0.067 18802 568 1 1 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.089 -0.031 18802 569 1 1 . 1 1 127 127 ALA C C 127 177.641 177.641 178.680 -1.039 18802 570 1 1 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.592 0.010 18802 571 1 1 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.745 0.104 18802 572 1 1 . 1 1 127 127 ALA H H 127 8.630 8.630 8.567 0.063 18802 573 1 1 . 1 1 128 128 ASP N N 128 112.924 112.924 114.267 -1.343 18802 574 1 1 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.500 -0.049 18802 575 1 1 . 1 1 128 128 ASP C C 128 175.724 175.724 176.158 -0.434 18802 576 1 1 . 1 1 128 128 ASP CA C 128 53.604 53.604 54.621 -1.017 18802 577 1 1 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.486 -0.068 18802 578 1 1 . 1 1 128 128 ASP H H 128 8.335 8.335 8.662 -0.327 18802 579 1 1 . 1 1 129 129 TYR N N 129 121.114 121.114 122.612 -1.498 18802 580 1 1 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.293 0.069 18802 581 1 1 . 1 1 129 129 TYR C C 129 174.190 174.190 174.361 -0.171 18802 582 1 1 . 1 1 129 129 TYR CA C 129 58.412 58.412 59.584 -1.173 18802 583 1 1 . 1 1 129 129 TYR CB C 129 39.059 39.059 39.227 -0.168 18802 584 1 1 . 1 1 129 129 TYR H H 129 7.600 7.600 7.399 0.201 18802 585 1 1 . 1 1 130 130 LYS N N 130 129.875 129.875 126.400 3.475 18802 586 1 1 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.440 -0.122 18802 587 1 1 . 1 1 130 130 LYS C C 130 172.314 172.314 173.575 -1.261 18802 588 1 1 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.806 0.764 18802 589 1 1 . 1 1 130 130 LYS CB C 130 33.663 33.663 33.749 -0.086 18802 590 1 1 . 1 1 130 130 LYS H H 130 7.695 7.695 7.586 0.109 18802 591 1 1 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.413 -0.136 18802 592 1 1 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.629 -0.571 18802 593 1 1 . 1 1 131 131 PRO CB C 131 30.852 30.852 31.308 -0.456 18802 594 1 1 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.333 -0.089 18802 595 1 1 . 1 1 132 132 PRO C C 132 176.459 176.459 175.849 0.610 18802 596 1 1 . 1 1 132 132 PRO CA C 132 62.874 62.874 63.148 -0.274 18802 597 1 1 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.168 -0.121 18802 598 1 1 . 1 1 133 133 ALA N N 133 124.170 124.170 126.012 -1.842 18802 599 1 1 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.644 -0.394 18802 600 1 1 . 1 1 133 133 ALA C C 133 177.870 177.870 177.456 0.414 18802 601 1 1 . 1 1 133 133 ALA CA C 133 52.508 52.508 51.476 1.032 18802 602 1 1 . 1 1 133 133 ALA CB C 133 19.303 19.303 21.027 -1.724 18802 603 1 1 . 1 1 133 133 ALA H H 133 8.311 8.311 7.811 0.500 18802 604 1 1 . 1 1 134 134 THR N N 134 113.807 113.807 115.373 -1.566 18802 605 1 1 . 1 1 134 134 THR HA H 134 4.228 4.228 4.238 -0.010 18802 606 1 1 . 1 1 134 134 THR C C 134 174.282 174.282 175.566 -1.284 18802 607 1 1 . 1 1 134 134 THR CA C 134 62.127 62.127 62.981 -0.854 18802 608 1 1 . 1 1 134 134 THR CB C 134 69.870 69.870 68.927 0.943 18802 609 1 1 . 1 1 134 134 THR H H 134 8.019 8.019 8.375 -0.356 18802 610 1 1 . 1 1 135 135 ARG N N 135 124.165 124.165 121.250 2.915 18802 611 1 1 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.231 0.118 18802 612 1 1 . 1 1 135 135 ARG C C 135 176.217 176.217 175.998 0.219 18802 613 1 1 . 1 1 135 135 ARG CA C 135 55.993 55.993 57.409 -1.416 18802 614 1 1 . 1 1 135 135 ARG CB C 135 30.992 30.992 30.457 0.535 18802 615 1 1 . 1 1 135 135 ARG H H 135 8.300 8.300 7.865 0.435 18802 616 1 1 . 1 1 136 136 VAL N N 136 122.157 122.157 116.635 5.522 18802 617 1 1 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.307 -0.237 18802 618 1 1 . 1 1 136 136 VAL C C 136 176.180 176.180 174.504 1.676 18802 619 1 1 . 1 1 136 136 VAL CA C 136 61.937 61.937 62.484 -0.547 18802 620 1 1 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.802 -0.055 18802 621 1 1 . 1 1 136 136 VAL H H 136 8.233 8.233 7.524 0.709 18802 622 1 1 . 1 1 137 137 SER N N 137 118.837 118.837 118.611 0.226 18802 623 1 1 . 1 1 137 137 SER HA H 137 4.416 4.416 4.700 -0.284 18802 624 1 1 . 1 1 137 137 SER C C 137 174.258 174.258 174.233 0.025 18802 625 1 1 . 1 1 137 137 SER CA C 137 58.341 58.341 58.223 0.118 18802 626 1 1 . 1 1 137 137 SER CB C 137 63.900 63.900 64.302 -0.402 18802 627 1 1 . 1 1 137 137 SER H H 137 8.264 8.264 8.628 -0.364 18802 628 1 1 . 1 1 138 138 ASP N N 138 122.871 122.871 119.572 3.299 18802 629 1 1 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.516 0.021 18802 630 1 1 . 1 1 138 138 ASP C C 138 176.053 176.053 176.388 -0.335 18802 631 1 1 . 1 1 138 138 ASP CA C 138 54.489 54.489 55.193 -0.704 18802 632 1 1 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.205 -0.057 18802 633 1 1 . 1 1 138 138 ASP H H 138 8.249 8.249 8.344 -0.095 18802 634 1 1 . 1 1 139 139 LYS N N 139 120.944 120.944 119.137 1.807 18802 635 1 1 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.516 -0.256 18802 636 1 1 . 1 1 139 139 LYS C C 139 176.343 176.343 175.432 0.911 18802 637 1 1 . 1 1 139 139 LYS CA C 139 56.261 56.261 54.589 1.672 18802 638 1 1 . 1 1 139 139 LYS CB C 139 33.077 33.077 34.298 -1.221 18802 639 1 1 . 1 1 139 139 LYS H H 139 8.084 8.084 7.660 0.424 18802 640 1 1 . 1 1 140 140 VAL N N 140 121.670 121.670 121.586 0.084 18802 641 1 1 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.210 -0.198 18802 642 1 1 . 1 1 140 140 VAL C C 140 175.842 175.842 175.235 0.607 18802 643 1 1 . 1 1 140 140 VAL CA C 140 62.442 62.442 62.261 0.181 18802 644 1 1 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.357 0.510 18802 645 1 1 . 1 1 140 140 VAL H H 140 8.025 8.025 8.327 -0.302 18802 646 1 1 . 1 1 141 141 MET N N 141 124.839 124.839 128.969 -4.130 18802 647 1 1 . 1 1 141 141 MET HA H 141 4.453 4.453 4.768 -0.315 18802 648 1 1 . 1 1 141 141 MET C C 141 175.562 175.562 175.278 0.284 18802 649 1 1 . 1 1 141 141 MET CA C 141 55.349 55.349 54.993 0.356 18802 650 1 1 . 1 1 141 141 MET CB C 141 32.993 32.993 32.360 0.633 18802 651 1 1 . 1 1 141 141 MET H H 141 8.364 8.364 8.627 -0.263 18802 652 1 1 . 1 1 142 142 ILE N N 142 124.515 124.515 128.972 -4.457 18802 653 1 1 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.558 -0.130 18802 654 1 1 . 1 1 142 142 ILE C C 142 174.331 174.331 174.284 0.047 18802 655 1 1 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.356 0.048 18802 656 1 1 . 1 1 142 142 ILE CB C 142 38.755 38.755 39.191 -0.437 18802 657 1 1 . 1 1 142 142 ILE H H 142 8.093 8.093 8.418 -0.325 18802 658 1 1 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.419 -0.069 18802 659 1 1 . 1 1 143 143 PRO C C 143 176.623 176.623 175.530 1.093 18802 660 1 1 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.720 0.695 18802 661 1 1 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.191 0.042 18802 662 1 1 . 1 1 144 144 GLN N N 144 121.557 121.557 121.529 0.028 18802 663 1 1 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.594 -0.288 18802 664 1 1 . 1 1 144 144 GLN C C 144 174.751 174.751 174.436 0.315 18802 665 1 1 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.050 0.621 18802 666 1 1 . 1 1 144 144 GLN CB C 144 30.118 30.118 30.772 -0.654 18802 667 1 1 . 1 1 144 144 GLN H H 144 8.392 8.392 8.312 0.080 18802 668 1 2 . 1 1 26 26 ALA N N 26 124.085 124.085 121.974 2.111 18802 669 1 2 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.606 -0.314 18802 670 1 2 . 1 1 26 26 ALA C C 26 177.101 177.101 178.229 -1.128 18802 671 1 2 . 1 1 26 26 ALA CA C 26 52.921 52.921 52.930 -0.009 18802 672 1 2 . 1 1 26 26 ALA CB C 26 19.426 19.426 19.537 -0.111 18802 673 1 2 . 1 1 26 26 ALA H H 26 8.498 8.498 8.165 0.333 18802 674 1 2 . 1 1 27 27 MET N N 27 119.630 119.630 121.308 -1.678 18802 675 1 2 . 1 1 27 27 MET HA H 27 4.391 4.391 4.633 -0.242 18802 676 1 2 . 1 1 27 27 MET C C 27 176.296 176.296 175.073 1.223 18802 677 1 2 . 1 1 27 27 MET CA C 27 55.834 55.834 53.828 2.006 18802 678 1 2 . 1 1 27 27 MET CB C 27 32.663 32.663 30.619 2.044 18802 679 1 2 . 1 1 27 27 MET H H 27 8.441 8.441 7.939 0.502 18802 680 1 2 . 1 1 28 28 GLU N N 28 122.376 122.376 123.594 -1.218 18802 681 1 2 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.552 -0.338 18802 682 1 2 . 1 1 28 28 GLU C C 28 176.310 176.310 176.422 -0.112 18802 683 1 2 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.057 0.762 18802 684 1 2 . 1 1 28 28 GLU CB C 28 30.252 30.252 28.929 1.323 18802 685 1 2 . 1 1 28 28 GLU H H 28 8.336 8.336 8.300 0.036 18802 686 1 2 . 1 1 29 29 GLN N N 29 122.010 122.010 123.002 -0.992 18802 687 1 2 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.401 -0.110 18802 688 1 2 . 1 1 29 29 GLN C C 29 175.765 175.765 176.071 -0.306 18802 689 1 2 . 1 1 29 29 GLN CA C 29 55.839 55.839 55.971 -0.132 18802 690 1 2 . 1 1 29 29 GLN CB C 29 29.559 29.559 29.596 -0.037 18802 691 1 2 . 1 1 29 29 GLN H H 29 8.347 8.347 8.549 -0.202 18802 692 1 2 . 1 1 30 30 LYS N N 30 123.090 123.090 122.133 0.957 18802 693 1 2 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.179 0.157 18802 694 1 2 . 1 1 30 30 LYS C C 30 176.474 176.474 175.837 0.637 18802 695 1 2 . 1 1 30 30 LYS CA C 30 56.391 56.391 56.287 0.104 18802 696 1 2 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.433 0.560 18802 697 1 2 . 1 1 30 30 LYS H H 30 8.327 8.327 7.949 0.378 18802 698 1 2 . 1 1 31 31 THR N N 31 116.800 116.800 120.240 -3.440 18802 699 1 2 . 1 1 31 31 THR HA H 31 4.273 4.273 4.272 0.001 18802 700 1 2 . 1 1 31 31 THR C C 31 174.071 174.071 173.903 0.168 18802 701 1 2 . 1 1 31 31 THR CA C 31 62.103 62.103 62.270 -0.167 18802 702 1 2 . 1 1 31 31 THR CB C 31 69.899 69.899 69.575 0.324 18802 703 1 2 . 1 1 31 31 THR H H 31 8.160 8.160 8.379 -0.219 18802 704 1 2 . 1 1 32 32 VAL N N 32 124.108 124.108 126.709 -2.601 18802 705 1 2 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.245 -0.179 18802 706 1 2 . 1 1 32 32 VAL C C 32 175.573 175.573 174.661 0.912 18802 707 1 2 . 1 1 32 32 VAL CA C 32 62.344 62.344 61.761 0.583 18802 708 1 2 . 1 1 32 32 VAL CB C 32 32.912 32.912 32.512 0.400 18802 709 1 2 . 1 1 32 32 VAL H H 32 8.192 8.192 8.568 -0.376 18802 710 1 2 . 1 1 33 33 ILE N N 33 127.371 127.371 131.009 -3.638 18802 711 1 2 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.523 -0.099 18802 712 1 2 . 1 1 33 33 ILE C C 33 174.335 174.335 174.199 0.136 18802 713 1 2 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.444 0.950 18802 714 1 2 . 1 1 33 33 ILE CB C 33 38.799 38.799 38.574 0.225 18802 715 1 2 . 1 1 33 33 ILE H H 33 8.275 8.275 8.318 -0.043 18802 716 1 2 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.535 -0.232 18802 717 1 2 . 1 1 34 34 PRO C C 34 177.261 177.261 177.951 -0.690 18802 718 1 2 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.174 0.498 18802 719 1 2 . 1 1 34 34 PRO CB C 34 32.177 32.177 32.199 -0.022 18802 720 1 2 . 1 1 35 35 GLY N N 35 109.540 109.540 110.729 -1.189 18802 721 1 2 . 1 1 35 35 GLY C C 35 173.906 173.906 174.339 -0.433 18802 722 1 2 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.816 0.454 18802 723 1 2 . 1 1 35 35 GLY H H 35 8.376 8.376 8.535 -0.159 18802 724 1 2 . 1 1 36 36 MET N N 36 120.834 120.834 121.085 -0.251 18802 725 1 2 . 1 1 36 36 MET HA H 36 4.780 4.780 4.829 -0.049 18802 726 1 2 . 1 1 36 36 MET C C 36 174.235 174.235 174.204 0.031 18802 727 1 2 . 1 1 36 36 MET CA C 36 53.258 53.258 52.083 1.175 18802 728 1 2 . 1 1 36 36 MET CB C 36 32.734 32.734 32.589 0.145 18802 729 1 2 . 1 1 36 36 MET H H 36 7.986 7.986 7.765 0.221 18802 730 1 2 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.543 -0.081 18802 731 1 2 . 1 1 37 37 PRO C C 37 176.736 176.736 176.172 0.564 18802 732 1 2 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.911 0.347 18802 733 1 2 . 1 1 37 37 PRO CB C 37 32.200 32.200 31.876 0.324 18802 734 1 2 . 1 1 38 38 THR N N 38 115.642 115.642 114.407 1.235 18802 735 1 2 . 1 1 38 38 THR HA H 38 4.226 4.226 4.573 -0.347 18802 736 1 2 . 1 1 38 38 THR C C 38 174.164 174.164 174.371 -0.207 18802 737 1 2 . 1 1 38 38 THR CA C 38 62.462 62.462 61.291 1.171 18802 738 1 2 . 1 1 38 38 THR CB C 38 69.874 69.874 69.128 0.746 18802 739 1 2 . 1 1 38 38 THR H H 38 8.189 8.189 8.164 0.025 18802 740 1 2 . 1 1 39 39 VAL N N 39 123.700 123.700 125.444 -1.744 18802 741 1 2 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.331 -0.252 18802 742 1 2 . 1 1 39 39 VAL C C 39 175.177 175.177 175.036 0.141 18802 743 1 2 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.265 0.726 18802 744 1 2 . 1 1 39 39 VAL CB C 39 32.898 32.898 33.156 -0.258 18802 745 1 2 . 1 1 39 39 VAL H H 39 8.036 8.036 8.569 -0.533 18802 746 1 2 . 1 1 40 40 ILE N N 40 127.780 127.780 127.961 -0.181 18802 747 1 2 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.144 0.033 18802 748 1 2 . 1 1 40 40 ILE C C 40 173.894 173.894 174.818 -0.924 18802 749 1 2 . 1 1 40 40 ILE CA C 40 57.911 57.911 58.965 -1.054 18802 750 1 2 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.717 0.916 18802 751 1 2 . 1 1 40 40 ILE H H 40 8.236 8.236 8.379 -0.143 18802 752 1 2 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.685 -0.194 18802 753 1 2 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.166 0.458 18802 754 1 2 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.085 0.017 18802 755 1 2 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.419 -0.164 18802 756 1 2 . 1 1 42 42 PRO C C 42 177.721 177.721 178.171 -0.450 18802 757 1 2 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.053 -0.253 18802 758 1 2 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.957 0.398 18802 759 1 2 . 1 1 43 43 GLY N N 43 107.305 107.305 108.202 -0.897 18802 760 1 2 . 1 1 43 43 GLY C C 43 174.642 174.642 174.139 0.503 18802 761 1 2 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.796 0.922 18802 762 1 2 . 1 1 43 43 GLY H H 43 8.321 8.321 8.573 -0.253 18802 763 1 2 . 1 1 44 44 LEU N N 44 120.897 120.897 122.106 -1.209 18802 764 1 2 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.470 0.059 18802 765 1 2 . 1 1 44 44 LEU C C 44 178.580 178.580 176.445 2.135 18802 766 1 2 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.301 0.249 18802 767 1 2 . 1 1 44 44 LEU CB C 44 42.579 42.579 42.894 -0.315 18802 768 1 2 . 1 1 44 44 LEU H H 44 8.043 8.043 7.713 0.330 18802 769 1 2 . 1 1 45 45 THR N N 45 113.195 113.195 111.458 1.737 18802 770 1 2 . 1 1 45 45 THR HA H 45 4.386 4.386 4.559 -0.173 18802 771 1 2 . 1 1 45 45 THR C C 45 175.377 175.377 175.417 -0.040 18802 772 1 2 . 1 1 45 45 THR CA C 45 61.188 61.188 60.012 1.176 18802 773 1 2 . 1 1 45 45 THR CB C 45 71.043 71.043 71.042 0.001 18802 774 1 2 . 1 1 45 45 THR H H 45 8.427 8.427 7.990 0.437 18802 775 1 2 . 1 1 46 46 ARG N N 46 121.322 121.322 121.909 -0.587 18802 776 1 2 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.075 -0.038 18802 777 1 2 . 1 1 46 46 ARG C C 46 179.309 179.309 178.228 1.081 18802 778 1 2 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.218 0.166 18802 779 1 2 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.196 0.620 18802 780 1 2 . 1 1 46 46 ARG H H 46 8.832 8.832 8.859 -0.027 18802 781 1 2 . 1 1 47 47 GLU N N 47 119.109 119.109 119.474 -0.365 18802 782 1 2 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.129 -0.120 18802 783 1 2 . 1 1 47 47 GLU C C 47 178.931 178.931 179.063 -0.132 18802 784 1 2 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.779 0.497 18802 785 1 2 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.695 0.596 18802 786 1 2 . 1 1 47 47 GLU H H 47 8.754 8.754 8.579 0.175 18802 787 1 2 . 1 1 48 48 GLN N N 48 119.556 119.556 119.893 -0.337 18802 788 1 2 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.050 0.016 18802 789 1 2 . 1 1 48 48 GLN C C 48 179.286 179.286 178.263 1.023 18802 790 1 2 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.666 -0.451 18802 791 1 2 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.398 1.268 18802 792 1 2 . 1 1 48 48 GLN H H 48 7.711 7.711 8.149 -0.438 18802 793 1 2 . 1 1 49 49 GLU N N 49 122.227 122.227 120.853 1.374 18802 794 1 2 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.957 -0.084 18802 795 1 2 . 1 1 49 49 GLU C C 49 177.879 177.879 179.112 -1.233 18802 796 1 2 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.957 0.001 18802 797 1 2 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.514 0.265 18802 798 1 2 . 1 1 49 49 GLU H H 49 8.730 8.730 8.651 0.079 18802 799 1 2 . 1 1 50 50 ARG N N 50 119.109 119.109 118.736 0.373 18802 800 1 2 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.101 -0.032 18802 801 1 2 . 1 1 50 50 ARG C C 50 177.567 177.567 178.615 -1.048 18802 802 1 2 . 1 1 50 50 ARG CA C 50 58.226 58.226 57.932 0.294 18802 803 1 2 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.278 -0.182 18802 804 1 2 . 1 1 50 50 ARG H H 50 7.906 7.906 8.137 -0.231 18802 805 1 2 . 1 1 51 51 ALA N N 51 119.411 119.411 123.274 -3.863 18802 806 1 2 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.863 -0.059 18802 807 1 2 . 1 1 51 51 ALA C C 51 178.740 178.740 178.952 -0.212 18802 808 1 2 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.054 0.181 18802 809 1 2 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.260 -0.001 18802 810 1 2 . 1 1 51 51 ALA H H 51 7.956 7.956 8.449 -0.493 18802 811 1 2 . 1 1 52 52 TYR N N 52 119.160 119.160 120.292 -1.132 18802 812 1 2 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.219 -0.161 18802 813 1 2 . 1 1 52 52 TYR C C 52 177.367 177.367 177.682 -0.315 18802 814 1 2 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.017 0.588 18802 815 1 2 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.571 0.138 18802 816 1 2 . 1 1 52 52 TYR H H 52 7.854 7.854 7.931 -0.077 18802 817 1 2 . 1 1 53 53 ILE N N 53 119.173 119.173 119.405 -0.232 18802 818 1 2 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.300 0.302 18802 819 1 2 . 1 1 53 53 ILE C C 53 178.711 178.711 178.010 0.701 18802 820 1 2 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.443 -1.255 18802 821 1 2 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.975 0.339 18802 822 1 2 . 1 1 53 53 ILE H H 53 7.809 7.809 8.328 -0.519 18802 823 1 2 . 1 1 54 54 VAL N N 54 121.549 121.549 120.166 1.383 18802 824 1 2 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.911 -0.437 18802 825 1 2 . 1 1 54 54 VAL C C 54 177.992 177.992 178.381 -0.389 18802 826 1 2 . 1 1 54 54 VAL CA C 54 66.995 66.995 65.429 1.566 18802 827 1 2 . 1 1 54 54 VAL CB C 54 31.231 31.231 30.777 0.454 18802 828 1 2 . 1 1 54 54 VAL H H 54 8.572 8.572 8.535 0.037 18802 829 1 2 . 1 1 55 55 GLN N N 55 119.997 119.997 120.482 -0.485 18802 830 1 2 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.883 -0.182 18802 831 1 2 . 1 1 55 55 GLN C C 55 178.604 178.604 178.562 0.042 18802 832 1 2 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.267 0.928 18802 833 1 2 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.518 -0.376 18802 834 1 2 . 1 1 55 55 GLN H H 55 8.183 8.183 8.020 0.163 18802 835 1 2 . 1 1 56 56 LEU N N 56 119.605 119.605 118.854 0.751 18802 836 1 2 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.840 0.106 18802 837 1 2 . 1 1 56 56 LEU C C 56 180.439 180.439 179.338 1.101 18802 838 1 2 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.574 0.661 18802 839 1 2 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.407 0.441 18802 840 1 2 . 1 1 56 56 LEU H H 56 7.586 7.586 7.558 0.028 18802 841 1 2 . 1 1 57 57 GLN N N 57 120.332 120.332 118.714 1.618 18802 842 1 2 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.963 0.146 18802 843 1 2 . 1 1 57 57 GLN C C 57 179.166 179.166 178.705 0.461 18802 844 1 2 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.840 0.550 18802 845 1 2 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.662 0.828 18802 846 1 2 . 1 1 57 57 GLN H H 57 8.046 8.046 7.381 0.665 18802 847 1 2 . 1 1 58 58 ILE N N 58 120.945 120.945 120.813 0.132 18802 848 1 2 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.536 -0.131 18802 849 1 2 . 1 1 58 58 ILE C C 58 179.368 179.368 177.982 1.386 18802 850 1 2 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.890 1.176 18802 851 1 2 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.793 0.463 18802 852 1 2 . 1 1 58 58 ILE H H 58 8.778 8.778 8.468 0.310 18802 853 1 2 . 1 1 59 59 GLU N N 59 122.689 122.689 119.015 3.674 18802 854 1 2 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.952 0.095 18802 855 1 2 . 1 1 59 59 GLU C C 59 178.901 178.901 178.717 0.184 18802 856 1 2 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.497 0.367 18802 857 1 2 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.959 0.577 18802 858 1 2 . 1 1 59 59 GLU H H 59 8.305 8.305 8.693 -0.388 18802 859 1 2 . 1 1 60 60 ASP N N 60 121.505 121.505 121.477 0.028 18802 860 1 2 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.378 0.059 18802 861 1 2 . 1 1 60 60 ASP C C 60 178.312 178.312 178.655 -0.343 18802 862 1 2 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.307 0.808 18802 863 1 2 . 1 1 60 60 ASP CB C 60 42.248 42.248 41.113 1.135 18802 864 1 2 . 1 1 60 60 ASP H H 60 8.142 8.142 7.809 0.333 18802 865 1 2 . 1 1 61 61 LEU N N 61 118.666 118.666 119.820 -1.154 18802 866 1 2 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.912 0.013 18802 867 1 2 . 1 1 61 61 LEU C C 61 178.866 178.866 179.088 -0.222 18802 868 1 2 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.299 0.003 18802 869 1 2 . 1 1 61 61 LEU CB C 61 42.610 42.610 41.938 0.672 18802 870 1 2 . 1 1 61 61 LEU H H 61 8.425 8.425 8.455 -0.030 18802 871 1 2 . 1 1 62 62 THR N N 62 115.786 115.786 114.299 1.487 18802 872 1 2 . 1 1 62 62 THR HA H 62 3.771 3.771 3.999 -0.228 18802 873 1 2 . 1 1 62 62 THR C C 62 175.988 175.988 176.288 -0.300 18802 874 1 2 . 1 1 62 62 THR CA C 62 67.649 67.649 67.216 0.433 18802 875 1 2 . 1 1 62 62 THR CB C 62 68.848 68.848 68.420 0.428 18802 876 1 2 . 1 1 62 62 THR H H 62 8.340 8.340 8.462 -0.122 18802 877 1 2 . 1 1 63 63 ARG N N 63 122.111 122.111 121.780 0.331 18802 878 1 2 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.924 0.065 18802 879 1 2 . 1 1 63 63 ARG C C 63 179.715 179.715 177.649 2.066 18802 880 1 2 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.731 0.355 18802 881 1 2 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.192 -0.381 18802 882 1 2 . 1 1 63 63 ARG H H 63 8.024 8.024 8.382 -0.358 18802 883 1 2 . 1 1 64 64 LYS N N 64 120.824 120.824 120.087 0.737 18802 884 1 2 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.145 -0.291 18802 885 1 2 . 1 1 64 64 LYS C C 64 178.707 178.707 179.314 -0.607 18802 886 1 2 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.440 1.115 18802 887 1 2 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.365 0.813 18802 888 1 2 . 1 1 64 64 LYS H H 64 8.130 8.130 7.683 0.447 18802 889 1 2 . 1 1 65 65 LEU N N 65 118.497 118.497 115.014 3.483 18802 890 1 2 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.195 -0.226 18802 891 1 2 . 1 1 65 65 LEU C C 65 179.023 179.023 179.027 -0.004 18802 892 1 2 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.591 -0.310 18802 893 1 2 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.596 0.794 18802 894 1 2 . 1 1 65 65 LEU H H 65 8.108 8.108 8.110 -0.002 18802 895 1 2 . 1 1 66 66 ARG N N 66 119.000 119.000 119.266 -0.266 18802 896 1 2 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.202 0.012 18802 897 1 2 . 1 1 66 66 ARG C C 66 178.064 178.064 178.511 -0.447 18802 898 1 2 . 1 1 66 66 ARG CA C 66 58.224 58.224 58.776 -0.552 18802 899 1 2 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.984 -0.361 18802 900 1 2 . 1 1 66 66 ARG H H 66 8.102 8.102 8.318 -0.216 18802 901 1 2 . 1 1 67 67 THR N N 67 109.849 109.849 107.706 2.143 18802 902 1 2 . 1 1 67 67 THR HA H 67 4.313 4.313 4.481 -0.168 18802 903 1 2 . 1 1 67 67 THR C C 67 175.834 175.834 175.866 -0.032 18802 904 1 2 . 1 1 67 67 THR CA C 67 62.681 62.681 61.969 0.712 18802 905 1 2 . 1 1 67 67 THR CB C 67 70.768 70.768 70.022 0.746 18802 906 1 2 . 1 1 67 67 THR H H 67 7.956 7.956 8.083 -0.127 18802 907 1 2 . 1 1 68 68 GLY N N 68 110.673 110.673 111.128 -0.455 18802 908 1 2 . 1 1 68 68 GLY C C 68 173.968 173.968 173.705 0.263 18802 909 1 2 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.192 0.838 18802 910 1 2 . 1 1 68 68 GLY H H 68 8.016 8.016 8.061 -0.045 18802 911 1 2 . 1 1 69 69 ASP N N 69 121.490 121.490 120.762 0.728 18802 912 1 2 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.805 -0.150 18802 913 1 2 . 1 1 69 69 ASP C C 69 175.983 175.983 176.266 -0.283 18802 914 1 2 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.186 0.669 18802 915 1 2 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.536 0.110 18802 916 1 2 . 1 1 69 69 ASP H H 69 8.048 8.048 7.747 0.301 18802 917 1 2 . 1 1 70 70 LEU N N 70 120.838 120.838 124.314 -3.476 18802 918 1 2 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.533 -0.394 18802 919 1 2 . 1 1 70 70 LEU C C 70 177.530 177.530 177.986 -0.456 18802 920 1 2 . 1 1 70 70 LEU CA C 70 55.280 55.280 54.528 0.752 18802 921 1 2 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.421 -0.285 18802 922 1 2 . 1 1 70 70 LEU H H 70 7.988 7.988 7.931 0.057 18802 923 1 2 . 1 1 71 71 GLY N N 71 108.059 108.059 108.487 -0.428 18802 924 1 2 . 1 1 71 71 GLY C C 71 173.936 173.936 174.605 -0.669 18802 925 1 2 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.786 -0.228 18802 926 1 2 . 1 1 71 71 GLY H H 71 8.341 8.341 8.386 -0.045 18802 927 1 2 . 1 1 72 72 ILE N N 72 121.037 121.037 121.837 -0.800 18802 928 1 2 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.346 0.048 18802 929 1 2 . 1 1 72 72 ILE C C 72 174.227 174.227 174.282 -0.055 18802 930 1 2 . 1 1 72 72 ILE CA C 72 58.539 58.539 58.504 0.035 18802 931 1 2 . 1 1 72 72 ILE CB C 72 38.810 38.810 39.152 -0.342 18802 932 1 2 . 1 1 72 72 ILE H H 72 7.793 7.793 7.908 -0.115 18802 933 1 2 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.654 -0.032 18802 934 1 2 . 1 1 73 73 PRO CA C 73 61.640 61.640 62.033 -0.393 18802 935 1 2 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.384 -0.280 18802 936 1 2 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.437 -0.065 18802 937 1 2 . 1 1 74 74 PRO C C 74 176.423 176.423 175.717 0.706 18802 938 1 2 . 1 1 74 74 PRO CA C 74 63.041 63.041 63.156 -0.115 18802 939 1 2 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.296 -0.266 18802 940 1 2 . 1 1 75 75 ASN N N 75 119.550 119.550 121.587 -2.037 18802 941 1 2 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.878 0.051 18802 942 1 2 . 1 1 75 75 ASN C C 75 174.066 174.066 175.327 -1.261 18802 943 1 2 . 1 1 75 75 ASN CA C 75 51.151 51.151 50.003 1.148 18802 944 1 2 . 1 1 75 75 ASN CB C 75 38.924 38.924 39.019 -0.095 18802 945 1 2 . 1 1 75 75 ASN H H 75 8.422 8.422 8.540 -0.118 18802 946 1 2 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.221 0.072 18802 947 1 2 . 1 1 76 76 PRO C C 76 177.322 177.322 177.622 -0.300 18802 948 1 2 . 1 1 76 76 PRO CA C 76 64.384 64.384 64.977 -0.593 18802 949 1 2 . 1 1 76 76 PRO CB C 76 32.236 32.236 31.923 0.313 18802 950 1 2 . 1 1 77 77 GLU N N 77 118.523 118.523 117.028 1.495 18802 951 1 2 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.388 -0.212 18802 952 1 2 . 1 1 77 77 GLU C C 77 176.403 176.403 178.139 -1.736 18802 953 1 2 . 1 1 77 77 GLU CA C 77 56.977 56.977 56.950 0.027 18802 954 1 2 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.909 0.951 18802 955 1 2 . 1 1 77 77 GLU H H 77 8.426 8.426 8.144 0.282 18802 956 1 2 . 1 1 78 78 ASP N N 78 120.581 120.581 120.575 0.006 18802 957 1 2 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.478 0.065 18802 958 1 2 . 1 1 78 78 ASP C C 78 176.085 176.085 176.641 -0.556 18802 959 1 2 . 1 1 78 78 ASP CA C 78 54.544 54.544 56.258 -1.714 18802 960 1 2 . 1 1 78 78 ASP CB C 78 41.239 41.239 40.867 0.371 18802 961 1 2 . 1 1 78 78 ASP H H 78 7.941 7.941 8.064 -0.123 18802 962 1 2 . 1 1 79 79 ARG N N 79 121.043 121.043 117.417 3.626 18802 963 1 2 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.218 0.107 18802 964 1 2 . 1 1 79 79 ARG C C 79 176.123 176.123 177.256 -1.133 18802 965 1 2 . 1 1 79 79 ARG CA C 79 55.927 55.927 56.072 -0.145 18802 966 1 2 . 1 1 79 79 ARG CB C 79 30.650 30.650 29.168 1.482 18802 967 1 2 . 1 1 79 79 ARG H H 79 8.066 8.066 7.675 0.391 18802 968 1 2 . 1 1 80 80 SER N N 80 118.338 118.338 118.292 0.046 18802 969 1 2 . 1 1 80 80 SER HA H 80 4.672 4.672 4.577 0.095 18802 970 1 2 . 1 1 80 80 SER C C 80 172.577 172.577 173.139 -0.562 18802 971 1 2 . 1 1 80 80 SER CA C 80 56.564 56.564 56.715 -0.151 18802 972 1 2 . 1 1 80 80 SER CB C 80 63.415 63.415 63.884 -0.469 18802 973 1 2 . 1 1 80 80 SER H H 80 8.281 8.281 7.673 0.608 18802 974 1 2 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.454 -0.034 18802 975 1 2 . 1 1 81 81 PRO C C 81 176.727 176.727 175.910 0.817 18802 976 1 2 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.325 -0.062 18802 977 1 2 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.196 -0.144 18802 978 1 2 . 1 1 82 82 SER N N 82 117.341 117.341 118.070 -0.729 18802 979 1 2 . 1 1 82 82 SER HA H 82 4.693 4.693 4.808 -0.115 18802 980 1 2 . 1 1 82 82 SER C C 82 172.803 172.803 172.649 0.154 18802 981 1 2 . 1 1 82 82 SER CA C 82 56.288 56.288 56.584 -0.296 18802 982 1 2 . 1 1 82 82 SER CB C 82 63.500 63.500 63.585 -0.085 18802 983 1 2 . 1 1 82 82 SER H H 82 8.280 8.280 8.081 0.199 18802 984 1 2 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.407 -0.096 18802 985 1 2 . 1 1 83 83 PRO C C 83 176.273 176.273 176.036 0.237 18802 986 1 2 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.992 0.123 18802 987 1 2 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.255 -0.156 18802 988 1 2 . 1 1 84 84 GLU N N 84 122.213 122.213 122.490 -0.277 18802 989 1 2 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.321 0.172 18802 990 1 2 . 1 1 84 84 GLU C C 84 174.546 174.546 175.840 -1.294 18802 991 1 2 . 1 1 84 84 GLU CA C 84 54.529 54.529 54.882 -0.353 18802 992 1 2 . 1 1 84 84 GLU CB C 84 29.938 29.938 30.223 -0.285 18802 993 1 2 . 1 1 84 84 GLU H H 84 8.230 8.230 8.531 -0.301 18802 994 1 2 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.455 -0.040 18802 995 1 2 . 1 1 85 85 PRO C C 85 176.024 176.024 175.943 0.081 18802 996 1 2 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.879 0.363 18802 997 1 2 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.352 -0.164 18802 998 1 2 . 1 1 86 86 ILE N N 86 120.281 120.281 120.422 -0.141 18802 999 1 2 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.330 -0.268 18802 1000 1 2 . 1 1 86 86 ILE C C 86 175.419 175.419 174.790 0.629 18802 1001 1 2 . 1 1 86 86 ILE CA C 86 61.029 61.029 61.485 -0.456 18802 1002 1 2 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.142 0.116 18802 1003 1 2 . 1 1 86 86 ILE H H 86 7.980 7.980 8.231 -0.251 18802 1004 1 2 . 1 1 87 87 TYR N N 87 123.089 123.089 125.757 -2.668 18802 1005 1 2 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.842 -0.025 18802 1006 1 2 . 1 1 87 87 TYR C C 87 175.920 175.920 175.640 0.280 18802 1007 1 2 . 1 1 87 87 TYR CA C 87 57.197 57.197 56.550 0.647 18802 1008 1 2 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.992 0.186 18802 1009 1 2 . 1 1 87 87 TYR H H 87 8.194 8.194 8.457 -0.263 18802 1010 1 2 . 1 1 88 88 ASN N N 88 120.117 120.117 121.403 -1.286 18802 1011 1 2 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.626 0.119 18802 1012 1 2 . 1 1 88 88 ASN C C 88 176.275 176.275 177.211 -0.936 18802 1013 1 2 . 1 1 88 88 ASN CA C 88 52.286 52.286 53.353 -1.067 18802 1014 1 2 . 1 1 88 88 ASN CB C 88 39.082 39.082 40.077 -0.995 18802 1015 1 2 . 1 1 88 88 ASN H H 88 8.386 8.386 8.677 -0.291 18802 1016 1 2 . 1 1 89 89 SER N N 89 115.826 115.826 116.527 -0.701 18802 1017 1 2 . 1 1 89 89 SER HA H 89 4.248 4.248 4.274 -0.026 18802 1018 1 2 . 1 1 89 89 SER C C 89 175.066 175.066 174.797 0.269 18802 1019 1 2 . 1 1 89 89 SER CA C 89 60.012 60.012 60.803 -0.791 18802 1020 1 2 . 1 1 89 89 SER CB C 89 63.400 63.400 62.971 0.429 18802 1021 1 2 . 1 1 89 89 SER H H 89 8.371 8.371 8.733 -0.362 18802 1022 1 2 . 1 1 90 90 GLU N N 90 121.062 121.062 118.319 2.743 18802 1023 1 2 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.376 -0.098 18802 1024 1 2 . 1 1 90 90 GLU C C 90 176.936 176.936 176.382 0.554 18802 1025 1 2 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.001 0.780 18802 1026 1 2 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.503 0.560 18802 1027 1 2 . 1 1 90 90 GLU H H 90 8.018 8.018 8.097 -0.079 18802 1028 1 2 . 1 1 91 91 GLY N N 91 108.499 108.499 109.532 -1.033 18802 1029 1 2 . 1 1 91 91 GLY C C 91 174.115 174.115 173.581 0.534 18802 1030 1 2 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.189 0.555 18802 1031 1 2 . 1 1 91 91 GLY H H 91 8.199 8.199 8.481 -0.282 18802 1032 1 2 . 1 1 92 92 LYS N N 92 120.638 120.638 120.687 -0.049 18802 1033 1 2 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.531 -0.222 18802 1034 1 2 . 1 1 92 92 LYS C C 92 176.453 176.453 175.269 1.184 18802 1035 1 2 . 1 1 92 92 LYS CA C 92 55.856 55.856 55.391 0.466 18802 1036 1 2 . 1 1 92 92 LYS CB C 92 33.109 33.109 34.517 -1.408 18802 1037 1 2 . 1 1 92 92 LYS H H 92 7.956 7.956 7.621 0.335 18802 1038 1 2 . 1 1 93 93 ARG N N 93 122.999 122.999 126.155 -3.156 18802 1039 1 2 . 1 1 93 93 ARG HA H 93 4.191 4.191 3.914 0.277 18802 1040 1 2 . 1 1 93 93 ARG C C 93 176.325 176.325 175.098 1.227 18802 1041 1 2 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.601 0.781 18802 1042 1 2 . 1 1 93 93 ARG CB C 93 30.656 30.656 31.302 -0.646 18802 1043 1 2 . 1 1 93 93 ARG H H 93 8.403 8.403 8.672 -0.269 18802 1044 1 2 . 1 1 94 94 LEU N N 94 124.100 124.100 119.896 4.204 18802 1045 1 2 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.672 -0.409 18802 1046 1 2 . 1 1 94 94 LEU C C 94 176.993 176.993 175.158 1.835 18802 1047 1 2 . 1 1 94 94 LEU CA C 94 55.034 55.034 52.858 2.176 18802 1048 1 2 . 1 1 94 94 LEU CB C 94 42.941 42.941 43.539 -0.598 18802 1049 1 2 . 1 1 94 94 LEU H H 94 8.283 8.283 8.260 0.023 18802 1050 1 2 . 1 1 95 95 ASN N N 95 119.593 119.593 117.241 2.352 18802 1051 1 2 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.696 0.051 18802 1052 1 2 . 1 1 95 95 ASN C C 95 175.598 175.598 175.128 0.470 18802 1053 1 2 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.703 -1.023 18802 1054 1 2 . 1 1 95 95 ASN CB C 95 38.723 38.723 39.410 -0.687 18802 1055 1 2 . 1 1 95 95 ASN H H 95 8.460 8.460 8.239 0.221 18802 1056 1 2 . 1 1 96 96 THR N N 96 114.100 114.100 117.046 -2.946 18802 1057 1 2 . 1 1 96 96 THR HA H 96 4.226 4.226 4.408 -0.182 18802 1058 1 2 . 1 1 96 96 THR C C 96 175.186 175.186 176.060 -0.874 18802 1059 1 2 . 1 1 96 96 THR CA C 96 62.203 62.203 64.907 -2.704 18802 1060 1 2 . 1 1 96 96 THR CB C 96 69.880 69.880 69.546 0.333 18802 1061 1 2 . 1 1 96 96 THR H H 96 8.031 8.031 8.440 -0.409 18802 1062 1 2 . 1 1 97 97 ARG N N 97 122.587 122.587 120.697 1.890 18802 1063 1 2 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.144 -0.031 18802 1064 1 2 . 1 1 97 97 ARG C C 97 177.938 177.938 178.529 -0.591 18802 1065 1 2 . 1 1 97 97 ARG CA C 97 58.412 58.412 60.434 -2.022 18802 1066 1 2 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.885 0.412 18802 1067 1 2 . 1 1 97 97 ARG H H 97 8.502 8.502 8.562 -0.060 18802 1068 1 2 . 1 1 98 98 GLU N N 98 121.548 121.548 120.688 0.860 18802 1069 1 2 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.135 -0.118 18802 1070 1 2 . 1 1 98 98 GLU C C 98 177.113 177.113 178.863 -1.750 18802 1071 1 2 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.758 -1.078 18802 1072 1 2 . 1 1 98 98 GLU CB C 98 29.666 29.666 29.007 0.659 18802 1073 1 2 . 1 1 98 98 GLU H H 98 8.517 8.517 8.742 -0.225 18802 1074 1 2 . 1 1 99 99 PHE N N 99 121.388 121.388 119.708 1.680 18802 1075 1 2 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.237 0.085 18802 1076 1 2 . 1 1 99 99 PHE C C 99 177.070 177.070 177.402 -0.332 18802 1077 1 2 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.279 -1.204 18802 1078 1 2 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.077 0.409 18802 1079 1 2 . 1 1 99 99 PHE H H 99 8.176 8.176 8.281 -0.105 18802 1080 1 2 . 1 1 100 100 ARG N N 100 120.211 120.211 120.045 0.166 18802 1081 1 2 . 1 1 100 100 ARG C C 100 178.159 178.159 178.789 -0.630 18802 1082 1 2 . 1 1 100 100 ARG CA C 100 58.533 58.533 59.231 -0.698 18802 1083 1 2 . 1 1 100 100 ARG CB C 100 30.588 30.588 29.627 0.961 18802 1084 1 2 . 1 1 100 100 ARG H H 100 8.377 8.377 8.158 0.219 18802 1085 1 2 . 1 1 101 101 THR N N 101 115.416 115.416 116.494 -1.078 18802 1086 1 2 . 1 1 101 101 THR HA H 101 4.022 4.022 4.044 -0.022 18802 1087 1 2 . 1 1 101 101 THR C C 101 175.301 175.301 176.946 -1.645 18802 1088 1 2 . 1 1 101 101 THR CA C 101 65.141 65.141 66.262 -1.121 18802 1089 1 2 . 1 1 101 101 THR CB C 101 69.305 69.305 68.446 0.859 18802 1090 1 2 . 1 1 101 101 THR H H 101 7.992 7.992 8.223 -0.232 18802 1091 1 2 . 1 1 102 102 ARG N N 102 122.212 122.212 121.546 0.666 18802 1092 1 2 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.969 0.338 18802 1093 1 2 . 1 1 102 102 ARG C C 102 177.644 177.644 178.417 -0.773 18802 1094 1 2 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.718 0.893 18802 1095 1 2 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.111 -0.303 18802 1096 1 2 . 1 1 102 102 ARG H H 102 8.369 8.369 8.341 0.028 18802 1097 1 2 . 1 1 103 103 LYS N N 103 117.591 117.591 119.253 -1.662 18802 1098 1 2 . 1 1 103 103 LYS HA H 103 3.960 3.960 4.093 -0.133 18802 1099 1 2 . 1 1 103 103 LYS C C 103 178.913 178.913 178.668 0.245 18802 1100 1 2 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.165 0.885 18802 1101 1 2 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.511 0.630 18802 1102 1 2 . 1 1 103 103 LYS H H 103 7.941 7.941 8.155 -0.214 18802 1103 1 2 . 1 1 104 104 LYS N N 104 119.769 119.769 120.411 -0.642 18802 1104 1 2 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.197 -0.051 18802 1105 1 2 . 1 1 104 104 LYS C C 104 179.377 179.377 178.840 0.537 18802 1106 1 2 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.724 0.255 18802 1107 1 2 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.505 0.686 18802 1108 1 2 . 1 1 104 104 LYS H H 104 7.615 7.615 7.483 0.132 18802 1109 1 2 . 1 1 105 105 LEU N N 105 120.500 120.500 118.780 1.720 18802 1110 1 2 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.879 0.238 18802 1111 1 2 . 1 1 105 105 LEU C C 105 179.481 179.481 179.092 0.389 18802 1112 1 2 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.153 0.108 18802 1113 1 2 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.400 0.604 18802 1114 1 2 . 1 1 105 105 LEU H H 105 8.057 8.057 7.953 0.104 18802 1115 1 2 . 1 1 106 106 GLU N N 106 118.803 118.803 119.024 -0.221 18802 1116 1 2 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.940 0.049 18802 1117 1 2 . 1 1 106 106 GLU C C 106 180.577 180.577 179.209 1.368 18802 1118 1 2 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.817 -0.007 18802 1119 1 2 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.356 0.653 18802 1120 1 2 . 1 1 106 106 GLU H H 106 8.652 8.652 7.812 0.840 18802 1121 1 2 . 1 1 107 107 GLU N N 107 122.396 122.396 119.954 2.442 18802 1122 1 2 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.089 0.017 18802 1123 1 2 . 1 1 107 107 GLU C C 107 178.457 178.457 179.149 -0.692 18802 1124 1 2 . 1 1 107 107 GLU CA C 107 59.826 59.826 59.587 0.239 18802 1125 1 2 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.616 -0.054 18802 1126 1 2 . 1 1 107 107 GLU H H 107 8.281 8.281 8.451 -0.170 18802 1127 1 2 . 1 1 108 108 GLU N N 108 120.976 120.976 119.114 1.862 18802 1128 1 2 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.028 0.064 18802 1129 1 2 . 1 1 108 108 GLU C C 108 179.343 179.343 178.908 0.435 18802 1130 1 2 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.351 0.345 18802 1131 1 2 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.215 0.355 18802 1132 1 2 . 1 1 108 108 GLU H H 108 8.321 8.321 8.647 -0.326 18802 1133 1 2 . 1 1 109 109 ARG N N 109 118.559 118.559 119.962 -1.403 18802 1134 1 2 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.880 -0.088 18802 1135 1 2 . 1 1 109 109 ARG C C 109 177.178 177.178 178.114 -0.936 18802 1136 1 2 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.809 0.675 18802 1137 1 2 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.187 -0.038 18802 1138 1 2 . 1 1 109 109 ARG H H 109 8.594 8.594 8.223 0.371 18802 1139 1 2 . 1 1 110 110 HIS N N 110 119.632 119.632 118.694 0.938 18802 1140 1 2 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.065 0.276 18802 1141 1 2 . 1 1 110 110 HIS C C 110 177.578 177.578 177.354 0.224 18802 1142 1 2 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.308 1.309 18802 1143 1 2 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.012 0.497 18802 1144 1 2 . 1 1 110 110 HIS H H 110 8.465 8.465 8.479 -0.014 18802 1145 1 2 . 1 1 111 111 ASN N N 111 119.587 119.587 118.173 1.414 18802 1146 1 2 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.333 -0.055 18802 1147 1 2 . 1 1 111 111 ASN C C 111 178.630 178.630 177.882 0.748 18802 1148 1 2 . 1 1 111 111 ASN CA C 111 56.281 56.281 55.970 0.311 18802 1149 1 2 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.278 -0.583 18802 1150 1 2 . 1 1 111 111 ASN H H 111 8.323 8.323 8.422 -0.099 18802 1151 1 2 . 1 1 112 112 LEU N N 112 122.320 122.320 120.418 1.902 18802 1152 1 2 . 1 1 112 112 LEU HA H 112 4.116 4.116 3.913 0.203 18802 1153 1 2 . 1 1 112 112 LEU C C 112 178.539 178.539 178.592 -0.053 18802 1154 1 2 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.687 0.292 18802 1155 1 2 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.686 0.908 18802 1156 1 2 . 1 1 112 112 LEU H H 112 7.966 7.966 7.923 0.043 18802 1157 1 2 . 1 1 113 113 ILE N N 113 121.495 121.495 120.389 1.106 18802 1158 1 2 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.780 -0.544 18802 1159 1 2 . 1 1 113 113 ILE C C 113 176.959 176.959 178.487 -1.528 18802 1160 1 2 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.686 1.368 18802 1161 1 2 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.257 1.346 18802 1162 1 2 . 1 1 113 113 ILE H H 113 8.472 8.472 8.691 -0.219 18802 1163 1 2 . 1 1 114 114 THR N N 114 115.066 115.066 114.726 0.340 18802 1164 1 2 . 1 1 114 114 THR HA H 114 3.718 3.718 3.976 -0.258 18802 1165 1 2 . 1 1 114 114 THR C C 114 176.559 176.559 176.480 0.079 18802 1166 1 2 . 1 1 114 114 THR CA C 114 66.700 66.700 66.675 0.025 18802 1167 1 2 . 1 1 114 114 THR CB C 114 68.759 68.759 68.358 0.401 18802 1168 1 2 . 1 1 114 114 THR H H 114 8.075 8.075 8.344 -0.269 18802 1169 1 2 . 1 1 115 115 GLU N N 115 123.259 123.259 121.708 1.551 18802 1170 1 2 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.067 -0.135 18802 1171 1 2 . 1 1 115 115 GLU C C 115 178.191 178.191 178.549 -0.358 18802 1172 1 2 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.347 -0.007 18802 1173 1 2 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.497 -0.098 18802 1174 1 2 . 1 1 115 115 GLU H H 115 7.368 7.368 7.474 -0.106 18802 1175 1 2 . 1 1 116 116 MET N N 116 119.844 119.844 120.123 -0.279 18802 1176 1 2 . 1 1 116 116 MET HA H 116 4.014 4.014 4.006 0.008 18802 1177 1 2 . 1 1 116 116 MET C C 116 177.888 177.888 178.179 -0.291 18802 1178 1 2 . 1 1 116 116 MET CA C 116 57.183 57.183 59.190 -2.007 18802 1179 1 2 . 1 1 116 116 MET CB C 116 32.126 32.126 32.516 -0.390 18802 1180 1 2 . 1 1 116 116 MET H H 116 8.373 8.373 8.330 0.043 18802 1181 1 2 . 1 1 117 117 VAL N N 117 117.572 117.572 119.764 -2.192 18802 1182 1 2 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.084 -0.188 18802 1183 1 2 . 1 1 117 117 VAL C C 117 177.567 177.567 177.700 -0.133 18802 1184 1 2 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.206 -1.336 18802 1185 1 2 . 1 1 117 117 VAL CB C 117 32.002 32.002 31.773 0.229 18802 1186 1 2 . 1 1 117 117 VAL H H 117 8.279 8.279 8.707 -0.428 18802 1187 1 2 . 1 1 118 118 ALA N N 118 120.560 120.560 121.406 -0.846 18802 1188 1 2 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.164 -0.028 18802 1189 1 2 . 1 1 118 118 ALA C C 118 179.595 179.595 179.192 0.403 18802 1190 1 2 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.688 -0.585 18802 1191 1 2 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.701 -0.452 18802 1192 1 2 . 1 1 118 118 ALA H H 118 7.074 7.074 7.410 -0.336 18802 1193 1 2 . 1 1 119 119 LEU N N 119 117.987 117.987 117.603 0.384 18802 1194 1 2 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.144 -0.004 18802 1195 1 2 . 1 1 119 119 LEU C C 119 177.863 177.863 177.082 0.781 18802 1196 1 2 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.687 -0.015 18802 1197 1 2 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.819 0.415 18802 1198 1 2 . 1 1 119 119 LEU H H 119 7.525 7.525 7.576 -0.051 18802 1199 1 2 . 1 1 120 120 ASN N N 120 115.338 115.338 115.799 -0.461 18802 1200 1 2 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.149 -0.131 18802 1201 1 2 . 1 1 120 120 ASN C C 120 172.510 172.510 174.073 -1.563 18802 1202 1 2 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.118 -0.017 18802 1203 1 2 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.558 -1.253 18802 1204 1 2 . 1 1 120 120 ASN H H 120 8.467 8.467 8.079 0.388 18802 1205 1 2 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.480 0.176 18802 1206 1 2 . 1 1 121 121 PRO C C 121 177.020 177.020 176.839 0.181 18802 1207 1 2 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.485 -0.187 18802 1208 1 2 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.305 -0.006 18802 1209 1 2 . 1 1 122 122 ASP N N 122 115.744 115.744 117.533 -1.789 18802 1210 1 2 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.657 0.012 18802 1211 1 2 . 1 1 122 122 ASP C C 122 176.004 176.004 175.974 0.030 18802 1212 1 2 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.856 0.510 18802 1213 1 2 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.581 -0.257 18802 1214 1 2 . 1 1 122 122 ASP H H 122 7.600 7.600 7.957 -0.357 18802 1215 1 2 . 1 1 123 123 PHE N N 123 122.722 122.722 121.934 0.788 18802 1216 1 2 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.386 -0.251 18802 1217 1 2 . 1 1 123 123 PHE C C 123 173.954 173.954 174.444 -0.490 18802 1218 1 2 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.431 0.562 18802 1219 1 2 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.156 0.441 18802 1220 1 2 . 1 1 123 123 PHE H H 123 7.940 7.940 7.454 0.486 18802 1221 1 2 . 1 1 124 124 LYS N N 124 129.400 129.400 130.280 -0.880 18802 1222 1 2 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.461 0.098 18802 1223 1 2 . 1 1 124 124 LYS C C 124 172.622 172.622 174.127 -1.505 18802 1224 1 2 . 1 1 124 124 LYS CA C 124 51.815 51.815 52.956 -1.141 18802 1225 1 2 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.341 1.240 18802 1226 1 2 . 1 1 124 124 LYS H H 124 7.602 7.602 8.389 -0.787 18802 1227 1 2 . 1 1 125 125 PRO HA H 125 4.089 4.089 3.903 0.186 18802 1228 1 2 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.519 -0.523 18802 1229 1 2 . 1 1 125 125 PRO CB C 125 31.067 31.067 31.261 -0.194 18802 1230 1 2 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.391 -0.017 18802 1231 1 2 . 1 1 126 126 PRO C C 126 177.630 177.630 177.753 -0.123 18802 1232 1 2 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.911 -0.098 18802 1233 1 2 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.311 0.010 18802 1234 1 2 . 1 1 127 127 ALA N N 127 123.830 123.830 123.000 0.830 18802 1235 1 2 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.056 0.002 18802 1236 1 2 . 1 1 127 127 ALA C C 127 177.641 177.641 178.792 -1.151 18802 1237 1 2 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.472 0.130 18802 1238 1 2 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.776 0.073 18802 1239 1 2 . 1 1 127 127 ALA H H 127 8.630 8.630 8.600 0.030 18802 1240 1 2 . 1 1 128 128 ASP N N 128 112.924 112.924 115.167 -2.243 18802 1241 1 2 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.533 -0.082 18802 1242 1 2 . 1 1 128 128 ASP C C 128 175.724 175.724 175.422 0.302 18802 1243 1 2 . 1 1 128 128 ASP CA C 128 53.604 53.604 54.502 -0.898 18802 1244 1 2 . 1 1 128 128 ASP CB C 128 40.418 40.418 41.061 -0.643 18802 1245 1 2 . 1 1 128 128 ASP H H 128 8.335 8.335 8.225 0.110 18802 1246 1 2 . 1 1 129 129 TYR N N 129 121.114 121.114 121.420 -0.306 18802 1247 1 2 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.474 -0.112 18802 1248 1 2 . 1 1 129 129 TYR C C 129 174.190 174.190 174.532 -0.342 18802 1249 1 2 . 1 1 129 129 TYR CA C 129 58.412 58.412 58.684 -0.272 18802 1250 1 2 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.526 0.532 18802 1251 1 2 . 1 1 129 129 TYR H H 129 7.600 7.600 7.598 0.002 18802 1252 1 2 . 1 1 130 130 LYS N N 130 129.875 129.875 128.661 1.214 18802 1253 1 2 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.345 -0.027 18802 1254 1 2 . 1 1 130 130 LYS C C 130 172.314 172.314 173.510 -1.196 18802 1255 1 2 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.956 0.614 18802 1256 1 2 . 1 1 130 130 LYS CB C 130 33.663 33.663 33.851 -0.188 18802 1257 1 2 . 1 1 130 130 LYS H H 130 7.695 7.695 8.267 -0.572 18802 1258 1 2 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.449 -0.172 18802 1259 1 2 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.438 -0.380 18802 1260 1 2 . 1 1 131 131 PRO CB C 131 30.852 30.852 31.157 -0.305 18802 1261 1 2 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.455 -0.211 18802 1262 1 2 . 1 1 132 132 PRO C C 132 176.459 176.459 177.463 -1.004 18802 1263 1 2 . 1 1 132 132 PRO CA C 132 62.874 62.874 62.374 0.500 18802 1264 1 2 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.558 -0.511 18802 1265 1 2 . 1 1 133 133 ALA N N 133 124.170 124.170 125.426 -1.256 18802 1266 1 2 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.176 0.074 18802 1267 1 2 . 1 1 133 133 ALA C C 133 177.870 177.870 178.665 -0.795 18802 1268 1 2 . 1 1 133 133 ALA CA C 133 52.508 52.508 54.093 -1.585 18802 1269 1 2 . 1 1 133 133 ALA CB C 133 19.303 19.303 18.283 1.020 18802 1270 1 2 . 1 1 133 133 ALA H H 133 8.311 8.311 8.452 -0.141 18802 1271 1 2 . 1 1 134 134 THR N N 134 113.807 113.807 111.189 2.618 18802 1272 1 2 . 1 1 134 134 THR HA H 134 4.228 4.228 4.265 -0.037 18802 1273 1 2 . 1 1 134 134 THR C C 134 174.282 174.282 174.581 -0.299 18802 1274 1 2 . 1 1 134 134 THR CA C 134 62.127 62.127 62.435 -0.308 18802 1275 1 2 . 1 1 134 134 THR CB C 134 69.870 69.870 68.911 0.959 18802 1276 1 2 . 1 1 134 134 THR H H 134 8.019 8.019 7.772 0.247 18802 1277 1 2 . 1 1 135 135 ARG N N 135 124.165 124.165 121.937 2.228 18802 1278 1 2 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.726 -0.377 18802 1279 1 2 . 1 1 135 135 ARG C C 135 176.217 176.217 175.583 0.634 18802 1280 1 2 . 1 1 135 135 ARG CA C 135 55.993 55.993 54.636 1.357 18802 1281 1 2 . 1 1 135 135 ARG CB C 135 30.992 30.992 29.748 1.244 18802 1282 1 2 . 1 1 135 135 ARG H H 135 8.300 8.300 7.541 0.759 18802 1283 1 2 . 1 1 136 136 VAL N N 136 122.157 122.157 120.407 1.750 18802 1284 1 2 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.200 -0.130 18802 1285 1 2 . 1 1 136 136 VAL C C 136 176.180 176.180 176.672 -0.492 18802 1286 1 2 . 1 1 136 136 VAL CA C 136 61.937 61.937 63.414 -1.477 18802 1287 1 2 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.427 0.320 18802 1288 1 2 . 1 1 136 136 VAL H H 136 8.233 8.233 8.113 0.120 18802 1289 1 2 . 1 1 137 137 SER N N 137 118.837 118.837 115.416 3.421 18802 1290 1 2 . 1 1 137 137 SER HA H 137 4.416 4.416 4.618 -0.202 18802 1291 1 2 . 1 1 137 137 SER C C 137 174.258 174.258 174.405 -0.147 18802 1292 1 2 . 1 1 137 137 SER CA C 137 58.341 58.341 57.078 1.263 18802 1293 1 2 . 1 1 137 137 SER CB C 137 63.900 63.900 62.776 1.124 18802 1294 1 2 . 1 1 137 137 SER H H 137 8.264 8.264 8.048 0.216 18802 1295 1 2 . 1 1 138 138 ASP N N 138 122.871 122.871 127.729 -4.858 18802 1296 1 2 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.652 -0.115 18802 1297 1 2 . 1 1 138 138 ASP C C 138 176.053 176.053 176.017 0.036 18802 1298 1 2 . 1 1 138 138 ASP CA C 138 54.489 54.489 54.756 -0.267 18802 1299 1 2 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.708 -0.560 18802 1300 1 2 . 1 1 138 138 ASP H H 138 8.249 8.249 8.717 -0.468 18802 1301 1 2 . 1 1 139 139 LYS N N 139 120.944 120.944 119.791 1.153 18802 1302 1 2 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.110 0.150 18802 1303 1 2 . 1 1 139 139 LYS C C 139 176.343 176.343 175.036 1.307 18802 1304 1 2 . 1 1 139 139 LYS CA C 139 56.261 56.261 56.162 0.099 18802 1305 1 2 . 1 1 139 139 LYS CB C 139 33.077 33.077 31.153 1.924 18802 1306 1 2 . 1 1 139 139 LYS H H 139 8.084 8.084 8.469 -0.385 18802 1307 1 2 . 1 1 140 140 VAL N N 140 121.670 121.670 117.979 3.691 18802 1308 1 2 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.201 -0.189 18802 1309 1 2 . 1 1 140 140 VAL C C 140 175.842 175.842 175.895 -0.053 18802 1310 1 2 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.703 0.739 18802 1311 1 2 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.202 0.665 18802 1312 1 2 . 1 1 140 140 VAL H H 140 8.025 8.025 7.961 0.064 18802 1313 1 2 . 1 1 141 141 MET N N 141 124.839 124.839 124.705 0.134 18802 1314 1 2 . 1 1 141 141 MET HA H 141 4.453 4.453 4.828 -0.375 18802 1315 1 2 . 1 1 141 141 MET C C 141 175.562 175.562 175.156 0.406 18802 1316 1 2 . 1 1 141 141 MET CA C 141 55.349 55.349 54.582 0.767 18802 1317 1 2 . 1 1 141 141 MET CB C 141 32.993 32.993 33.648 -0.655 18802 1318 1 2 . 1 1 141 141 MET H H 141 8.364 8.364 8.375 -0.011 18802 1319 1 2 . 1 1 142 142 ILE N N 142 124.515 124.515 123.262 1.253 18802 1320 1 2 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.567 -0.139 18802 1321 1 2 . 1 1 142 142 ILE C C 142 174.331 174.331 174.392 -0.061 18802 1322 1 2 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.760 -0.356 18802 1323 1 2 . 1 1 142 142 ILE CB C 142 38.755 38.755 38.845 -0.090 18802 1324 1 2 . 1 1 142 142 ILE H H 142 8.093 8.093 8.301 -0.208 18802 1325 1 2 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.565 -0.215 18802 1326 1 2 . 1 1 143 143 PRO C C 143 176.623 176.623 175.765 0.858 18802 1327 1 2 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.446 0.969 18802 1328 1 2 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.465 -0.232 18802 1329 1 2 . 1 1 144 144 GLN N N 144 121.557 121.557 120.628 0.929 18802 1330 1 2 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.488 -0.182 18802 1331 1 2 . 1 1 144 144 GLN C C 144 174.751 174.751 175.408 -0.657 18802 1332 1 2 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.901 -0.230 18802 1333 1 2 . 1 1 144 144 GLN CB C 144 30.118 30.118 29.573 0.545 18802 1334 1 2 . 1 1 144 144 GLN H H 144 8.392 8.392 8.466 -0.074 18802 1335 1 3 . 1 1 26 26 ALA N N 26 124.085 124.085 122.479 1.606 18802 1336 1 3 . 1 1 26 26 ALA HA H 26 4.292 4.292 5.270 -0.978 18802 1337 1 3 . 1 1 26 26 ALA C C 26 177.101 177.101 177.341 -0.240 18802 1338 1 3 . 1 1 26 26 ALA CA C 26 52.921 52.921 52.330 0.591 18802 1339 1 3 . 1 1 26 26 ALA CB C 26 19.426 19.426 20.106 -0.680 18802 1340 1 3 . 1 1 26 26 ALA H H 26 8.498 8.498 9.728 -1.230 18802 1341 1 3 . 1 1 27 27 MET N N 27 119.630 119.630 117.877 1.753 18802 1342 1 3 . 1 1 27 27 MET HA H 27 4.391 4.391 4.874 -0.483 18802 1343 1 3 . 1 1 27 27 MET C C 27 176.296 176.296 175.809 0.487 18802 1344 1 3 . 1 1 27 27 MET CA C 27 55.834 55.834 54.726 1.108 18802 1345 1 3 . 1 1 27 27 MET CB C 27 32.663 32.663 33.845 -1.182 18802 1346 1 3 . 1 1 27 27 MET H H 27 8.441 8.441 8.036 0.405 18802 1347 1 3 . 1 1 28 28 GLU N N 28 122.376 122.376 120.125 2.251 18802 1348 1 3 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.428 -0.214 18802 1349 1 3 . 1 1 28 28 GLU C C 28 176.310 176.310 176.220 0.090 18802 1350 1 3 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.002 0.817 18802 1351 1 3 . 1 1 28 28 GLU CB C 28 30.252 30.252 30.231 0.021 18802 1352 1 3 . 1 1 28 28 GLU H H 28 8.336 8.336 8.456 -0.120 18802 1353 1 3 . 1 1 29 29 GLN N N 29 122.010 122.010 120.385 1.625 18802 1354 1 3 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.414 -0.123 18802 1355 1 3 . 1 1 29 29 GLN C C 29 175.765 175.765 176.342 -0.577 18802 1356 1 3 . 1 1 29 29 GLN CA C 29 55.839 55.839 54.983 0.856 18802 1357 1 3 . 1 1 29 29 GLN CB C 29 29.559 29.559 29.280 0.279 18802 1358 1 3 . 1 1 29 29 GLN H H 29 8.347 8.347 8.458 -0.111 18802 1359 1 3 . 1 1 30 30 LYS N N 30 123.090 123.090 123.731 -0.641 18802 1360 1 3 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.234 0.102 18802 1361 1 3 . 1 1 30 30 LYS C C 30 176.474 176.474 176.539 -0.065 18802 1362 1 3 . 1 1 30 30 LYS CA C 30 56.391 56.391 56.409 -0.018 18802 1363 1 3 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.489 0.504 18802 1364 1 3 . 1 1 30 30 LYS H H 30 8.327 8.327 8.466 -0.139 18802 1365 1 3 . 1 1 31 31 THR N N 31 116.800 116.800 118.172 -1.372 18802 1366 1 3 . 1 1 31 31 THR HA H 31 4.273 4.273 4.148 0.125 18802 1367 1 3 . 1 1 31 31 THR C C 31 174.071 174.071 174.230 -0.159 18802 1368 1 3 . 1 1 31 31 THR CA C 31 62.103 62.103 62.743 -0.640 18802 1369 1 3 . 1 1 31 31 THR CB C 31 69.899 69.899 69.174 0.725 18802 1370 1 3 . 1 1 31 31 THR H H 31 8.160 8.160 8.306 -0.146 18802 1371 1 3 . 1 1 32 32 VAL N N 32 124.108 124.108 125.945 -1.837 18802 1372 1 3 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.328 -0.262 18802 1373 1 3 . 1 1 32 32 VAL C C 32 175.573 175.573 174.493 1.080 18802 1374 1 3 . 1 1 32 32 VAL CA C 32 62.344 62.344 60.891 1.453 18802 1375 1 3 . 1 1 32 32 VAL CB C 32 32.912 32.912 33.653 -0.741 18802 1376 1 3 . 1 1 32 32 VAL H H 32 8.192 8.192 8.452 -0.260 18802 1377 1 3 . 1 1 33 33 ILE N N 33 127.371 127.371 128.762 -1.391 18802 1378 1 3 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.532 -0.108 18802 1379 1 3 . 1 1 33 33 ILE C C 33 174.335 174.335 174.426 -0.091 18802 1380 1 3 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.036 1.358 18802 1381 1 3 . 1 1 33 33 ILE CB C 33 38.799 38.799 38.008 0.791 18802 1382 1 3 . 1 1 33 33 ILE H H 33 8.275 8.275 8.255 0.020 18802 1383 1 3 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.485 -0.182 18802 1384 1 3 . 1 1 34 34 PRO C C 34 177.261 177.261 177.810 -0.549 18802 1385 1 3 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.458 0.214 18802 1386 1 3 . 1 1 34 34 PRO CB C 34 32.177 32.177 31.950 0.227 18802 1387 1 3 . 1 1 35 35 GLY N N 35 109.540 109.540 111.646 -2.106 18802 1388 1 3 . 1 1 35 35 GLY C C 35 173.906 173.906 174.004 -0.098 18802 1389 1 3 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.919 0.351 18802 1390 1 3 . 1 1 35 35 GLY H H 35 8.376 8.376 8.666 -0.290 18802 1391 1 3 . 1 1 36 36 MET N N 36 120.834 120.834 120.123 0.711 18802 1392 1 3 . 1 1 36 36 MET HA H 36 4.780 4.780 4.933 -0.153 18802 1393 1 3 . 1 1 36 36 MET C C 36 174.235 174.235 173.634 0.601 18802 1394 1 3 . 1 1 36 36 MET CA C 36 53.258 53.258 52.169 1.089 18802 1395 1 3 . 1 1 36 36 MET CB C 36 32.734 32.734 33.923 -1.190 18802 1396 1 3 . 1 1 36 36 MET H H 36 7.986 7.986 7.549 0.437 18802 1397 1 3 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.636 -0.174 18802 1398 1 3 . 1 1 37 37 PRO C C 37 176.736 176.736 176.177 0.559 18802 1399 1 3 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.635 0.623 18802 1400 1 3 . 1 1 37 37 PRO CB C 37 32.200 32.200 31.866 0.334 18802 1401 1 3 . 1 1 38 38 THR N N 38 115.642 115.642 113.438 2.204 18802 1402 1 3 . 1 1 38 38 THR HA H 38 4.226 4.226 4.371 -0.145 18802 1403 1 3 . 1 1 38 38 THR C C 38 174.164 174.164 175.315 -1.151 18802 1404 1 3 . 1 1 38 38 THR CA C 38 62.462 62.462 61.280 1.182 18802 1405 1 3 . 1 1 38 38 THR CB C 38 69.874 69.874 69.758 0.116 18802 1406 1 3 . 1 1 38 38 THR H H 38 8.189 8.189 8.119 0.070 18802 1407 1 3 . 1 1 39 39 VAL N N 39 123.700 123.700 124.362 -0.662 18802 1408 1 3 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.041 0.038 18802 1409 1 3 . 1 1 39 39 VAL C C 39 175.177 175.177 175.307 -0.130 18802 1410 1 3 . 1 1 39 39 VAL CA C 39 61.991 61.991 62.774 -0.783 18802 1411 1 3 . 1 1 39 39 VAL CB C 39 32.898 32.898 31.907 0.991 18802 1412 1 3 . 1 1 39 39 VAL H H 39 8.036 8.036 8.582 -0.546 18802 1413 1 3 . 1 1 40 40 ILE N N 40 127.780 127.780 128.987 -1.207 18802 1414 1 3 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.099 0.078 18802 1415 1 3 . 1 1 40 40 ILE C C 40 173.894 173.894 174.719 -0.825 18802 1416 1 3 . 1 1 40 40 ILE CA C 40 57.911 57.911 58.328 -0.417 18802 1417 1 3 . 1 1 40 40 ILE CB C 40 38.633 38.633 38.479 0.154 18802 1418 1 3 . 1 1 40 40 ILE H H 40 8.236 8.236 8.167 0.069 18802 1419 1 3 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.659 -0.168 18802 1420 1 3 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.335 0.289 18802 1421 1 3 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.063 0.039 18802 1422 1 3 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.305 -0.050 18802 1423 1 3 . 1 1 42 42 PRO C C 42 177.721 177.721 177.597 0.124 18802 1424 1 3 . 1 1 42 42 PRO CA C 42 62.800 62.800 62.843 -0.043 18802 1425 1 3 . 1 1 42 42 PRO CB C 42 32.355 32.355 32.091 0.264 18802 1426 1 3 . 1 1 43 43 GLY N N 43 107.305 107.305 107.870 -0.565 18802 1427 1 3 . 1 1 43 43 GLY C C 43 174.642 174.642 173.767 0.875 18802 1428 1 3 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.839 0.879 18802 1429 1 3 . 1 1 43 43 GLY H H 43 8.321 8.321 8.500 -0.179 18802 1430 1 3 . 1 1 44 44 LEU N N 44 120.897 120.897 121.899 -1.002 18802 1431 1 3 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.505 0.024 18802 1432 1 3 . 1 1 44 44 LEU C C 44 178.580 178.580 176.624 1.956 18802 1433 1 3 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.261 0.289 18802 1434 1 3 . 1 1 44 44 LEU CB C 44 42.579 42.579 42.951 -0.372 18802 1435 1 3 . 1 1 44 44 LEU H H 44 8.043 8.043 7.649 0.394 18802 1436 1 3 . 1 1 45 45 THR N N 45 113.195 113.195 111.698 1.497 18802 1437 1 3 . 1 1 45 45 THR HA H 45 4.386 4.386 4.593 -0.207 18802 1438 1 3 . 1 1 45 45 THR C C 45 175.377 175.377 175.807 -0.430 18802 1439 1 3 . 1 1 45 45 THR CA C 45 61.188 61.188 60.222 0.966 18802 1440 1 3 . 1 1 45 45 THR CB C 45 71.043 71.043 70.941 0.102 18802 1441 1 3 . 1 1 45 45 THR H H 45 8.427 8.427 8.129 0.298 18802 1442 1 3 . 1 1 46 46 ARG N N 46 121.322 121.322 121.398 -0.076 18802 1443 1 3 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.181 -0.144 18802 1444 1 3 . 1 1 46 46 ARG C C 46 179.309 179.309 178.138 1.171 18802 1445 1 3 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.221 0.163 18802 1446 1 3 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.520 0.296 18802 1447 1 3 . 1 1 46 46 ARG H H 46 8.832 8.832 8.900 -0.068 18802 1448 1 3 . 1 1 47 47 GLU N N 47 119.109 119.109 120.485 -1.376 18802 1449 1 3 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.067 -0.058 18802 1450 1 3 . 1 1 47 47 GLU C C 47 178.931 178.931 178.551 0.380 18802 1451 1 3 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.339 0.937 18802 1452 1 3 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.709 0.582 18802 1453 1 3 . 1 1 47 47 GLU H H 47 8.754 8.754 8.287 0.467 18802 1454 1 3 . 1 1 48 48 GLN N N 48 119.556 119.556 119.877 -0.321 18802 1455 1 3 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.085 -0.019 18802 1456 1 3 . 1 1 48 48 GLN C C 48 179.286 179.286 178.175 1.111 18802 1457 1 3 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.515 -0.300 18802 1458 1 3 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.287 1.380 18802 1459 1 3 . 1 1 48 48 GLN H H 48 7.711 7.711 7.939 -0.228 18802 1460 1 3 . 1 1 49 49 GLU N N 49 122.227 122.227 121.287 0.940 18802 1461 1 3 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.935 -0.062 18802 1462 1 3 . 1 1 49 49 GLU C C 49 177.879 177.879 179.071 -1.192 18802 1463 1 3 . 1 1 49 49 GLU CA C 49 59.958 59.958 60.055 -0.097 18802 1464 1 3 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.481 0.297 18802 1465 1 3 . 1 1 49 49 GLU H H 49 8.730 8.730 8.685 0.045 18802 1466 1 3 . 1 1 50 50 ARG N N 50 119.109 119.109 118.813 0.296 18802 1467 1 3 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.066 0.003 18802 1468 1 3 . 1 1 50 50 ARG C C 50 177.567 177.567 178.602 -1.035 18802 1469 1 3 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.325 -0.099 18802 1470 1 3 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.410 -0.314 18802 1471 1 3 . 1 1 50 50 ARG H H 50 7.906 7.906 8.224 -0.318 18802 1472 1 3 . 1 1 51 51 ALA N N 51 119.411 119.411 122.575 -3.164 18802 1473 1 3 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.895 -0.091 18802 1474 1 3 . 1 1 51 51 ALA C C 51 178.740 178.740 179.230 -0.490 18802 1475 1 3 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.006 0.229 18802 1476 1 3 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.297 -0.038 18802 1477 1 3 . 1 1 51 51 ALA H H 51 7.956 7.956 8.190 -0.234 18802 1478 1 3 . 1 1 52 52 TYR N N 52 119.160 119.160 119.894 -0.734 18802 1479 1 3 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.143 -0.085 18802 1480 1 3 . 1 1 52 52 TYR C C 52 177.367 177.367 177.530 -0.163 18802 1481 1 3 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.684 -0.079 18802 1482 1 3 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.590 0.118 18802 1483 1 3 . 1 1 52 52 TYR H H 52 7.854 7.854 7.959 -0.105 18802 1484 1 3 . 1 1 53 53 ILE N N 53 119.173 119.173 119.753 -0.580 18802 1485 1 3 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.194 0.408 18802 1486 1 3 . 1 1 53 53 ILE C C 53 178.711 178.711 178.079 0.632 18802 1487 1 3 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.716 -1.528 18802 1488 1 3 . 1 1 53 53 ILE CB C 53 38.314 38.314 38.019 0.295 18802 1489 1 3 . 1 1 53 53 ILE H H 53 7.809 7.809 8.372 -0.563 18802 1490 1 3 . 1 1 54 54 VAL N N 54 121.549 121.549 119.768 1.781 18802 1491 1 3 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.698 -0.224 18802 1492 1 3 . 1 1 54 54 VAL C C 54 177.992 177.992 178.082 -0.090 18802 1493 1 3 . 1 1 54 54 VAL CA C 54 66.995 66.995 66.326 0.670 18802 1494 1 3 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.462 -0.230 18802 1495 1 3 . 1 1 54 54 VAL H H 54 8.572 8.572 8.533 0.039 18802 1496 1 3 . 1 1 55 55 GLN N N 55 119.997 119.997 120.086 -0.089 18802 1497 1 3 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.897 -0.196 18802 1498 1 3 . 1 1 55 55 GLN C C 55 178.604 178.604 178.373 0.231 18802 1499 1 3 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.275 0.920 18802 1500 1 3 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.459 -0.317 18802 1501 1 3 . 1 1 55 55 GLN H H 55 8.183 8.183 7.512 0.671 18802 1502 1 3 . 1 1 56 56 LEU N N 56 119.605 119.605 118.916 0.689 18802 1503 1 3 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.983 -0.037 18802 1504 1 3 . 1 1 56 56 LEU C C 56 180.439 180.439 179.277 1.162 18802 1505 1 3 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.748 0.487 18802 1506 1 3 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.412 0.437 18802 1507 1 3 . 1 1 56 56 LEU H H 56 7.586 7.586 7.596 -0.010 18802 1508 1 3 . 1 1 57 57 GLN N N 57 120.332 120.332 118.774 1.558 18802 1509 1 3 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.970 0.139 18802 1510 1 3 . 1 1 57 57 GLN C C 57 179.166 179.166 178.783 0.383 18802 1511 1 3 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.841 0.549 18802 1512 1 3 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.668 0.822 18802 1513 1 3 . 1 1 57 57 GLN H H 57 8.046 8.046 7.626 0.420 18802 1514 1 3 . 1 1 58 58 ILE N N 58 120.945 120.945 120.897 0.048 18802 1515 1 3 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.535 -0.130 18802 1516 1 3 . 1 1 58 58 ILE C C 58 179.368 179.368 177.902 1.466 18802 1517 1 3 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.942 1.124 18802 1518 1 3 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.772 0.484 18802 1519 1 3 . 1 1 58 58 ILE H H 58 8.778 8.778 8.535 0.243 18802 1520 1 3 . 1 1 59 59 GLU N N 59 122.689 122.689 119.107 3.582 18802 1521 1 3 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.935 0.112 18802 1522 1 3 . 1 1 59 59 GLU C C 59 178.901 178.901 178.615 0.286 18802 1523 1 3 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.418 0.446 18802 1524 1 3 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.958 0.578 18802 1525 1 3 . 1 1 59 59 GLU H H 59 8.305 8.305 8.533 -0.228 18802 1526 1 3 . 1 1 60 60 ASP N N 60 121.505 121.505 121.593 -0.088 18802 1527 1 3 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.352 0.085 18802 1528 1 3 . 1 1 60 60 ASP C C 60 178.312 178.312 178.549 -0.237 18802 1529 1 3 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.249 0.866 18802 1530 1 3 . 1 1 60 60 ASP CB C 60 42.248 42.248 41.100 1.147 18802 1531 1 3 . 1 1 60 60 ASP H H 60 8.142 8.142 7.966 0.175 18802 1532 1 3 . 1 1 61 61 LEU N N 61 118.666 118.666 119.983 -1.317 18802 1533 1 3 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.921 0.004 18802 1534 1 3 . 1 1 61 61 LEU C C 61 178.866 178.866 179.108 -0.242 18802 1535 1 3 . 1 1 61 61 LEU CA C 61 58.302 58.302 57.955 0.347 18802 1536 1 3 . 1 1 61 61 LEU CB C 61 42.610 42.610 41.947 0.663 18802 1537 1 3 . 1 1 61 61 LEU H H 61 8.425 8.425 8.434 -0.009 18802 1538 1 3 . 1 1 62 62 THR N N 62 115.786 115.786 114.437 1.349 18802 1539 1 3 . 1 1 62 62 THR HA H 62 3.771 3.771 3.955 -0.184 18802 1540 1 3 . 1 1 62 62 THR C C 62 175.988 175.988 176.443 -0.455 18802 1541 1 3 . 1 1 62 62 THR CA C 62 67.649 67.649 66.622 1.027 18802 1542 1 3 . 1 1 62 62 THR CB C 62 68.848 68.848 68.263 0.585 18802 1543 1 3 . 1 1 62 62 THR H H 62 8.340 8.340 8.445 -0.105 18802 1544 1 3 . 1 1 63 63 ARG N N 63 122.111 122.111 121.950 0.161 18802 1545 1 3 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.957 0.032 18802 1546 1 3 . 1 1 63 63 ARG C C 63 179.715 179.715 177.833 1.882 18802 1547 1 3 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.848 0.238 18802 1548 1 3 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.184 -0.373 18802 1549 1 3 . 1 1 63 63 ARG H H 63 8.024 8.024 8.428 -0.404 18802 1550 1 3 . 1 1 64 64 LYS N N 64 120.824 120.824 120.015 0.809 18802 1551 1 3 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.118 -0.264 18802 1552 1 3 . 1 1 64 64 LYS C C 64 178.707 178.707 179.277 -0.570 18802 1553 1 3 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.577 0.978 18802 1554 1 3 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.309 0.869 18802 1555 1 3 . 1 1 64 64 LYS H H 64 8.130 8.130 7.666 0.464 18802 1556 1 3 . 1 1 65 65 LEU N N 65 118.497 118.497 115.857 2.640 18802 1557 1 3 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.109 -0.140 18802 1558 1 3 . 1 1 65 65 LEU C C 65 179.023 179.023 178.949 0.074 18802 1559 1 3 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.542 -0.262 18802 1560 1 3 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.404 0.986 18802 1561 1 3 . 1 1 65 65 LEU H H 65 8.108 8.108 7.823 0.285 18802 1562 1 3 . 1 1 66 66 ARG N N 66 119.000 119.000 118.020 0.980 18802 1563 1 3 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.138 0.076 18802 1564 1 3 . 1 1 66 66 ARG C C 66 178.064 178.064 178.358 -0.294 18802 1565 1 3 . 1 1 66 66 ARG CA C 66 58.224 58.224 59.055 -0.831 18802 1566 1 3 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.665 -0.042 18802 1567 1 3 . 1 1 66 66 ARG H H 66 8.102 8.102 8.092 0.010 18802 1568 1 3 . 1 1 67 67 THR N N 67 109.849 109.849 109.753 0.096 18802 1569 1 3 . 1 1 67 67 THR HA H 67 4.313 4.313 4.447 -0.134 18802 1570 1 3 . 1 1 67 67 THR C C 67 175.834 175.834 175.269 0.565 18802 1571 1 3 . 1 1 67 67 THR CA C 67 62.681 62.681 61.727 0.954 18802 1572 1 3 . 1 1 67 67 THR CB C 67 70.768 70.768 69.930 0.838 18802 1573 1 3 . 1 1 67 67 THR H H 67 7.956 7.956 8.158 -0.202 18802 1574 1 3 . 1 1 68 68 GLY N N 68 110.673 110.673 110.833 -0.160 18802 1575 1 3 . 1 1 68 68 GLY C C 68 173.968 173.968 173.545 0.423 18802 1576 1 3 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.062 0.968 18802 1577 1 3 . 1 1 68 68 GLY H H 68 8.016 8.016 7.950 0.066 18802 1578 1 3 . 1 1 69 69 ASP N N 69 121.490 121.490 120.464 1.026 18802 1579 1 3 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.788 -0.133 18802 1580 1 3 . 1 1 69 69 ASP C C 69 175.983 175.983 176.161 -0.178 18802 1581 1 3 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.499 0.356 18802 1582 1 3 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.698 -0.052 18802 1583 1 3 . 1 1 69 69 ASP H H 69 8.048 8.048 7.833 0.215 18802 1584 1 3 . 1 1 70 70 LEU N N 70 120.838 120.838 126.038 -5.200 18802 1585 1 3 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.465 -0.326 18802 1586 1 3 . 1 1 70 70 LEU C C 70 177.530 177.530 177.570 -0.040 18802 1587 1 3 . 1 1 70 70 LEU CA C 70 55.280 55.280 54.316 0.964 18802 1588 1 3 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.744 -0.608 18802 1589 1 3 . 1 1 70 70 LEU H H 70 7.988 7.988 7.833 0.155 18802 1590 1 3 . 1 1 71 71 GLY N N 71 108.059 108.059 107.114 0.945 18802 1591 1 3 . 1 1 71 71 GLY C C 71 173.936 173.936 174.582 -0.646 18802 1592 1 3 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.578 -0.020 18802 1593 1 3 . 1 1 71 71 GLY H H 71 8.341 8.341 8.386 -0.045 18802 1594 1 3 . 1 1 72 72 ILE N N 72 121.037 121.037 122.244 -1.207 18802 1595 1 3 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.349 0.045 18802 1596 1 3 . 1 1 72 72 ILE C C 72 174.227 174.227 174.102 0.125 18802 1597 1 3 . 1 1 72 72 ILE CA C 72 58.539 58.539 58.500 0.039 18802 1598 1 3 . 1 1 72 72 ILE CB C 72 38.810 38.810 39.298 -0.488 18802 1599 1 3 . 1 1 72 72 ILE H H 72 7.793 7.793 7.783 0.010 18802 1600 1 3 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.623 -0.001 18802 1601 1 3 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.744 -0.104 18802 1602 1 3 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.365 -0.261 18802 1603 1 3 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.479 -0.107 18802 1604 1 3 . 1 1 74 74 PRO C C 74 176.423 176.423 175.665 0.758 18802 1605 1 3 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.999 0.042 18802 1606 1 3 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.171 -0.141 18802 1607 1 3 . 1 1 75 75 ASN N N 75 119.550 119.550 121.088 -1.538 18802 1608 1 3 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.928 0.001 18802 1609 1 3 . 1 1 75 75 ASN C C 75 174.066 174.066 174.945 -0.879 18802 1610 1 3 . 1 1 75 75 ASN CA C 75 51.151 51.151 50.080 1.071 18802 1611 1 3 . 1 1 75 75 ASN CB C 75 38.924 38.924 39.024 -0.100 18802 1612 1 3 . 1 1 75 75 ASN H H 75 8.422 8.422 8.317 0.105 18802 1613 1 3 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.363 -0.070 18802 1614 1 3 . 1 1 76 76 PRO C C 76 177.322 177.322 177.494 -0.172 18802 1615 1 3 . 1 1 76 76 PRO CA C 76 64.384 64.384 64.437 -0.053 18802 1616 1 3 . 1 1 76 76 PRO CB C 76 32.236 32.236 32.022 0.214 18802 1617 1 3 . 1 1 77 77 GLU N N 77 118.523 118.523 117.424 1.099 18802 1618 1 3 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.220 -0.044 18802 1619 1 3 . 1 1 77 77 GLU C C 77 176.403 176.403 177.342 -0.939 18802 1620 1 3 . 1 1 77 77 GLU CA C 77 56.977 56.977 57.901 -0.924 18802 1621 1 3 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.663 1.197 18802 1622 1 3 . 1 1 77 77 GLU H H 77 8.426 8.426 8.600 -0.174 18802 1623 1 3 . 1 1 78 78 ASP N N 78 120.581 120.581 118.632 1.949 18802 1624 1 3 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.562 -0.019 18802 1625 1 3 . 1 1 78 78 ASP C C 78 176.085 176.085 176.205 -0.120 18802 1626 1 3 . 1 1 78 78 ASP CA C 78 54.544 54.544 55.002 -0.458 18802 1627 1 3 . 1 1 78 78 ASP CB C 78 41.239 41.239 41.895 -0.656 18802 1628 1 3 . 1 1 78 78 ASP H H 78 7.941 7.941 7.658 0.283 18802 1629 1 3 . 1 1 79 79 ARG N N 79 121.043 121.043 117.291 3.752 18802 1630 1 3 . 1 1 79 79 ARG HA H 79 4.325 4.325 3.993 0.332 18802 1631 1 3 . 1 1 79 79 ARG C C 79 176.123 176.123 175.160 0.963 18802 1632 1 3 . 1 1 79 79 ARG CA C 79 55.927 55.927 56.432 -0.505 18802 1633 1 3 . 1 1 79 79 ARG CB C 79 30.650 30.650 27.623 3.027 18802 1634 1 3 . 1 1 79 79 ARG H H 79 8.066 8.066 7.643 0.423 18802 1635 1 3 . 1 1 80 80 SER N N 80 118.338 118.338 115.591 2.747 18802 1636 1 3 . 1 1 80 80 SER HA H 80 4.672 4.672 4.520 0.152 18802 1637 1 3 . 1 1 80 80 SER C C 80 172.577 172.577 174.389 -1.812 18802 1638 1 3 . 1 1 80 80 SER CA C 80 56.564 56.564 57.189 -0.625 18802 1639 1 3 . 1 1 80 80 SER CB C 80 63.415 63.415 63.504 -0.089 18802 1640 1 3 . 1 1 80 80 SER H H 80 8.281 8.281 8.133 0.148 18802 1641 1 3 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.509 -0.089 18802 1642 1 3 . 1 1 81 81 PRO C C 81 176.727 176.727 176.127 0.600 18802 1643 1 3 . 1 1 81 81 PRO CA C 81 63.263 63.263 62.857 0.406 18802 1644 1 3 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.373 -0.321 18802 1645 1 3 . 1 1 82 82 SER N N 82 117.341 117.341 116.802 0.539 18802 1646 1 3 . 1 1 82 82 SER HA H 82 4.693 4.693 4.798 -0.105 18802 1647 1 3 . 1 1 82 82 SER C C 82 172.803 172.803 172.488 0.315 18802 1648 1 3 . 1 1 82 82 SER CA C 82 56.288 56.288 55.686 0.602 18802 1649 1 3 . 1 1 82 82 SER CB C 82 63.500 63.500 63.798 -0.298 18802 1650 1 3 . 1 1 82 82 SER H H 82 8.280 8.280 8.329 -0.049 18802 1651 1 3 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.642 -0.331 18802 1652 1 3 . 1 1 83 83 PRO C C 83 176.273 176.273 175.895 0.378 18802 1653 1 3 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.358 0.757 18802 1654 1 3 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.426 -0.327 18802 1655 1 3 . 1 1 84 84 GLU N N 84 122.213 122.213 122.684 -0.471 18802 1656 1 3 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.428 0.065 18802 1657 1 3 . 1 1 84 84 GLU C C 84 174.546 174.546 174.863 -0.317 18802 1658 1 3 . 1 1 84 84 GLU CA C 84 54.529 54.529 53.873 0.656 18802 1659 1 3 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.399 0.538 18802 1660 1 3 . 1 1 84 84 GLU H H 84 8.230 8.230 8.458 -0.228 18802 1661 1 3 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.362 0.053 18802 1662 1 3 . 1 1 85 85 PRO C C 85 176.024 176.024 175.463 0.561 18802 1663 1 3 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.653 0.589 18802 1664 1 3 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.197 -0.008 18802 1665 1 3 . 1 1 86 86 ILE N N 86 120.281 120.281 121.593 -1.312 18802 1666 1 3 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.005 0.057 18802 1667 1 3 . 1 1 86 86 ILE C C 86 175.419 175.419 175.371 0.048 18802 1668 1 3 . 1 1 86 86 ILE CA C 86 61.029 61.029 60.085 0.944 18802 1669 1 3 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.317 -0.059 18802 1670 1 3 . 1 1 86 86 ILE H H 86 7.980 7.980 7.966 0.014 18802 1671 1 3 . 1 1 87 87 TYR N N 87 123.089 123.089 125.812 -2.723 18802 1672 1 3 . 1 1 87 87 TYR HA H 87 4.817 4.817 5.088 -0.271 18802 1673 1 3 . 1 1 87 87 TYR C C 87 175.920 175.920 176.296 -0.376 18802 1674 1 3 . 1 1 87 87 TYR CA C 87 57.197 57.197 57.156 0.041 18802 1675 1 3 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.839 0.339 18802 1676 1 3 . 1 1 87 87 TYR H H 87 8.194 8.194 8.445 -0.251 18802 1677 1 3 . 1 1 88 88 ASN N N 88 120.117 120.117 119.981 0.136 18802 1678 1 3 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.884 -0.139 18802 1679 1 3 . 1 1 88 88 ASN C C 88 176.275 176.275 176.904 -0.629 18802 1680 1 3 . 1 1 88 88 ASN CA C 88 52.286 52.286 52.728 -0.442 18802 1681 1 3 . 1 1 88 88 ASN CB C 88 39.082 39.082 39.527 -0.445 18802 1682 1 3 . 1 1 88 88 ASN H H 88 8.386 8.386 8.628 -0.242 18802 1683 1 3 . 1 1 89 89 SER N N 89 115.826 115.826 117.044 -1.218 18802 1684 1 3 . 1 1 89 89 SER HA H 89 4.248 4.248 4.294 -0.046 18802 1685 1 3 . 1 1 89 89 SER C C 89 175.066 175.066 174.850 0.216 18802 1686 1 3 . 1 1 89 89 SER CA C 89 60.012 60.012 60.935 -0.923 18802 1687 1 3 . 1 1 89 89 SER CB C 89 63.400 63.400 62.841 0.559 18802 1688 1 3 . 1 1 89 89 SER H H 89 8.371 8.371 8.676 -0.305 18802 1689 1 3 . 1 1 90 90 GLU N N 90 121.062 121.062 119.154 1.908 18802 1690 1 3 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.327 -0.049 18802 1691 1 3 . 1 1 90 90 GLU C C 90 176.936 176.936 176.465 0.471 18802 1692 1 3 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.139 0.642 18802 1693 1 3 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.197 0.866 18802 1694 1 3 . 1 1 90 90 GLU H H 90 8.018 8.018 8.117 -0.099 18802 1695 1 3 . 1 1 91 91 GLY N N 91 108.499 108.499 108.905 -0.406 18802 1696 1 3 . 1 1 91 91 GLY C C 91 174.115 174.115 173.851 0.264 18802 1697 1 3 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.071 0.673 18802 1698 1 3 . 1 1 91 91 GLY H H 91 8.199 8.199 8.174 0.025 18802 1699 1 3 . 1 1 92 92 LYS N N 92 120.638 120.638 120.336 0.302 18802 1700 1 3 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.454 -0.145 18802 1701 1 3 . 1 1 92 92 LYS C C 92 176.453 176.453 175.264 1.189 18802 1702 1 3 . 1 1 92 92 LYS CA C 92 55.856 55.856 55.867 -0.011 18802 1703 1 3 . 1 1 92 92 LYS CB C 92 33.109 33.109 33.859 -0.750 18802 1704 1 3 . 1 1 92 92 LYS H H 92 7.956 7.956 7.795 0.161 18802 1705 1 3 . 1 1 93 93 ARG N N 93 122.999 122.999 124.511 -1.512 18802 1706 1 3 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.378 -0.187 18802 1707 1 3 . 1 1 93 93 ARG C C 93 176.325 176.325 174.651 1.674 18802 1708 1 3 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.742 0.640 18802 1709 1 3 . 1 1 93 93 ARG CB C 93 30.656 30.656 32.013 -1.357 18802 1710 1 3 . 1 1 93 93 ARG H H 93 8.403 8.403 8.742 -0.339 18802 1711 1 3 . 1 1 94 94 LEU N N 94 124.100 124.100 122.092 2.008 18802 1712 1 3 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.616 -0.353 18802 1713 1 3 . 1 1 94 94 LEU C C 94 176.993 176.993 175.289 1.704 18802 1714 1 3 . 1 1 94 94 LEU CA C 94 55.034 55.034 54.767 0.267 18802 1715 1 3 . 1 1 94 94 LEU CB C 94 42.941 42.941 42.460 0.481 18802 1716 1 3 . 1 1 94 94 LEU H H 94 8.283 8.283 8.452 -0.169 18802 1717 1 3 . 1 1 95 95 ASN N N 95 119.593 119.593 116.807 2.786 18802 1718 1 3 . 1 1 95 95 ASN HA H 95 4.747 4.747 5.275 -0.528 18802 1719 1 3 . 1 1 95 95 ASN C C 95 175.598 175.598 174.427 1.171 18802 1720 1 3 . 1 1 95 95 ASN CA C 95 52.680 52.680 52.472 0.208 18802 1721 1 3 . 1 1 95 95 ASN CB C 95 38.723 38.723 41.676 -2.953 18802 1722 1 3 . 1 1 95 95 ASN H H 95 8.460 8.460 7.798 0.662 18802 1723 1 3 . 1 1 96 96 THR N N 96 114.100 114.100 115.226 -1.126 18802 1724 1 3 . 1 1 96 96 THR HA H 96 4.226 4.226 4.542 -0.316 18802 1725 1 3 . 1 1 96 96 THR C C 96 175.186 175.186 175.207 -0.021 18802 1726 1 3 . 1 1 96 96 THR CA C 96 62.203 62.203 63.718 -1.516 18802 1727 1 3 . 1 1 96 96 THR CB C 96 69.880 69.880 70.815 -0.935 18802 1728 1 3 . 1 1 96 96 THR H H 96 8.031 8.031 9.461 -1.430 18802 1729 1 3 . 1 1 97 97 ARG N N 97 122.587 122.587 123.076 -0.489 18802 1730 1 3 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.165 -0.052 18802 1731 1 3 . 1 1 97 97 ARG C C 97 177.938 177.938 177.826 0.112 18802 1732 1 3 . 1 1 97 97 ARG CA C 97 58.412 58.412 59.498 -1.086 18802 1733 1 3 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.922 0.375 18802 1734 1 3 . 1 1 97 97 ARG H H 97 8.502 8.502 8.845 -0.343 18802 1735 1 3 . 1 1 98 98 GLU N N 98 121.548 121.548 120.456 1.092 18802 1736 1 3 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.052 -0.035 18802 1737 1 3 . 1 1 98 98 GLU C C 98 177.113 177.113 178.820 -1.707 18802 1738 1 3 . 1 1 98 98 GLU CA C 98 58.680 58.680 60.008 -1.328 18802 1739 1 3 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.707 0.959 18802 1740 1 3 . 1 1 98 98 GLU H H 98 8.517 8.517 8.373 0.144 18802 1741 1 3 . 1 1 99 99 PHE N N 99 121.388 121.388 120.066 1.322 18802 1742 1 3 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.272 0.050 18802 1743 1 3 . 1 1 99 99 PHE C C 99 177.070 177.070 177.331 -0.261 18802 1744 1 3 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.135 -1.060 18802 1745 1 3 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.149 0.337 18802 1746 1 3 . 1 1 99 99 PHE H H 99 8.176 8.176 8.241 -0.065 18802 1747 1 3 . 1 1 100 100 ARG N N 100 120.211 120.211 119.480 0.731 18802 1748 1 3 . 1 1 100 100 ARG C C 100 178.159 178.159 178.720 -0.561 18802 1749 1 3 . 1 1 100 100 ARG CA C 100 58.533 58.533 60.070 -1.537 18802 1750 1 3 . 1 1 100 100 ARG CB C 100 30.588 30.588 30.210 0.378 18802 1751 1 3 . 1 1 100 100 ARG H H 100 8.377 8.377 8.254 0.123 18802 1752 1 3 . 1 1 101 101 THR N N 101 115.416 115.416 116.494 -1.078 18802 1753 1 3 . 1 1 101 101 THR HA H 101 4.022 4.022 3.988 0.034 18802 1754 1 3 . 1 1 101 101 THR C C 101 175.301 175.301 176.433 -1.132 18802 1755 1 3 . 1 1 101 101 THR CA C 101 65.141 65.141 66.531 -1.390 18802 1756 1 3 . 1 1 101 101 THR CB C 101 69.305 69.305 68.668 0.637 18802 1757 1 3 . 1 1 101 101 THR H H 101 7.992 7.992 8.107 -0.115 18802 1758 1 3 . 1 1 102 102 ARG N N 102 122.212 122.212 121.692 0.520 18802 1759 1 3 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.981 0.326 18802 1760 1 3 . 1 1 102 102 ARG C C 102 177.644 177.644 178.167 -0.523 18802 1761 1 3 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.399 1.212 18802 1762 1 3 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.309 -0.501 18802 1763 1 3 . 1 1 102 102 ARG H H 102 8.369 8.369 8.255 0.114 18802 1764 1 3 . 1 1 103 103 LYS N N 103 117.591 117.591 119.487 -1.896 18802 1765 1 3 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.884 0.076 18802 1766 1 3 . 1 1 103 103 LYS C C 103 178.913 178.913 178.656 0.257 18802 1767 1 3 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.432 0.618 18802 1768 1 3 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.602 0.539 18802 1769 1 3 . 1 1 103 103 LYS H H 103 7.941 7.941 8.233 -0.292 18802 1770 1 3 . 1 1 104 104 LYS N N 104 119.769 119.769 120.103 -0.334 18802 1771 1 3 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.054 0.092 18802 1772 1 3 . 1 1 104 104 LYS C C 104 179.377 179.377 178.879 0.498 18802 1773 1 3 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.764 0.214 18802 1774 1 3 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.627 0.564 18802 1775 1 3 . 1 1 104 104 LYS H H 104 7.615 7.615 7.502 0.113 18802 1776 1 3 . 1 1 105 105 LEU N N 105 120.500 120.500 119.038 1.462 18802 1777 1 3 . 1 1 105 105 LEU HA H 105 4.117 4.117 4.208 -0.091 18802 1778 1 3 . 1 1 105 105 LEU C C 105 179.481 179.481 179.494 -0.013 18802 1779 1 3 . 1 1 105 105 LEU CA C 105 58.261 58.261 57.810 0.451 18802 1780 1 3 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.529 0.475 18802 1781 1 3 . 1 1 105 105 LEU H H 105 8.057 8.057 7.811 0.246 18802 1782 1 3 . 1 1 106 106 GLU N N 106 118.803 118.803 119.025 -0.222 18802 1783 1 3 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.921 0.068 18802 1784 1 3 . 1 1 106 106 GLU C C 106 180.577 180.577 179.225 1.352 18802 1785 1 3 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.794 0.016 18802 1786 1 3 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.316 0.693 18802 1787 1 3 . 1 1 106 106 GLU H H 106 8.652 8.652 8.254 0.398 18802 1788 1 3 . 1 1 107 107 GLU N N 107 122.396 122.396 119.170 3.226 18802 1789 1 3 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.348 -0.242 18802 1790 1 3 . 1 1 107 107 GLU C C 107 178.457 178.457 179.322 -0.865 18802 1791 1 3 . 1 1 107 107 GLU CA C 107 59.826 59.826 58.396 1.430 18802 1792 1 3 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.183 0.379 18802 1793 1 3 . 1 1 107 107 GLU H H 107 8.281 8.281 8.305 -0.024 18802 1794 1 3 . 1 1 108 108 GLU N N 108 120.976 120.976 120.359 0.617 18802 1795 1 3 . 1 1 108 108 GLU HA H 108 4.092 4.092 3.984 0.108 18802 1796 1 3 . 1 1 108 108 GLU C C 108 179.343 179.343 178.998 0.345 18802 1797 1 3 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.353 0.343 18802 1798 1 3 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.481 0.089 18802 1799 1 3 . 1 1 108 108 GLU H H 108 8.321 8.321 8.435 -0.114 18802 1800 1 3 . 1 1 109 109 ARG N N 109 118.559 118.559 119.711 -1.152 18802 1801 1 3 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.890 -0.098 18802 1802 1 3 . 1 1 109 109 ARG C C 109 177.178 177.178 177.827 -0.649 18802 1803 1 3 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.717 0.766 18802 1804 1 3 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.185 -0.036 18802 1805 1 3 . 1 1 109 109 ARG H H 109 8.594 8.594 8.145 0.449 18802 1806 1 3 . 1 1 110 110 HIS N N 110 119.632 119.632 118.754 0.878 18802 1807 1 3 . 1 1 110 110 HIS HA H 110 4.341 4.341 3.971 0.370 18802 1808 1 3 . 1 1 110 110 HIS C C 110 177.578 177.578 177.539 0.039 18802 1809 1 3 . 1 1 110 110 HIS CA C 110 60.617 60.617 58.942 1.675 18802 1810 1 3 . 1 1 110 110 HIS CB C 110 30.509 30.509 29.910 0.600 18802 1811 1 3 . 1 1 110 110 HIS H H 110 8.465 8.465 8.425 0.040 18802 1812 1 3 . 1 1 111 111 ASN N N 111 119.587 119.587 118.328 1.259 18802 1813 1 3 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.384 -0.106 18802 1814 1 3 . 1 1 111 111 ASN C C 111 178.630 178.630 177.727 0.903 18802 1815 1 3 . 1 1 111 111 ASN CA C 111 56.281 56.281 56.028 0.253 18802 1816 1 3 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.200 -0.505 18802 1817 1 3 . 1 1 111 111 ASN H H 111 8.323 8.323 8.391 -0.068 18802 1818 1 3 . 1 1 112 112 LEU N N 112 122.320 122.320 120.303 2.017 18802 1819 1 3 . 1 1 112 112 LEU HA H 112 4.116 4.116 4.008 0.108 18802 1820 1 3 . 1 1 112 112 LEU C C 112 178.539 178.539 178.881 -0.342 18802 1821 1 3 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.668 0.311 18802 1822 1 3 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.798 0.796 18802 1823 1 3 . 1 1 112 112 LEU H H 112 7.966 7.966 7.551 0.415 18802 1824 1 3 . 1 1 113 113 ILE N N 113 121.495 121.495 120.496 0.999 18802 1825 1 3 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.787 -0.551 18802 1826 1 3 . 1 1 113 113 ILE C C 113 176.959 176.959 178.344 -1.385 18802 1827 1 3 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.630 1.424 18802 1828 1 3 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.352 1.251 18802 1829 1 3 . 1 1 113 113 ILE H H 113 8.472 8.472 8.721 -0.249 18802 1830 1 3 . 1 1 114 114 THR N N 114 115.066 115.066 116.011 -0.945 18802 1831 1 3 . 1 1 114 114 THR HA H 114 3.718 3.718 3.962 -0.244 18802 1832 1 3 . 1 1 114 114 THR C C 114 176.559 176.559 176.469 0.090 18802 1833 1 3 . 1 1 114 114 THR CA C 114 66.700 66.700 67.402 -0.702 18802 1834 1 3 . 1 1 114 114 THR CB C 114 68.759 68.759 68.393 0.366 18802 1835 1 3 . 1 1 114 114 THR H H 114 8.075 8.075 8.344 -0.269 18802 1836 1 3 . 1 1 115 115 GLU N N 115 123.259 123.259 122.156 1.103 18802 1837 1 3 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.053 -0.121 18802 1838 1 3 . 1 1 115 115 GLU C C 115 178.191 178.191 178.580 -0.389 18802 1839 1 3 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.215 0.125 18802 1840 1 3 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.644 -0.245 18802 1841 1 3 . 1 1 115 115 GLU H H 115 7.368 7.368 7.567 -0.199 18802 1842 1 3 . 1 1 116 116 MET N N 116 119.844 119.844 119.932 -0.088 18802 1843 1 3 . 1 1 116 116 MET HA H 116 4.014 4.014 4.011 0.003 18802 1844 1 3 . 1 1 116 116 MET C C 116 177.888 177.888 178.272 -0.384 18802 1845 1 3 . 1 1 116 116 MET CA C 116 57.183 57.183 57.145 0.038 18802 1846 1 3 . 1 1 116 116 MET CB C 116 32.126 32.126 31.725 0.401 18802 1847 1 3 . 1 1 116 116 MET H H 116 8.373 8.373 8.368 0.005 18802 1848 1 3 . 1 1 117 117 VAL N N 117 117.572 117.572 118.953 -1.381 18802 1849 1 3 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.202 -0.306 18802 1850 1 3 . 1 1 117 117 VAL C C 117 177.567 177.567 178.168 -0.601 18802 1851 1 3 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.505 -1.635 18802 1852 1 3 . 1 1 117 117 VAL CB C 117 32.002 32.002 30.807 1.195 18802 1853 1 3 . 1 1 117 117 VAL H H 117 8.279 8.279 8.749 -0.470 18802 1854 1 3 . 1 1 118 118 ALA N N 118 120.560 120.560 121.429 -0.869 18802 1855 1 3 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.167 -0.031 18802 1856 1 3 . 1 1 118 118 ALA C C 118 179.595 179.595 179.534 0.061 18802 1857 1 3 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.675 -0.572 18802 1858 1 3 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.692 -0.442 18802 1859 1 3 . 1 1 118 118 ALA H H 118 7.074 7.074 7.332 -0.258 18802 1860 1 3 . 1 1 119 119 LEU N N 119 117.987 117.987 118.712 -0.725 18802 1861 1 3 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.092 0.048 18802 1862 1 3 . 1 1 119 119 LEU C C 119 177.863 177.863 177.937 -0.074 18802 1863 1 3 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.464 0.208 18802 1864 1 3 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.692 0.542 18802 1865 1 3 . 1 1 119 119 LEU H H 119 7.525 7.525 7.872 -0.347 18802 1866 1 3 . 1 1 120 120 ASN N N 120 115.338 115.338 115.714 -0.376 18802 1867 1 3 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.135 -0.117 18802 1868 1 3 . 1 1 120 120 ASN C C 120 172.510 172.510 174.050 -1.540 18802 1869 1 3 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.022 0.079 18802 1870 1 3 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.029 -0.724 18802 1871 1 3 . 1 1 120 120 ASN H H 120 8.467 8.467 8.286 0.181 18802 1872 1 3 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.492 0.164 18802 1873 1 3 . 1 1 121 121 PRO C C 121 177.020 177.020 176.908 0.112 18802 1874 1 3 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.303 -0.006 18802 1875 1 3 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.252 0.047 18802 1876 1 3 . 1 1 122 122 ASP N N 122 115.744 115.744 118.237 -2.493 18802 1877 1 3 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.642 0.027 18802 1878 1 3 . 1 1 122 122 ASP C C 122 176.004 176.004 176.160 -0.156 18802 1879 1 3 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.939 0.427 18802 1880 1 3 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.505 -0.181 18802 1881 1 3 . 1 1 122 122 ASP H H 122 7.600 7.600 8.482 -0.882 18802 1882 1 3 . 1 1 123 123 PHE N N 123 122.722 122.722 122.384 0.338 18802 1883 1 3 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.371 -0.236 18802 1884 1 3 . 1 1 123 123 PHE C C 123 173.954 173.954 174.703 -0.749 18802 1885 1 3 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.406 0.587 18802 1886 1 3 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.776 -0.180 18802 1887 1 3 . 1 1 123 123 PHE H H 123 7.940 7.940 7.498 0.442 18802 1888 1 3 . 1 1 124 124 LYS N N 124 129.400 129.400 128.811 0.589 18802 1889 1 3 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.421 0.138 18802 1890 1 3 . 1 1 124 124 LYS C C 124 172.622 172.622 173.891 -1.269 18802 1891 1 3 . 1 1 124 124 LYS CA C 124 51.815 51.815 52.381 -0.566 18802 1892 1 3 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.420 1.161 18802 1893 1 3 . 1 1 124 124 LYS H H 124 7.602 7.602 8.209 -0.607 18802 1894 1 3 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.143 -0.054 18802 1895 1 3 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.558 -0.562 18802 1896 1 3 . 1 1 125 125 PRO CB C 125 31.067 31.067 30.739 0.328 18802 1897 1 3 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.404 -0.030 18802 1898 1 3 . 1 1 126 126 PRO C C 126 177.630 177.630 177.700 -0.070 18802 1899 1 3 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.774 0.039 18802 1900 1 3 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.257 0.064 18802 1901 1 3 . 1 1 127 127 ALA N N 127 123.830 123.830 123.069 0.761 18802 1902 1 3 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.129 -0.071 18802 1903 1 3 . 1 1 127 127 ALA C C 127 177.641 177.641 177.768 -0.127 18802 1904 1 3 . 1 1 127 127 ALA CA C 127 54.602 54.602 53.987 0.615 18802 1905 1 3 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.836 0.013 18802 1906 1 3 . 1 1 127 127 ALA H H 127 8.630 8.630 8.555 0.075 18802 1907 1 3 . 1 1 128 128 ASP N N 128 112.924 112.924 115.848 -2.924 18802 1908 1 3 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.586 -0.135 18802 1909 1 3 . 1 1 128 128 ASP C C 128 175.724 175.724 175.868 -0.144 18802 1910 1 3 . 1 1 128 128 ASP CA C 128 53.604 53.604 55.038 -1.434 18802 1911 1 3 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.966 -0.548 18802 1912 1 3 . 1 1 128 128 ASP H H 128 8.335 8.335 8.188 0.147 18802 1913 1 3 . 1 1 129 129 TYR N N 129 121.114 121.114 122.406 -1.292 18802 1914 1 3 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.436 -0.074 18802 1915 1 3 . 1 1 129 129 TYR C C 129 174.190 174.190 174.298 -0.108 18802 1916 1 3 . 1 1 129 129 TYR CA C 129 58.412 58.412 58.268 0.144 18802 1917 1 3 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.984 0.075 18802 1918 1 3 . 1 1 129 129 TYR H H 129 7.600 7.600 7.593 0.007 18802 1919 1 3 . 1 1 130 130 LYS N N 130 129.875 129.875 129.416 0.459 18802 1920 1 3 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.443 -0.125 18802 1921 1 3 . 1 1 130 130 LYS C C 130 172.314 172.314 173.965 -1.651 18802 1922 1 3 . 1 1 130 130 LYS CA C 130 52.570 52.570 52.012 0.558 18802 1923 1 3 . 1 1 130 130 LYS CB C 130 33.663 33.663 31.767 1.896 18802 1924 1 3 . 1 1 130 130 LYS H H 130 7.695 7.695 8.226 -0.531 18802 1925 1 3 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.045 0.232 18802 1926 1 3 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.355 -0.297 18802 1927 1 3 . 1 1 131 131 PRO CB C 131 30.852 30.852 31.142 -0.290 18802 1928 1 3 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.500 -0.256 18802 1929 1 3 . 1 1 132 132 PRO C C 132 176.459 176.459 177.015 -0.556 18802 1930 1 3 . 1 1 132 132 PRO CA C 132 62.874 62.874 62.242 0.632 18802 1931 1 3 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.635 -0.588 18802 1932 1 3 . 1 1 133 133 ALA N N 133 124.170 124.170 122.893 1.277 18802 1933 1 3 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.345 -0.095 18802 1934 1 3 . 1 1 133 133 ALA C C 133 177.870 177.870 178.454 -0.584 18802 1935 1 3 . 1 1 133 133 ALA CA C 133 52.508 52.508 53.406 -0.898 18802 1936 1 3 . 1 1 133 133 ALA CB C 133 19.303 19.303 18.997 0.306 18802 1937 1 3 . 1 1 133 133 ALA H H 133 8.311 8.311 8.442 -0.131 18802 1938 1 3 . 1 1 134 134 THR N N 134 113.807 113.807 111.284 2.523 18802 1939 1 3 . 1 1 134 134 THR HA H 134 4.228 4.228 4.290 -0.062 18802 1940 1 3 . 1 1 134 134 THR C C 134 174.282 174.282 175.722 -1.440 18802 1941 1 3 . 1 1 134 134 THR CA C 134 62.127 62.127 63.785 -1.659 18802 1942 1 3 . 1 1 134 134 THR CB C 134 69.870 69.870 68.810 1.060 18802 1943 1 3 . 1 1 134 134 THR H H 134 8.019 8.019 7.775 0.244 18802 1944 1 3 . 1 1 135 135 ARG N N 135 124.165 124.165 122.703 1.462 18802 1945 1 3 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.298 0.051 18802 1946 1 3 . 1 1 135 135 ARG C C 135 176.217 176.217 178.359 -2.142 18802 1947 1 3 . 1 1 135 135 ARG CA C 135 55.993 55.993 56.720 -0.727 18802 1948 1 3 . 1 1 135 135 ARG CB C 135 30.992 30.992 30.321 0.671 18802 1949 1 3 . 1 1 135 135 ARG H H 135 8.300 8.300 8.281 0.019 18802 1950 1 3 . 1 1 136 136 VAL N N 136 122.157 122.157 117.226 4.931 18802 1951 1 3 . 1 1 136 136 VAL HA H 136 4.070 4.070 3.573 0.497 18802 1952 1 3 . 1 1 136 136 VAL C C 136 176.180 176.180 175.428 0.752 18802 1953 1 3 . 1 1 136 136 VAL CA C 136 61.937 61.937 64.215 -2.278 18802 1954 1 3 . 1 1 136 136 VAL CB C 136 32.747 32.747 31.306 1.441 18802 1955 1 3 . 1 1 136 136 VAL H H 136 8.233 8.233 8.596 -0.363 18802 1956 1 3 . 1 1 137 137 SER N N 137 118.837 118.837 115.740 3.097 18802 1957 1 3 . 1 1 137 137 SER HA H 137 4.416 4.416 4.143 0.273 18802 1958 1 3 . 1 1 137 137 SER C C 137 174.258 174.258 174.528 -0.270 18802 1959 1 3 . 1 1 137 137 SER CA C 137 58.341 58.341 58.926 -0.585 18802 1960 1 3 . 1 1 137 137 SER CB C 137 63.900 63.900 62.577 1.323 18802 1961 1 3 . 1 1 137 137 SER H H 137 8.264 8.264 8.245 0.019 18802 1962 1 3 . 1 1 138 138 ASP N N 138 122.871 122.871 119.413 3.458 18802 1963 1 3 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.504 0.033 18802 1964 1 3 . 1 1 138 138 ASP C C 138 176.053 176.053 176.662 -0.609 18802 1965 1 3 . 1 1 138 138 ASP CA C 138 54.489 54.489 55.087 -0.598 18802 1966 1 3 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.284 -0.136 18802 1967 1 3 . 1 1 138 138 ASP H H 138 8.249 8.249 8.592 -0.343 18802 1968 1 3 . 1 1 139 139 LYS N N 139 120.944 120.944 121.091 -0.147 18802 1969 1 3 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.396 -0.136 18802 1970 1 3 . 1 1 139 139 LYS C C 139 176.343 176.343 176.318 0.025 18802 1971 1 3 . 1 1 139 139 LYS CA C 139 56.261 56.261 55.722 0.539 18802 1972 1 3 . 1 1 139 139 LYS CB C 139 33.077 33.077 32.222 0.855 18802 1973 1 3 . 1 1 139 139 LYS H H 139 8.084 8.084 7.970 0.114 18802 1974 1 3 . 1 1 140 140 VAL N N 140 121.670 121.670 121.022 0.648 18802 1975 1 3 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.477 -0.465 18802 1976 1 3 . 1 1 140 140 VAL C C 140 175.842 175.842 175.944 -0.102 18802 1977 1 3 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.447 0.995 18802 1978 1 3 . 1 1 140 140 VAL CB C 140 32.867 32.867 33.571 -0.704 18802 1979 1 3 . 1 1 140 140 VAL H H 140 8.025 8.025 8.237 -0.212 18802 1980 1 3 . 1 1 141 141 MET N N 141 124.839 124.839 122.488 2.351 18802 1981 1 3 . 1 1 141 141 MET HA H 141 4.453 4.453 4.838 -0.385 18802 1982 1 3 . 1 1 141 141 MET C C 141 175.562 175.562 175.558 0.004 18802 1983 1 3 . 1 1 141 141 MET CA C 141 55.349 55.349 55.718 -0.369 18802 1984 1 3 . 1 1 141 141 MET CB C 141 32.993 32.993 33.369 -0.376 18802 1985 1 3 . 1 1 141 141 MET H H 141 8.364 8.364 8.316 0.048 18802 1986 1 3 . 1 1 142 142 ILE N N 142 124.515 124.515 126.190 -1.675 18802 1987 1 3 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.487 -0.059 18802 1988 1 3 . 1 1 142 142 ILE C C 142 174.331 174.331 173.915 0.416 18802 1989 1 3 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.587 -0.184 18802 1990 1 3 . 1 1 142 142 ILE CB C 142 38.755 38.755 38.953 -0.197 18802 1991 1 3 . 1 1 142 142 ILE H H 142 8.093 8.093 8.441 -0.348 18802 1992 1 3 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.565 -0.215 18802 1993 1 3 . 1 1 143 143 PRO C C 143 176.623 176.623 176.182 0.441 18802 1994 1 3 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.277 1.138 18802 1995 1 3 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.218 0.015 18802 1996 1 3 . 1 1 144 144 GLN N N 144 121.557 121.557 121.263 0.294 18802 1997 1 3 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.386 -0.080 18802 1998 1 3 . 1 1 144 144 GLN C C 144 174.751 174.751 175.478 -0.727 18802 1999 1 3 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.323 0.348 18802 2000 1 3 . 1 1 144 144 GLN CB C 144 30.118 30.118 28.947 1.171 18802 2001 1 3 . 1 1 144 144 GLN H H 144 8.392 8.392 8.439 -0.047 18802 2002 1 4 . 1 1 26 26 ALA N N 26 124.085 124.085 125.848 -1.763 18802 2003 1 4 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.664 -0.372 18802 2004 1 4 . 1 1 26 26 ALA C C 26 177.101 177.101 177.317 -0.216 18802 2005 1 4 . 1 1 26 26 ALA CA C 26 52.921 52.921 51.275 1.646 18802 2006 1 4 . 1 1 26 26 ALA CB C 26 19.426 19.426 20.443 -1.017 18802 2007 1 4 . 1 1 26 26 ALA H H 26 8.498 8.498 8.207 0.291 18802 2008 1 4 . 1 1 27 27 MET N N 27 119.630 119.630 122.570 -2.940 18802 2009 1 4 . 1 1 27 27 MET HA H 27 4.391 4.391 4.523 -0.132 18802 2010 1 4 . 1 1 27 27 MET C C 27 176.296 176.296 176.131 0.165 18802 2011 1 4 . 1 1 27 27 MET CA C 27 55.834 55.834 55.255 0.579 18802 2012 1 4 . 1 1 27 27 MET CB C 27 32.663 32.663 32.989 -0.326 18802 2013 1 4 . 1 1 27 27 MET H H 27 8.441 8.441 8.548 -0.107 18802 2014 1 4 . 1 1 28 28 GLU N N 28 122.376 122.376 124.762 -2.386 18802 2015 1 4 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.295 -0.081 18802 2016 1 4 . 1 1 28 28 GLU C C 28 176.310 176.310 176.265 0.045 18802 2017 1 4 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.833 -0.014 18802 2018 1 4 . 1 1 28 28 GLU CB C 28 30.252 30.252 29.990 0.262 18802 2019 1 4 . 1 1 28 28 GLU H H 28 8.336 8.336 8.757 -0.421 18802 2020 1 4 . 1 1 29 29 GLN N N 29 122.010 122.010 119.903 2.107 18802 2021 1 4 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.271 0.020 18802 2022 1 4 . 1 1 29 29 GLN C C 29 175.765 175.765 175.478 0.287 18802 2023 1 4 . 1 1 29 29 GLN CA C 29 55.839 55.839 55.566 0.273 18802 2024 1 4 . 1 1 29 29 GLN CB C 29 29.559 29.559 29.323 0.236 18802 2025 1 4 . 1 1 29 29 GLN H H 29 8.347 8.347 7.850 0.497 18802 2026 1 4 . 1 1 30 30 LYS N N 30 123.090 123.090 125.178 -2.088 18802 2027 1 4 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.219 0.117 18802 2028 1 4 . 1 1 30 30 LYS C C 30 176.474 176.474 176.494 -0.020 18802 2029 1 4 . 1 1 30 30 LYS CA C 30 56.391 56.391 55.924 0.467 18802 2030 1 4 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.199 0.794 18802 2031 1 4 . 1 1 30 30 LYS H H 30 8.327 8.327 8.473 -0.146 18802 2032 1 4 . 1 1 31 31 THR N N 31 116.800 116.800 117.647 -0.847 18802 2033 1 4 . 1 1 31 31 THR HA H 31 4.273 4.273 4.226 0.047 18802 2034 1 4 . 1 1 31 31 THR C C 31 174.071 174.071 174.944 -0.873 18802 2035 1 4 . 1 1 31 31 THR CA C 31 62.103 62.103 62.394 -0.291 18802 2036 1 4 . 1 1 31 31 THR CB C 31 69.899 69.899 69.597 0.302 18802 2037 1 4 . 1 1 31 31 THR H H 31 8.160 8.160 8.343 -0.183 18802 2038 1 4 . 1 1 32 32 VAL N N 32 124.108 124.108 125.799 -1.691 18802 2039 1 4 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.292 -0.226 18802 2040 1 4 . 1 1 32 32 VAL C C 32 175.573 175.573 174.927 0.646 18802 2041 1 4 . 1 1 32 32 VAL CA C 32 62.344 62.344 61.358 0.986 18802 2042 1 4 . 1 1 32 32 VAL CB C 32 32.912 32.912 33.162 -0.250 18802 2043 1 4 . 1 1 32 32 VAL H H 32 8.192 8.192 8.334 -0.142 18802 2044 1 4 . 1 1 33 33 ILE N N 33 127.371 127.371 127.790 -0.419 18802 2045 1 4 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.558 -0.134 18802 2046 1 4 . 1 1 33 33 ILE C C 33 174.335 174.335 173.923 0.412 18802 2047 1 4 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.042 1.352 18802 2048 1 4 . 1 1 33 33 ILE CB C 33 38.799 38.799 37.237 1.562 18802 2049 1 4 . 1 1 33 33 ILE H H 33 8.275 8.275 8.390 -0.115 18802 2050 1 4 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.421 -0.118 18802 2051 1 4 . 1 1 34 34 PRO C C 34 177.261 177.261 177.552 -0.291 18802 2052 1 4 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.301 0.371 18802 2053 1 4 . 1 1 34 34 PRO CB C 34 32.177 32.177 32.220 -0.043 18802 2054 1 4 . 1 1 35 35 GLY N N 35 109.540 109.540 110.626 -1.086 18802 2055 1 4 . 1 1 35 35 GLY C C 35 173.906 173.906 174.023 -0.117 18802 2056 1 4 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.900 0.370 18802 2057 1 4 . 1 1 35 35 GLY H H 35 8.376 8.376 8.677 -0.301 18802 2058 1 4 . 1 1 36 36 MET N N 36 120.834 120.834 120.820 0.014 18802 2059 1 4 . 1 1 36 36 MET HA H 36 4.780 4.780 4.876 -0.096 18802 2060 1 4 . 1 1 36 36 MET C C 36 174.235 174.235 174.072 0.163 18802 2061 1 4 . 1 1 36 36 MET CA C 36 53.258 53.258 51.786 1.472 18802 2062 1 4 . 1 1 36 36 MET CB C 36 32.734 32.734 32.947 -0.213 18802 2063 1 4 . 1 1 36 36 MET H H 36 7.986 7.986 7.797 0.189 18802 2064 1 4 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.546 -0.084 18802 2065 1 4 . 1 1 37 37 PRO C C 37 176.736 176.736 176.373 0.363 18802 2066 1 4 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.846 0.412 18802 2067 1 4 . 1 1 37 37 PRO CB C 37 32.200 32.200 31.905 0.294 18802 2068 1 4 . 1 1 38 38 THR N N 38 115.642 115.642 118.761 -3.119 18802 2069 1 4 . 1 1 38 38 THR HA H 38 4.226 4.226 4.450 -0.224 18802 2070 1 4 . 1 1 38 38 THR C C 38 174.164 174.164 174.041 0.123 18802 2071 1 4 . 1 1 38 38 THR CA C 38 62.462 62.462 62.140 0.322 18802 2072 1 4 . 1 1 38 38 THR CB C 38 69.874 69.874 69.705 0.169 18802 2073 1 4 . 1 1 38 38 THR H H 38 8.189 8.189 8.289 -0.100 18802 2074 1 4 . 1 1 39 39 VAL N N 39 123.700 123.700 125.823 -2.123 18802 2075 1 4 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.289 -0.210 18802 2076 1 4 . 1 1 39 39 VAL C C 39 175.177 175.177 175.677 -0.500 18802 2077 1 4 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.537 0.454 18802 2078 1 4 . 1 1 39 39 VAL CB C 39 32.898 32.898 33.308 -0.410 18802 2079 1 4 . 1 1 39 39 VAL H H 39 8.036 8.036 8.442 -0.406 18802 2080 1 4 . 1 1 40 40 ILE N N 40 127.780 127.780 127.913 -0.133 18802 2081 1 4 . 1 1 40 40 ILE HA H 40 4.177 4.177 3.887 0.290 18802 2082 1 4 . 1 1 40 40 ILE C C 40 173.894 173.894 174.636 -0.742 18802 2083 1 4 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.860 -1.949 18802 2084 1 4 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.739 0.894 18802 2085 1 4 . 1 1 40 40 ILE H H 40 8.236 8.236 8.344 -0.108 18802 2086 1 4 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.677 -0.186 18802 2087 1 4 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.160 0.464 18802 2088 1 4 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.117 -0.015 18802 2089 1 4 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.304 -0.049 18802 2090 1 4 . 1 1 42 42 PRO C C 42 177.721 177.721 177.546 0.175 18802 2091 1 4 . 1 1 42 42 PRO CA C 42 62.800 62.800 62.919 -0.119 18802 2092 1 4 . 1 1 42 42 PRO CB C 42 32.355 32.355 32.003 0.352 18802 2093 1 4 . 1 1 43 43 GLY N N 43 107.305 107.305 108.237 -0.932 18802 2094 1 4 . 1 1 43 43 GLY C C 43 174.642 174.642 173.731 0.911 18802 2095 1 4 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.843 0.875 18802 2096 1 4 . 1 1 43 43 GLY H H 43 8.321 8.321 8.501 -0.180 18802 2097 1 4 . 1 1 44 44 LEU N N 44 120.897 120.897 122.411 -1.514 18802 2098 1 4 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.453 0.076 18802 2099 1 4 . 1 1 44 44 LEU C C 44 178.580 178.580 176.395 2.185 18802 2100 1 4 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.334 0.216 18802 2101 1 4 . 1 1 44 44 LEU CB C 44 42.579 42.579 42.879 -0.300 18802 2102 1 4 . 1 1 44 44 LEU H H 44 8.043 8.043 7.667 0.376 18802 2103 1 4 . 1 1 45 45 THR N N 45 113.195 113.195 112.248 0.947 18802 2104 1 4 . 1 1 45 45 THR HA H 45 4.386 4.386 4.536 -0.150 18802 2105 1 4 . 1 1 45 45 THR C C 45 175.377 175.377 175.633 -0.256 18802 2106 1 4 . 1 1 45 45 THR CA C 45 61.188 61.188 60.292 0.896 18802 2107 1 4 . 1 1 45 45 THR CB C 45 71.043 71.043 70.976 0.067 18802 2108 1 4 . 1 1 45 45 THR H H 45 8.427 8.427 8.089 0.338 18802 2109 1 4 . 1 1 46 46 ARG N N 46 121.322 121.322 121.957 -0.635 18802 2110 1 4 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.199 -0.162 18802 2111 1 4 . 1 1 46 46 ARG C C 46 179.309 179.309 177.913 1.396 18802 2112 1 4 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.227 0.157 18802 2113 1 4 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.510 0.306 18802 2114 1 4 . 1 1 46 46 ARG H H 46 8.832 8.832 8.831 0.001 18802 2115 1 4 . 1 1 47 47 GLU N N 47 119.109 119.109 120.530 -1.421 18802 2116 1 4 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.066 -0.057 18802 2117 1 4 . 1 1 47 47 GLU C C 47 178.931 178.931 178.939 -0.008 18802 2118 1 4 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.907 0.369 18802 2119 1 4 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.293 0.998 18802 2120 1 4 . 1 1 47 47 GLU H H 47 8.754 8.754 8.232 0.522 18802 2121 1 4 . 1 1 48 48 GLN N N 48 119.556 119.556 119.899 -0.343 18802 2122 1 4 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.050 0.016 18802 2123 1 4 . 1 1 48 48 GLN C C 48 179.286 179.286 178.221 1.065 18802 2124 1 4 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.644 -0.429 18802 2125 1 4 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.319 1.349 18802 2126 1 4 . 1 1 48 48 GLN H H 48 7.711 7.711 7.898 -0.187 18802 2127 1 4 . 1 1 49 49 GLU N N 49 122.227 122.227 120.712 1.515 18802 2128 1 4 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.991 -0.118 18802 2129 1 4 . 1 1 49 49 GLU C C 49 177.879 177.879 179.197 -1.318 18802 2130 1 4 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.763 0.195 18802 2131 1 4 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.485 0.292 18802 2132 1 4 . 1 1 49 49 GLU H H 49 8.730 8.730 8.684 0.046 18802 2133 1 4 . 1 1 50 50 ARG N N 50 119.109 119.109 118.769 0.340 18802 2134 1 4 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.067 0.002 18802 2135 1 4 . 1 1 50 50 ARG C C 50 177.567 177.567 178.622 -1.055 18802 2136 1 4 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.118 0.108 18802 2137 1 4 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.212 -0.116 18802 2138 1 4 . 1 1 50 50 ARG H H 50 7.906 7.906 8.468 -0.562 18802 2139 1 4 . 1 1 51 51 ALA N N 51 119.411 119.411 122.856 -3.445 18802 2140 1 4 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.885 -0.081 18802 2141 1 4 . 1 1 51 51 ALA C C 51 178.740 178.740 179.101 -0.361 18802 2142 1 4 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.011 0.224 18802 2143 1 4 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.308 -0.049 18802 2144 1 4 . 1 1 51 51 ALA H H 51 7.956 7.956 8.367 -0.411 18802 2145 1 4 . 1 1 52 52 TYR N N 52 119.160 119.160 119.847 -0.687 18802 2146 1 4 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.141 -0.083 18802 2147 1 4 . 1 1 52 52 TYR C C 52 177.367 177.367 177.564 -0.197 18802 2148 1 4 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.614 -0.009 18802 2149 1 4 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.502 0.207 18802 2150 1 4 . 1 1 52 52 TYR H H 52 7.854 7.854 7.851 0.003 18802 2151 1 4 . 1 1 53 53 ILE N N 53 119.173 119.173 119.670 -0.497 18802 2152 1 4 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.222 0.380 18802 2153 1 4 . 1 1 53 53 ILE C C 53 178.711 178.711 178.050 0.661 18802 2154 1 4 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.535 -1.347 18802 2155 1 4 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.889 0.424 18802 2156 1 4 . 1 1 53 53 ILE H H 53 7.809 7.809 8.462 -0.653 18802 2157 1 4 . 1 1 54 54 VAL N N 54 121.549 121.549 119.896 1.653 18802 2158 1 4 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.837 -0.363 18802 2159 1 4 . 1 1 54 54 VAL C C 54 177.992 177.992 178.445 -0.453 18802 2160 1 4 . 1 1 54 54 VAL CA C 54 66.995 66.995 65.841 1.154 18802 2161 1 4 . 1 1 54 54 VAL CB C 54 31.231 31.231 30.850 0.381 18802 2162 1 4 . 1 1 54 54 VAL H H 54 8.572 8.572 8.530 0.042 18802 2163 1 4 . 1 1 55 55 GLN N N 55 119.997 119.997 119.952 0.045 18802 2164 1 4 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.933 -0.232 18802 2165 1 4 . 1 1 55 55 GLN C C 55 178.604 178.604 178.535 0.069 18802 2166 1 4 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.247 0.948 18802 2167 1 4 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.497 -0.355 18802 2168 1 4 . 1 1 55 55 GLN H H 55 8.183 8.183 7.626 0.557 18802 2169 1 4 . 1 1 56 56 LEU N N 56 119.605 119.605 119.297 0.308 18802 2170 1 4 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.837 0.109 18802 2171 1 4 . 1 1 56 56 LEU C C 56 180.439 180.439 179.284 1.155 18802 2172 1 4 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.669 0.566 18802 2173 1 4 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.401 0.448 18802 2174 1 4 . 1 1 56 56 LEU H H 56 7.586 7.586 7.753 -0.167 18802 2175 1 4 . 1 1 57 57 GLN N N 57 120.332 120.332 118.666 1.666 18802 2176 1 4 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.974 0.135 18802 2177 1 4 . 1 1 57 57 GLN C C 57 179.166 179.166 178.725 0.441 18802 2178 1 4 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.811 0.579 18802 2179 1 4 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.636 0.854 18802 2180 1 4 . 1 1 57 57 GLN H H 57 8.046 8.046 7.511 0.535 18802 2181 1 4 . 1 1 58 58 ILE N N 58 120.945 120.945 120.883 0.062 18802 2182 1 4 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.560 -0.155 18802 2183 1 4 . 1 1 58 58 ILE C C 58 179.368 179.368 177.970 1.398 18802 2184 1 4 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.870 1.196 18802 2185 1 4 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.798 0.458 18802 2186 1 4 . 1 1 58 58 ILE H H 58 8.778 8.778 8.377 0.401 18802 2187 1 4 . 1 1 59 59 GLU N N 59 122.689 122.689 119.028 3.661 18802 2188 1 4 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.961 0.086 18802 2189 1 4 . 1 1 59 59 GLU C C 59 178.901 178.901 178.619 0.282 18802 2190 1 4 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.447 0.417 18802 2191 1 4 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.929 0.607 18802 2192 1 4 . 1 1 59 59 GLU H H 59 8.305 8.305 8.725 -0.420 18802 2193 1 4 . 1 1 60 60 ASP N N 60 121.505 121.505 121.275 0.230 18802 2194 1 4 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.360 0.077 18802 2195 1 4 . 1 1 60 60 ASP C C 60 178.312 178.312 178.609 -0.297 18802 2196 1 4 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.335 0.780 18802 2197 1 4 . 1 1 60 60 ASP CB C 60 42.248 42.248 40.919 1.329 18802 2198 1 4 . 1 1 60 60 ASP H H 60 8.142 8.142 7.921 0.221 18802 2199 1 4 . 1 1 61 61 LEU N N 61 118.666 118.666 119.626 -0.960 18802 2200 1 4 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.928 -0.003 18802 2201 1 4 . 1 1 61 61 LEU C C 61 178.866 178.866 179.058 -0.192 18802 2202 1 4 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.326 -0.024 18802 2203 1 4 . 1 1 61 61 LEU CB C 61 42.610 42.610 42.015 0.595 18802 2204 1 4 . 1 1 61 61 LEU H H 61 8.425 8.425 8.363 0.062 18802 2205 1 4 . 1 1 62 62 THR N N 62 115.786 115.786 114.516 1.270 18802 2206 1 4 . 1 1 62 62 THR HA H 62 3.771 3.771 3.993 -0.222 18802 2207 1 4 . 1 1 62 62 THR C C 62 175.988 175.988 176.312 -0.324 18802 2208 1 4 . 1 1 62 62 THR CA C 62 67.649 67.649 67.231 0.418 18802 2209 1 4 . 1 1 62 62 THR CB C 62 68.848 68.848 68.398 0.450 18802 2210 1 4 . 1 1 62 62 THR H H 62 8.340 8.340 8.459 -0.119 18802 2211 1 4 . 1 1 63 63 ARG N N 63 122.111 122.111 121.688 0.423 18802 2212 1 4 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.935 0.054 18802 2213 1 4 . 1 1 63 63 ARG C C 63 179.715 179.715 177.933 1.782 18802 2214 1 4 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.690 0.396 18802 2215 1 4 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.185 -0.374 18802 2216 1 4 . 1 1 63 63 ARG H H 63 8.024 8.024 8.516 -0.492 18802 2217 1 4 . 1 1 64 64 LYS N N 64 120.824 120.824 120.469 0.355 18802 2218 1 4 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.185 -0.331 18802 2219 1 4 . 1 1 64 64 LYS C C 64 178.707 178.707 179.056 -0.349 18802 2220 1 4 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.431 1.124 18802 2221 1 4 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.395 0.783 18802 2222 1 4 . 1 1 64 64 LYS H H 64 8.130 8.130 7.574 0.556 18802 2223 1 4 . 1 1 65 65 LEU N N 65 118.497 118.497 115.117 3.380 18802 2224 1 4 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.119 -0.150 18802 2225 1 4 . 1 1 65 65 LEU C C 65 179.023 179.023 178.546 0.477 18802 2226 1 4 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.428 -0.147 18802 2227 1 4 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.425 0.965 18802 2228 1 4 . 1 1 65 65 LEU H H 65 8.108 8.108 7.980 0.128 18802 2229 1 4 . 1 1 66 66 ARG N N 66 119.000 119.000 118.357 0.643 18802 2230 1 4 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.166 0.048 18802 2231 1 4 . 1 1 66 66 ARG C C 66 178.064 178.064 178.575 -0.511 18802 2232 1 4 . 1 1 66 66 ARG CA C 66 58.224 58.224 58.498 -0.274 18802 2233 1 4 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.781 -0.158 18802 2234 1 4 . 1 1 66 66 ARG H H 66 8.102 8.102 8.285 -0.183 18802 2235 1 4 . 1 1 67 67 THR N N 67 109.849 109.849 107.091 2.758 18802 2236 1 4 . 1 1 67 67 THR HA H 67 4.313 4.313 4.497 -0.184 18802 2237 1 4 . 1 1 67 67 THR C C 67 175.834 175.834 176.176 -0.342 18802 2238 1 4 . 1 1 67 67 THR CA C 67 62.681 62.681 62.332 0.349 18802 2239 1 4 . 1 1 67 67 THR CB C 67 70.768 70.768 70.683 0.085 18802 2240 1 4 . 1 1 67 67 THR H H 67 7.956 7.956 8.055 -0.099 18802 2241 1 4 . 1 1 68 68 GLY N N 68 110.673 110.673 111.480 -0.807 18802 2242 1 4 . 1 1 68 68 GLY C C 68 173.968 173.968 173.386 0.582 18802 2243 1 4 . 1 1 68 68 GLY CA C 68 46.030 46.030 44.851 1.179 18802 2244 1 4 . 1 1 68 68 GLY H H 68 8.016 8.016 8.268 -0.252 18802 2245 1 4 . 1 1 69 69 ASP N N 69 121.490 121.490 121.359 0.131 18802 2246 1 4 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.725 -0.070 18802 2247 1 4 . 1 1 69 69 ASP C C 69 175.983 175.983 176.478 -0.495 18802 2248 1 4 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.648 0.207 18802 2249 1 4 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.754 -0.108 18802 2250 1 4 . 1 1 69 69 ASP H H 69 8.048 8.048 7.703 0.345 18802 2251 1 4 . 1 1 70 70 LEU N N 70 120.838 120.838 125.261 -4.423 18802 2252 1 4 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.435 -0.296 18802 2253 1 4 . 1 1 70 70 LEU C C 70 177.530 177.530 178.165 -0.635 18802 2254 1 4 . 1 1 70 70 LEU CA C 70 55.280 55.280 55.264 0.016 18802 2255 1 4 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.343 -0.207 18802 2256 1 4 . 1 1 70 70 LEU H H 70 7.988 7.988 7.897 0.091 18802 2257 1 4 . 1 1 71 71 GLY N N 71 108.059 108.059 106.365 1.694 18802 2258 1 4 . 1 1 71 71 GLY C C 71 173.936 173.936 174.569 -0.633 18802 2259 1 4 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.609 -0.051 18802 2260 1 4 . 1 1 71 71 GLY H H 71 8.341 8.341 8.361 -0.020 18802 2261 1 4 . 1 1 72 72 ILE N N 72 121.037 121.037 122.598 -1.561 18802 2262 1 4 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.298 0.096 18802 2263 1 4 . 1 1 72 72 ILE C C 72 174.227 174.227 174.494 -0.267 18802 2264 1 4 . 1 1 72 72 ILE CA C 72 58.539 58.539 58.771 -0.232 18802 2265 1 4 . 1 1 72 72 ILE CB C 72 38.810 38.810 39.021 -0.211 18802 2266 1 4 . 1 1 72 72 ILE H H 72 7.793 7.793 7.806 -0.013 18802 2267 1 4 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.666 -0.044 18802 2268 1 4 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.267 0.373 18802 2269 1 4 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.339 -0.235 18802 2270 1 4 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.376 -0.004 18802 2271 1 4 . 1 1 74 74 PRO C C 74 176.423 176.423 176.020 0.403 18802 2272 1 4 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.631 0.410 18802 2273 1 4 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.562 -0.532 18802 2274 1 4 . 1 1 75 75 ASN N N 75 119.550 119.550 120.514 -0.964 18802 2275 1 4 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.712 0.217 18802 2276 1 4 . 1 1 75 75 ASN C C 75 174.066 174.066 176.112 -2.046 18802 2277 1 4 . 1 1 75 75 ASN CA C 75 51.151 51.151 51.206 -0.055 18802 2278 1 4 . 1 1 75 75 ASN CB C 75 38.924 38.924 38.909 0.015 18802 2279 1 4 . 1 1 75 75 ASN H H 75 8.422 8.422 8.456 -0.034 18802 2280 1 4 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.222 0.071 18802 2281 1 4 . 1 1 76 76 PRO C C 76 177.322 177.322 178.047 -0.725 18802 2282 1 4 . 1 1 76 76 PRO CA C 76 64.384 64.384 65.235 -0.851 18802 2283 1 4 . 1 1 76 76 PRO CB C 76 32.236 32.236 31.884 0.352 18802 2284 1 4 . 1 1 77 77 GLU N N 77 118.523 118.523 116.975 1.548 18802 2285 1 4 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.171 0.005 18802 2286 1 4 . 1 1 77 77 GLU C C 77 176.403 176.403 177.653 -1.250 18802 2287 1 4 . 1 1 77 77 GLU CA C 77 56.977 56.977 58.180 -1.203 18802 2288 1 4 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.980 0.880 18802 2289 1 4 . 1 1 77 77 GLU H H 77 8.426 8.426 8.629 -0.203 18802 2290 1 4 . 1 1 78 78 ASP N N 78 120.581 120.581 119.071 1.510 18802 2291 1 4 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.514 0.029 18802 2292 1 4 . 1 1 78 78 ASP C C 78 176.085 176.085 177.416 -1.331 18802 2293 1 4 . 1 1 78 78 ASP CA C 78 54.544 54.544 55.633 -1.089 18802 2294 1 4 . 1 1 78 78 ASP CB C 78 41.239 41.239 40.911 0.328 18802 2295 1 4 . 1 1 78 78 ASP H H 78 7.941 7.941 7.992 -0.051 18802 2296 1 4 . 1 1 79 79 ARG N N 79 121.043 121.043 118.215 2.828 18802 2297 1 4 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.431 -0.106 18802 2298 1 4 . 1 1 79 79 ARG C C 79 176.123 176.123 176.467 -0.344 18802 2299 1 4 . 1 1 79 79 ARG CA C 79 55.927 55.927 54.523 1.404 18802 2300 1 4 . 1 1 79 79 ARG CB C 79 30.650 30.650 29.478 1.172 18802 2301 1 4 . 1 1 79 79 ARG H H 79 8.066 8.066 7.439 0.627 18802 2302 1 4 . 1 1 80 80 SER N N 80 118.338 118.338 118.388 -0.050 18802 2303 1 4 . 1 1 80 80 SER HA H 80 4.672 4.672 4.583 0.089 18802 2304 1 4 . 1 1 80 80 SER C C 80 172.577 172.577 173.088 -0.511 18802 2305 1 4 . 1 1 80 80 SER CA C 80 56.564 56.564 57.868 -1.304 18802 2306 1 4 . 1 1 80 80 SER CB C 80 63.415 63.415 63.198 0.217 18802 2307 1 4 . 1 1 80 80 SER H H 80 8.281 8.281 7.460 0.821 18802 2308 1 4 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.393 0.027 18802 2309 1 4 . 1 1 81 81 PRO C C 81 176.727 176.727 175.951 0.776 18802 2310 1 4 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.251 0.012 18802 2311 1 4 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.005 0.047 18802 2312 1 4 . 1 1 82 82 SER N N 82 117.341 117.341 118.777 -1.436 18802 2313 1 4 . 1 1 82 82 SER HA H 82 4.693 4.693 4.690 0.003 18802 2314 1 4 . 1 1 82 82 SER C C 82 172.803 172.803 172.997 -0.194 18802 2315 1 4 . 1 1 82 82 SER CA C 82 56.288 56.288 56.788 -0.500 18802 2316 1 4 . 1 1 82 82 SER CB C 82 63.500 63.500 62.981 0.519 18802 2317 1 4 . 1 1 82 82 SER H H 82 8.280 8.280 8.283 -0.003 18802 2318 1 4 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.543 -0.232 18802 2319 1 4 . 1 1 83 83 PRO C C 83 176.273 176.273 175.776 0.497 18802 2320 1 4 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.796 0.319 18802 2321 1 4 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.287 -0.188 18802 2322 1 4 . 1 1 84 84 GLU N N 84 122.213 122.213 121.654 0.559 18802 2323 1 4 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.335 0.158 18802 2324 1 4 . 1 1 84 84 GLU C C 84 174.546 174.546 175.054 -0.508 18802 2325 1 4 . 1 1 84 84 GLU CA C 84 54.529 54.529 55.606 -1.077 18802 2326 1 4 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.272 0.666 18802 2327 1 4 . 1 1 84 84 GLU H H 84 8.230 8.230 8.441 -0.211 18802 2328 1 4 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.381 0.034 18802 2329 1 4 . 1 1 85 85 PRO C C 85 176.024 176.024 175.943 0.081 18802 2330 1 4 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.824 0.418 18802 2331 1 4 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.080 0.109 18802 2332 1 4 . 1 1 86 86 ILE N N 86 120.281 120.281 123.182 -2.901 18802 2333 1 4 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.146 -0.084 18802 2334 1 4 . 1 1 86 86 ILE C C 86 175.419 175.419 176.341 -0.922 18802 2335 1 4 . 1 1 86 86 ILE CA C 86 61.029 61.029 61.203 -0.174 18802 2336 1 4 . 1 1 86 86 ILE CB C 86 39.258 39.258 38.330 0.928 18802 2337 1 4 . 1 1 86 86 ILE H H 86 7.980 7.980 8.066 -0.086 18802 2338 1 4 . 1 1 87 87 TYR N N 87 123.089 123.089 126.333 -3.244 18802 2339 1 4 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.321 0.496 18802 2340 1 4 . 1 1 87 87 TYR C C 87 175.920 175.920 176.288 -0.368 18802 2341 1 4 . 1 1 87 87 TYR CA C 87 57.197 57.197 58.817 -1.620 18802 2342 1 4 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.098 1.080 18802 2343 1 4 . 1 1 87 87 TYR H H 87 8.194 8.194 8.518 -0.324 18802 2344 1 4 . 1 1 88 88 ASN N N 88 120.117 120.117 120.106 0.011 18802 2345 1 4 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.764 -0.019 18802 2346 1 4 . 1 1 88 88 ASN C C 88 176.275 176.275 177.026 -0.751 18802 2347 1 4 . 1 1 88 88 ASN CA C 88 52.286 52.286 53.104 -0.818 18802 2348 1 4 . 1 1 88 88 ASN CB C 88 39.082 39.082 40.147 -1.065 18802 2349 1 4 . 1 1 88 88 ASN H H 88 8.386 8.386 8.784 -0.398 18802 2350 1 4 . 1 1 89 89 SER N N 89 115.826 115.826 118.873 -3.047 18802 2351 1 4 . 1 1 89 89 SER HA H 89 4.248 4.248 4.238 0.010 18802 2352 1 4 . 1 1 89 89 SER C C 89 175.066 175.066 174.655 0.411 18802 2353 1 4 . 1 1 89 89 SER CA C 89 60.012 60.012 61.056 -1.044 18802 2354 1 4 . 1 1 89 89 SER CB C 89 63.400 63.400 63.077 0.323 18802 2355 1 4 . 1 1 89 89 SER H H 89 8.371 8.371 8.903 -0.532 18802 2356 1 4 . 1 1 90 90 GLU N N 90 121.062 121.062 119.130 1.932 18802 2357 1 4 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.383 -0.105 18802 2358 1 4 . 1 1 90 90 GLU C C 90 176.936 176.936 176.927 0.009 18802 2359 1 4 . 1 1 90 90 GLU CA C 90 56.781 56.781 55.960 0.821 18802 2360 1 4 . 1 1 90 90 GLU CB C 90 30.063 30.063 28.753 1.310 18802 2361 1 4 . 1 1 90 90 GLU H H 90 8.018 8.018 7.937 0.081 18802 2362 1 4 . 1 1 91 91 GLY N N 91 108.499 108.499 109.170 -0.671 18802 2363 1 4 . 1 1 91 91 GLY C C 91 174.115 174.115 173.650 0.465 18802 2364 1 4 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.156 0.588 18802 2365 1 4 . 1 1 91 91 GLY H H 91 8.199 8.199 8.453 -0.254 18802 2366 1 4 . 1 1 92 92 LYS N N 92 120.638 120.638 121.237 -0.599 18802 2367 1 4 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.517 -0.208 18802 2368 1 4 . 1 1 92 92 LYS C C 92 176.453 176.453 174.950 1.503 18802 2369 1 4 . 1 1 92 92 LYS CA C 92 55.856 55.856 55.181 0.675 18802 2370 1 4 . 1 1 92 92 LYS CB C 92 33.109 33.109 34.184 -1.075 18802 2371 1 4 . 1 1 92 92 LYS H H 92 7.956 7.956 7.535 0.421 18802 2372 1 4 . 1 1 93 93 ARG N N 93 122.999 122.999 125.976 -2.977 18802 2373 1 4 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.307 -0.116 18802 2374 1 4 . 1 1 93 93 ARG C C 93 176.325 176.325 174.835 1.490 18802 2375 1 4 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.433 0.949 18802 2376 1 4 . 1 1 93 93 ARG CB C 93 30.656 30.656 31.292 -0.636 18802 2377 1 4 . 1 1 93 93 ARG H H 93 8.403 8.403 8.678 -0.275 18802 2378 1 4 . 1 1 94 94 LEU N N 94 124.100 124.100 122.588 1.512 18802 2379 1 4 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.778 -0.515 18802 2380 1 4 . 1 1 94 94 LEU C C 94 176.993 176.993 175.446 1.547 18802 2381 1 4 . 1 1 94 94 LEU CA C 94 55.034 55.034 52.633 2.401 18802 2382 1 4 . 1 1 94 94 LEU CB C 94 42.941 42.941 43.409 -0.468 18802 2383 1 4 . 1 1 94 94 LEU H H 94 8.283 8.283 8.195 0.088 18802 2384 1 4 . 1 1 95 95 ASN N N 95 119.593 119.593 118.156 1.437 18802 2385 1 4 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.740 0.007 18802 2386 1 4 . 1 1 95 95 ASN C C 95 175.598 175.598 175.051 0.547 18802 2387 1 4 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.933 -1.253 18802 2388 1 4 . 1 1 95 95 ASN CB C 95 38.723 38.723 39.203 -0.480 18802 2389 1 4 . 1 1 95 95 ASN H H 95 8.460 8.460 8.295 0.165 18802 2390 1 4 . 1 1 96 96 THR N N 96 114.100 114.100 117.394 -3.294 18802 2391 1 4 . 1 1 96 96 THR HA H 96 4.226 4.226 4.392 -0.166 18802 2392 1 4 . 1 1 96 96 THR C C 96 175.186 175.186 175.915 -0.729 18802 2393 1 4 . 1 1 96 96 THR CA C 96 62.203 62.203 64.804 -2.601 18802 2394 1 4 . 1 1 96 96 THR CB C 96 69.880 69.880 69.632 0.248 18802 2395 1 4 . 1 1 96 96 THR H H 96 8.031 8.031 8.388 -0.357 18802 2396 1 4 . 1 1 97 97 ARG N N 97 122.587 122.587 121.325 1.262 18802 2397 1 4 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.188 -0.075 18802 2398 1 4 . 1 1 97 97 ARG C C 97 177.938 177.938 178.253 -0.315 18802 2399 1 4 . 1 1 97 97 ARG CA C 97 58.412 58.412 59.831 -1.419 18802 2400 1 4 . 1 1 97 97 ARG CB C 97 30.297 30.297 30.071 0.226 18802 2401 1 4 . 1 1 97 97 ARG H H 97 8.502 8.502 8.532 -0.030 18802 2402 1 4 . 1 1 98 98 GLU N N 98 121.548 121.548 119.095 2.453 18802 2403 1 4 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.090 -0.073 18802 2404 1 4 . 1 1 98 98 GLU C C 98 177.113 177.113 179.062 -1.949 18802 2405 1 4 . 1 1 98 98 GLU CA C 98 58.680 58.680 60.009 -1.329 18802 2406 1 4 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.909 0.757 18802 2407 1 4 . 1 1 98 98 GLU H H 98 8.517 8.517 8.854 -0.337 18802 2408 1 4 . 1 1 99 99 PHE N N 99 121.388 121.388 119.615 1.773 18802 2409 1 4 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.287 0.035 18802 2410 1 4 . 1 1 99 99 PHE C C 99 177.070 177.070 177.115 -0.045 18802 2411 1 4 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.192 -1.117 18802 2412 1 4 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.159 0.327 18802 2413 1 4 . 1 1 99 99 PHE H H 99 8.176 8.176 8.176 0.000 18802 2414 1 4 . 1 1 100 100 ARG N N 100 120.211 120.211 120.006 0.205 18802 2415 1 4 . 1 1 100 100 ARG C C 100 178.159 178.159 178.484 -0.325 18802 2416 1 4 . 1 1 100 100 ARG CA C 100 58.533 58.533 59.023 -0.489 18802 2417 1 4 . 1 1 100 100 ARG CB C 100 30.588 30.588 29.455 1.133 18802 2418 1 4 . 1 1 100 100 ARG H H 100 8.377 8.377 8.536 -0.159 18802 2419 1 4 . 1 1 101 101 THR N N 101 115.416 115.416 116.882 -1.466 18802 2420 1 4 . 1 1 101 101 THR HA H 101 4.022 4.022 3.863 0.159 18802 2421 1 4 . 1 1 101 101 THR C C 101 175.301 175.301 176.514 -1.213 18802 2422 1 4 . 1 1 101 101 THR CA C 101 65.141 65.141 66.991 -1.850 18802 2423 1 4 . 1 1 101 101 THR CB C 101 69.305 69.305 68.477 0.828 18802 2424 1 4 . 1 1 101 101 THR H H 101 7.992 7.992 8.444 -0.452 18802 2425 1 4 . 1 1 102 102 ARG N N 102 122.212 122.212 121.549 0.663 18802 2426 1 4 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.786 0.521 18802 2427 1 4 . 1 1 102 102 ARG C C 102 177.644 177.644 177.914 -0.270 18802 2428 1 4 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.794 0.817 18802 2429 1 4 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.024 -0.216 18802 2430 1 4 . 1 1 102 102 ARG H H 102 8.369 8.369 7.691 0.678 18802 2431 1 4 . 1 1 103 103 LYS N N 103 117.591 117.591 119.408 -1.817 18802 2432 1 4 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.890 0.070 18802 2433 1 4 . 1 1 103 103 LYS C C 103 178.913 178.913 178.909 0.004 18802 2434 1 4 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.504 0.546 18802 2435 1 4 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.705 0.436 18802 2436 1 4 . 1 1 103 103 LYS H H 103 7.941 7.941 8.178 -0.237 18802 2437 1 4 . 1 1 104 104 LYS N N 104 119.769 119.769 120.324 -0.555 18802 2438 1 4 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.294 -0.148 18802 2439 1 4 . 1 1 104 104 LYS C C 104 179.377 179.377 178.952 0.425 18802 2440 1 4 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.667 0.312 18802 2441 1 4 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.613 0.578 18802 2442 1 4 . 1 1 104 104 LYS H H 104 7.615 7.615 7.930 -0.315 18802 2443 1 4 . 1 1 105 105 LEU N N 105 120.500 120.500 119.098 1.402 18802 2444 1 4 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.917 0.200 18802 2445 1 4 . 1 1 105 105 LEU C C 105 179.481 179.481 179.151 0.330 18802 2446 1 4 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.116 0.145 18802 2447 1 4 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.532 0.471 18802 2448 1 4 . 1 1 105 105 LEU H H 105 8.057 8.057 7.957 0.100 18802 2449 1 4 . 1 1 106 106 GLU N N 106 118.803 118.803 118.879 -0.076 18802 2450 1 4 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.953 0.036 18802 2451 1 4 . 1 1 106 106 GLU C C 106 180.577 180.577 179.234 1.343 18802 2452 1 4 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.756 0.054 18802 2453 1 4 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.284 0.725 18802 2454 1 4 . 1 1 106 106 GLU H H 106 8.652 8.652 8.547 0.105 18802 2455 1 4 . 1 1 107 107 GLU N N 107 122.396 122.396 120.356 2.040 18802 2456 1 4 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.083 0.023 18802 2457 1 4 . 1 1 107 107 GLU C C 107 178.457 178.457 179.039 -0.582 18802 2458 1 4 . 1 1 107 107 GLU CA C 107 59.826 59.826 59.851 -0.025 18802 2459 1 4 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.656 -0.094 18802 2460 1 4 . 1 1 107 107 GLU H H 107 8.281 8.281 8.560 -0.279 18802 2461 1 4 . 1 1 108 108 GLU N N 108 120.976 120.976 118.362 2.614 18802 2462 1 4 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.079 0.013 18802 2463 1 4 . 1 1 108 108 GLU C C 108 179.343 179.343 179.116 0.227 18802 2464 1 4 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.012 0.684 18802 2465 1 4 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.150 0.420 18802 2466 1 4 . 1 1 108 108 GLU H H 108 8.321 8.321 8.179 0.142 18802 2467 1 4 . 1 1 109 109 ARG N N 109 118.559 118.559 120.374 -1.815 18802 2468 1 4 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.972 -0.180 18802 2469 1 4 . 1 1 109 109 ARG C C 109 177.178 177.178 178.195 -1.017 18802 2470 1 4 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.836 0.647 18802 2471 1 4 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.296 -0.146 18802 2472 1 4 . 1 1 109 109 ARG H H 109 8.594 8.594 8.457 0.137 18802 2473 1 4 . 1 1 110 110 HIS N N 110 119.632 119.632 119.167 0.465 18802 2474 1 4 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.364 -0.023 18802 2475 1 4 . 1 1 110 110 HIS C C 110 177.578 177.578 177.779 -0.201 18802 2476 1 4 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.117 1.500 18802 2477 1 4 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.123 0.386 18802 2478 1 4 . 1 1 110 110 HIS H H 110 8.465 8.465 8.605 -0.140 18802 2479 1 4 . 1 1 111 111 ASN N N 111 119.587 119.587 118.525 1.062 18802 2480 1 4 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.427 -0.149 18802 2481 1 4 . 1 1 111 111 ASN C C 111 178.630 178.630 177.782 0.848 18802 2482 1 4 . 1 1 111 111 ASN CA C 111 56.281 56.281 56.261 0.020 18802 2483 1 4 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.357 -0.662 18802 2484 1 4 . 1 1 111 111 ASN H H 111 8.323 8.323 8.520 -0.197 18802 2485 1 4 . 1 1 112 112 LEU N N 112 122.320 122.320 120.409 1.911 18802 2486 1 4 . 1 1 112 112 LEU HA H 112 4.116 4.116 3.943 0.173 18802 2487 1 4 . 1 1 112 112 LEU C C 112 178.539 178.539 178.777 -0.238 18802 2488 1 4 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.643 0.336 18802 2489 1 4 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.696 0.898 18802 2490 1 4 . 1 1 112 112 LEU H H 112 7.966 7.966 7.637 0.329 18802 2491 1 4 . 1 1 113 113 ILE N N 113 121.495 121.495 120.500 0.995 18802 2492 1 4 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.692 -0.456 18802 2493 1 4 . 1 1 113 113 ILE C C 113 176.959 176.959 178.302 -1.343 18802 2494 1 4 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.853 1.201 18802 2495 1 4 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.273 1.330 18802 2496 1 4 . 1 1 113 113 ILE H H 113 8.472 8.472 8.665 -0.193 18802 2497 1 4 . 1 1 114 114 THR N N 114 115.066 115.066 115.854 -0.788 18802 2498 1 4 . 1 1 114 114 THR HA H 114 3.718 3.718 4.065 -0.347 18802 2499 1 4 . 1 1 114 114 THR C C 114 176.559 176.559 176.728 -0.169 18802 2500 1 4 . 1 1 114 114 THR CA C 114 66.700 66.700 67.315 -0.615 18802 2501 1 4 . 1 1 114 114 THR CB C 114 68.759 68.759 68.296 0.463 18802 2502 1 4 . 1 1 114 114 THR H H 114 8.075 8.075 8.342 -0.267 18802 2503 1 4 . 1 1 115 115 GLU N N 115 123.259 123.259 121.815 1.444 18802 2504 1 4 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.127 -0.195 18802 2505 1 4 . 1 1 115 115 GLU C C 115 178.191 178.191 178.460 -0.269 18802 2506 1 4 . 1 1 115 115 GLU CA C 115 59.340 59.340 58.869 0.471 18802 2507 1 4 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.354 0.045 18802 2508 1 4 . 1 1 115 115 GLU H H 115 7.368 7.368 7.533 -0.165 18802 2509 1 4 . 1 1 116 116 MET N N 116 119.844 119.844 120.032 -0.188 18802 2510 1 4 . 1 1 116 116 MET HA H 116 4.014 4.014 3.946 0.068 18802 2511 1 4 . 1 1 116 116 MET C C 116 177.888 177.888 177.955 -0.067 18802 2512 1 4 . 1 1 116 116 MET CA C 116 57.183 57.183 57.031 0.152 18802 2513 1 4 . 1 1 116 116 MET CB C 116 32.126 32.126 31.462 0.664 18802 2514 1 4 . 1 1 116 116 MET H H 116 8.373 8.373 8.325 0.048 18802 2515 1 4 . 1 1 117 117 VAL N N 117 117.572 117.572 118.995 -1.423 18802 2516 1 4 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.136 -0.240 18802 2517 1 4 . 1 1 117 117 VAL C C 117 177.567 177.567 178.155 -0.588 18802 2518 1 4 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.518 -1.648 18802 2519 1 4 . 1 1 117 117 VAL CB C 117 32.002 32.002 30.739 1.263 18802 2520 1 4 . 1 1 117 117 VAL H H 117 8.279 8.279 8.599 -0.320 18802 2521 1 4 . 1 1 118 118 ALA N N 118 120.560 120.560 121.601 -1.041 18802 2522 1 4 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.159 -0.023 18802 2523 1 4 . 1 1 118 118 ALA C C 118 179.595 179.595 179.547 0.048 18802 2524 1 4 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.715 -0.612 18802 2525 1 4 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.680 -0.430 18802 2526 1 4 . 1 1 118 118 ALA H H 118 7.074 7.074 7.302 -0.228 18802 2527 1 4 . 1 1 119 119 LEU N N 119 117.987 117.987 117.524 0.463 18802 2528 1 4 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.139 0.001 18802 2529 1 4 . 1 1 119 119 LEU C C 119 177.863 177.863 177.156 0.707 18802 2530 1 4 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.740 -0.068 18802 2531 1 4 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.773 0.461 18802 2532 1 4 . 1 1 119 119 LEU H H 119 7.525 7.525 7.844 -0.319 18802 2533 1 4 . 1 1 120 120 ASN N N 120 115.338 115.338 115.907 -0.569 18802 2534 1 4 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.131 -0.113 18802 2535 1 4 . 1 1 120 120 ASN C C 120 172.510 172.510 173.831 -1.321 18802 2536 1 4 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.267 -0.166 18802 2537 1 4 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.925 -1.620 18802 2538 1 4 . 1 1 120 120 ASN H H 120 8.467 8.467 8.097 0.370 18802 2539 1 4 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.527 0.129 18802 2540 1 4 . 1 1 121 121 PRO C C 121 177.020 177.020 176.875 0.145 18802 2541 1 4 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.246 0.052 18802 2542 1 4 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.252 0.047 18802 2543 1 4 . 1 1 122 122 ASP N N 122 115.744 115.744 118.582 -2.838 18802 2544 1 4 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.750 -0.081 18802 2545 1 4 . 1 1 122 122 ASP C C 122 176.004 176.004 175.821 0.183 18802 2546 1 4 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.589 0.777 18802 2547 1 4 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.691 -0.367 18802 2548 1 4 . 1 1 122 122 ASP H H 122 7.600 7.600 8.762 -1.162 18802 2549 1 4 . 1 1 123 123 PHE N N 123 122.722 122.722 121.604 1.118 18802 2550 1 4 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.408 -0.273 18802 2551 1 4 . 1 1 123 123 PHE C C 123 173.954 173.954 174.135 -0.181 18802 2552 1 4 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.720 0.273 18802 2553 1 4 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.636 -0.040 18802 2554 1 4 . 1 1 123 123 PHE H H 123 7.940 7.940 7.466 0.474 18802 2555 1 4 . 1 1 124 124 LYS N N 124 129.400 129.400 129.106 0.294 18802 2556 1 4 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.410 0.149 18802 2557 1 4 . 1 1 124 124 LYS C C 124 172.622 172.622 173.768 -1.146 18802 2558 1 4 . 1 1 124 124 LYS CA C 124 51.815 51.815 51.988 -0.173 18802 2559 1 4 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.951 0.630 18802 2560 1 4 . 1 1 124 124 LYS H H 124 7.602 7.602 8.261 -0.659 18802 2561 1 4 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.206 -0.117 18802 2562 1 4 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.205 -0.209 18802 2563 1 4 . 1 1 125 125 PRO CB C 125 31.067 31.067 30.851 0.216 18802 2564 1 4 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.387 -0.013 18802 2565 1 4 . 1 1 126 126 PRO C C 126 177.630 177.630 177.819 -0.189 18802 2566 1 4 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.674 0.139 18802 2567 1 4 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.187 0.134 18802 2568 1 4 . 1 1 127 127 ALA N N 127 123.830 123.830 123.137 0.693 18802 2569 1 4 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.093 -0.035 18802 2570 1 4 . 1 1 127 127 ALA C C 127 177.641 177.641 178.419 -0.778 18802 2571 1 4 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.363 0.239 18802 2572 1 4 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.821 0.028 18802 2573 1 4 . 1 1 127 127 ALA H H 127 8.630 8.630 8.488 0.142 18802 2574 1 4 . 1 1 128 128 ASP N N 128 112.924 112.924 116.104 -3.180 18802 2575 1 4 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.570 -0.119 18802 2576 1 4 . 1 1 128 128 ASP C C 128 175.724 175.724 175.101 0.623 18802 2577 1 4 . 1 1 128 128 ASP CA C 128 53.604 53.604 53.587 0.017 18802 2578 1 4 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.752 -0.334 18802 2579 1 4 . 1 1 128 128 ASP H H 128 8.335 8.335 8.126 0.209 18802 2580 1 4 . 1 1 129 129 TYR N N 129 121.114 121.114 121.563 -0.449 18802 2581 1 4 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.304 0.058 18802 2582 1 4 . 1 1 129 129 TYR C C 129 174.190 174.190 174.875 -0.685 18802 2583 1 4 . 1 1 129 129 TYR CA C 129 58.412 58.412 58.847 -0.435 18802 2584 1 4 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.603 0.456 18802 2585 1 4 . 1 1 129 129 TYR H H 129 7.600 7.600 7.529 0.071 18802 2586 1 4 . 1 1 130 130 LYS N N 130 129.875 129.875 129.098 0.777 18802 2587 1 4 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.385 -0.067 18802 2588 1 4 . 1 1 130 130 LYS C C 130 172.314 172.314 174.195 -1.881 18802 2589 1 4 . 1 1 130 130 LYS CA C 130 52.570 52.570 52.026 0.544 18802 2590 1 4 . 1 1 130 130 LYS CB C 130 33.663 33.663 31.400 2.263 18802 2591 1 4 . 1 1 130 130 LYS H H 130 7.695 7.695 8.141 -0.446 18802 2592 1 4 . 1 1 131 131 PRO HA H 131 4.277 4.277 3.978 0.299 18802 2593 1 4 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.158 -0.100 18802 2594 1 4 . 1 1 131 131 PRO CB C 131 30.852 30.852 30.794 0.057 18802 2595 1 4 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.489 -0.245 18802 2596 1 4 . 1 1 132 132 PRO C C 132 176.459 176.459 176.181 0.278 18802 2597 1 4 . 1 1 132 132 PRO CA C 132 62.874 62.874 63.309 -0.435 18802 2598 1 4 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.228 -0.181 18802 2599 1 4 . 1 1 133 133 ALA N N 133 124.170 124.170 124.664 -0.494 18802 2600 1 4 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.395 -0.145 18802 2601 1 4 . 1 1 133 133 ALA C C 133 177.870 177.870 177.298 0.572 18802 2602 1 4 . 1 1 133 133 ALA CA C 133 52.508 52.508 52.549 -0.041 18802 2603 1 4 . 1 1 133 133 ALA CB C 133 19.303 19.303 19.315 -0.012 18802 2604 1 4 . 1 1 133 133 ALA H H 133 8.311 8.311 8.067 0.244 18802 2605 1 4 . 1 1 134 134 THR N N 134 113.807 113.807 113.290 0.517 18802 2606 1 4 . 1 1 134 134 THR HA H 134 4.228 4.228 4.499 -0.271 18802 2607 1 4 . 1 1 134 134 THR C C 134 174.282 174.282 176.305 -2.023 18802 2608 1 4 . 1 1 134 134 THR CA C 134 62.127 62.127 62.867 -0.740 18802 2609 1 4 . 1 1 134 134 THR CB C 134 69.870 69.870 69.132 0.738 18802 2610 1 4 . 1 1 134 134 THR H H 134 8.019 8.019 8.023 -0.004 18802 2611 1 4 . 1 1 135 135 ARG N N 135 124.165 124.165 121.841 2.324 18802 2612 1 4 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.455 -0.106 18802 2613 1 4 . 1 1 135 135 ARG C C 135 176.217 176.217 175.928 0.289 18802 2614 1 4 . 1 1 135 135 ARG CA C 135 55.993 55.993 57.287 -1.294 18802 2615 1 4 . 1 1 135 135 ARG CB C 135 30.992 30.992 30.632 0.360 18802 2616 1 4 . 1 1 135 135 ARG H H 135 8.300 8.300 8.137 0.163 18802 2617 1 4 . 1 1 136 136 VAL N N 136 122.157 122.157 112.560 9.597 18802 2618 1 4 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.535 -0.465 18802 2619 1 4 . 1 1 136 136 VAL C C 136 176.180 176.180 176.386 -0.206 18802 2620 1 4 . 1 1 136 136 VAL CA C 136 61.937 61.937 61.386 0.551 18802 2621 1 4 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.112 0.635 18802 2622 1 4 . 1 1 136 136 VAL H H 136 8.233 8.233 7.214 1.019 18802 2623 1 4 . 1 1 137 137 SER N N 137 118.837 118.837 117.692 1.145 18802 2624 1 4 . 1 1 137 137 SER HA H 137 4.416 4.416 4.281 0.135 18802 2625 1 4 . 1 1 137 137 SER C C 137 174.258 174.258 174.983 -0.725 18802 2626 1 4 . 1 1 137 137 SER CA C 137 58.341 58.341 61.363 -3.022 18802 2627 1 4 . 1 1 137 137 SER CB C 137 63.900 63.900 63.428 0.471 18802 2628 1 4 . 1 1 137 137 SER H H 137 8.264 8.264 7.986 0.278 18802 2629 1 4 . 1 1 138 138 ASP N N 138 122.871 122.871 116.519 6.352 18802 2630 1 4 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.652 -0.115 18802 2631 1 4 . 1 1 138 138 ASP C C 138 176.053 176.053 175.932 0.121 18802 2632 1 4 . 1 1 138 138 ASP CA C 138 54.489 54.489 53.803 0.686 18802 2633 1 4 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.083 0.065 18802 2634 1 4 . 1 1 138 138 ASP H H 138 8.249 8.249 8.388 -0.139 18802 2635 1 4 . 1 1 139 139 LYS N N 139 120.944 120.944 121.098 -0.154 18802 2636 1 4 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.319 -0.059 18802 2637 1 4 . 1 1 139 139 LYS C C 139 176.343 176.343 175.995 0.348 18802 2638 1 4 . 1 1 139 139 LYS CA C 139 56.261 56.261 56.041 0.220 18802 2639 1 4 . 1 1 139 139 LYS CB C 139 33.077 33.077 33.259 -0.182 18802 2640 1 4 . 1 1 139 139 LYS H H 139 8.084 8.084 7.669 0.415 18802 2641 1 4 . 1 1 140 140 VAL N N 140 121.670 121.670 123.125 -1.455 18802 2642 1 4 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.290 -0.278 18802 2643 1 4 . 1 1 140 140 VAL C C 140 175.842 175.842 174.940 0.902 18802 2644 1 4 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.784 0.658 18802 2645 1 4 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.228 0.639 18802 2646 1 4 . 1 1 140 140 VAL H H 140 8.025 8.025 8.343 -0.318 18802 2647 1 4 . 1 1 141 141 MET N N 141 124.839 124.839 128.397 -3.558 18802 2648 1 4 . 1 1 141 141 MET HA H 141 4.453 4.453 4.734 -0.281 18802 2649 1 4 . 1 1 141 141 MET C C 141 175.562 175.562 175.229 0.333 18802 2650 1 4 . 1 1 141 141 MET CA C 141 55.349 55.349 54.383 0.966 18802 2651 1 4 . 1 1 141 141 MET CB C 141 32.993 32.993 32.784 0.209 18802 2652 1 4 . 1 1 141 141 MET H H 141 8.364 8.364 8.433 -0.069 18802 2653 1 4 . 1 1 142 142 ILE N N 142 124.515 124.515 130.607 -6.092 18802 2654 1 4 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.497 -0.069 18802 2655 1 4 . 1 1 142 142 ILE C C 142 174.331 174.331 174.277 0.054 18802 2656 1 4 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.656 -0.251 18802 2657 1 4 . 1 1 142 142 ILE CB C 142 38.755 38.755 37.936 0.819 18802 2658 1 4 . 1 1 142 142 ILE H H 142 8.093 8.093 8.372 -0.279 18802 2659 1 4 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.442 -0.092 18802 2660 1 4 . 1 1 143 143 PRO C C 143 176.623 176.623 175.798 0.825 18802 2661 1 4 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.627 0.788 18802 2662 1 4 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.264 -0.030 18802 2663 1 4 . 1 1 144 144 GLN N N 144 121.557 121.557 122.983 -1.426 18802 2664 1 4 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.503 -0.197 18802 2665 1 4 . 1 1 144 144 GLN C C 144 174.751 174.751 175.076 -0.325 18802 2666 1 4 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.338 0.333 18802 2667 1 4 . 1 1 144 144 GLN CB C 144 30.118 30.118 30.261 -0.143 18802 2668 1 4 . 1 1 144 144 GLN H H 144 8.392 8.392 8.447 -0.055 18802 2669 1 5 . 1 1 26 26 ALA N N 26 124.085 124.085 122.599 1.486 18802 2670 1 5 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.544 -0.252 18802 2671 1 5 . 1 1 26 26 ALA C C 26 177.101 177.101 177.577 -0.476 18802 2672 1 5 . 1 1 26 26 ALA CA C 26 52.921 52.921 51.566 1.355 18802 2673 1 5 . 1 1 26 26 ALA CB C 26 19.426 19.426 19.928 -0.502 18802 2674 1 5 . 1 1 26 26 ALA H H 26 8.498 8.498 8.325 0.173 18802 2675 1 5 . 1 1 27 27 MET N N 27 119.630 119.630 119.123 0.507 18802 2676 1 5 . 1 1 27 27 MET HA H 27 4.391 4.391 4.582 -0.191 18802 2677 1 5 . 1 1 27 27 MET C C 27 176.296 176.296 175.852 0.444 18802 2678 1 5 . 1 1 27 27 MET CA C 27 55.834 55.834 55.849 -0.015 18802 2679 1 5 . 1 1 27 27 MET CB C 27 32.663 32.663 32.953 -0.290 18802 2680 1 5 . 1 1 27 27 MET H H 27 8.441 8.441 8.192 0.249 18802 2681 1 5 . 1 1 28 28 GLU N N 28 122.376 122.376 125.005 -2.629 18802 2682 1 5 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.552 -0.338 18802 2683 1 5 . 1 1 28 28 GLU C C 28 176.310 176.310 175.705 0.605 18802 2684 1 5 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.028 0.791 18802 2685 1 5 . 1 1 28 28 GLU CB C 28 30.252 30.252 30.674 -0.422 18802 2686 1 5 . 1 1 28 28 GLU H H 28 8.336 8.336 8.543 -0.207 18802 2687 1 5 . 1 1 29 29 GLN N N 29 122.010 122.010 118.296 3.714 18802 2688 1 5 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.553 -0.262 18802 2689 1 5 . 1 1 29 29 GLN C C 29 175.765 175.765 175.672 0.093 18802 2690 1 5 . 1 1 29 29 GLN CA C 29 55.839 55.839 54.779 1.060 18802 2691 1 5 . 1 1 29 29 GLN CB C 29 29.559 29.559 31.277 -1.718 18802 2692 1 5 . 1 1 29 29 GLN H H 29 8.347 8.347 8.633 -0.286 18802 2693 1 5 . 1 1 30 30 LYS N N 30 123.090 123.090 124.256 -1.166 18802 2694 1 5 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.390 -0.054 18802 2695 1 5 . 1 1 30 30 LYS C C 30 176.474 176.474 176.762 -0.288 18802 2696 1 5 . 1 1 30 30 LYS CA C 30 56.391 56.391 56.377 0.014 18802 2697 1 5 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.538 0.455 18802 2698 1 5 . 1 1 30 30 LYS H H 30 8.327 8.327 8.678 -0.351 18802 2699 1 5 . 1 1 31 31 THR N N 31 116.800 116.800 118.797 -1.997 18802 2700 1 5 . 1 1 31 31 THR HA H 31 4.273 4.273 4.437 -0.164 18802 2701 1 5 . 1 1 31 31 THR C C 31 174.071 174.071 174.030 0.041 18802 2702 1 5 . 1 1 31 31 THR CA C 31 62.103 62.103 61.695 0.408 18802 2703 1 5 . 1 1 31 31 THR CB C 31 69.899 69.899 69.832 0.067 18802 2704 1 5 . 1 1 31 31 THR H H 31 8.160 8.160 8.407 -0.247 18802 2705 1 5 . 1 1 32 32 VAL N N 32 124.108 124.108 125.777 -1.669 18802 2706 1 5 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.269 -0.203 18802 2707 1 5 . 1 1 32 32 VAL C C 32 175.573 175.573 174.777 0.796 18802 2708 1 5 . 1 1 32 32 VAL CA C 32 62.344 62.344 61.992 0.353 18802 2709 1 5 . 1 1 32 32 VAL CB C 32 32.912 32.912 32.548 0.364 18802 2710 1 5 . 1 1 32 32 VAL H H 32 8.192 8.192 8.447 -0.255 18802 2711 1 5 . 1 1 33 33 ILE N N 33 127.371 127.371 129.377 -2.006 18802 2712 1 5 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.557 -0.133 18802 2713 1 5 . 1 1 33 33 ILE C C 33 174.335 174.335 174.330 0.005 18802 2714 1 5 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.008 1.386 18802 2715 1 5 . 1 1 33 33 ILE CB C 33 38.799 38.799 38.190 0.609 18802 2716 1 5 . 1 1 33 33 ILE H H 33 8.275 8.275 8.569 -0.294 18802 2717 1 5 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.546 -0.243 18802 2718 1 5 . 1 1 34 34 PRO C C 34 177.261 177.261 177.140 0.121 18802 2719 1 5 . 1 1 34 34 PRO CA C 34 63.672 63.672 62.922 0.750 18802 2720 1 5 . 1 1 34 34 PRO CB C 34 32.177 32.177 32.249 -0.072 18802 2721 1 5 . 1 1 35 35 GLY N N 35 109.540 109.540 111.418 -1.878 18802 2722 1 5 . 1 1 35 35 GLY C C 35 173.906 173.906 174.603 -0.697 18802 2723 1 5 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.696 0.574 18802 2724 1 5 . 1 1 35 35 GLY H H 35 8.376 8.376 8.602 -0.226 18802 2725 1 5 . 1 1 36 36 MET N N 36 120.834 120.834 121.007 -0.173 18802 2726 1 5 . 1 1 36 36 MET HA H 36 4.780 4.780 4.637 0.143 18802 2727 1 5 . 1 1 36 36 MET C C 36 174.235 174.235 174.395 -0.160 18802 2728 1 5 . 1 1 36 36 MET CA C 36 53.258 53.258 54.409 -1.151 18802 2729 1 5 . 1 1 36 36 MET CB C 36 32.734 32.734 32.636 0.098 18802 2730 1 5 . 1 1 36 36 MET H H 36 7.986 7.986 8.133 -0.147 18802 2731 1 5 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.512 -0.050 18802 2732 1 5 . 1 1 37 37 PRO C C 37 176.736 176.736 176.122 0.614 18802 2733 1 5 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.609 0.648 18802 2734 1 5 . 1 1 37 37 PRO CB C 37 32.200 32.200 32.111 0.090 18802 2735 1 5 . 1 1 38 38 THR N N 38 115.642 115.642 116.242 -0.600 18802 2736 1 5 . 1 1 38 38 THR HA H 38 4.226 4.226 4.354 -0.128 18802 2737 1 5 . 1 1 38 38 THR C C 38 174.164 174.164 174.881 -0.717 18802 2738 1 5 . 1 1 38 38 THR CA C 38 62.462 62.462 61.997 0.465 18802 2739 1 5 . 1 1 38 38 THR CB C 38 69.874 69.874 69.925 -0.051 18802 2740 1 5 . 1 1 38 38 THR H H 38 8.189 8.189 8.193 -0.004 18802 2741 1 5 . 1 1 39 39 VAL N N 39 123.700 123.700 126.112 -2.412 18802 2742 1 5 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.230 -0.151 18802 2743 1 5 . 1 1 39 39 VAL C C 39 175.177 175.177 175.990 -0.813 18802 2744 1 5 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.566 0.425 18802 2745 1 5 . 1 1 39 39 VAL CB C 39 32.898 32.898 33.085 -0.187 18802 2746 1 5 . 1 1 39 39 VAL H H 39 8.036 8.036 8.340 -0.304 18802 2747 1 5 . 1 1 40 40 ILE N N 40 127.780 127.780 128.171 -0.391 18802 2748 1 5 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.139 0.038 18802 2749 1 5 . 1 1 40 40 ILE C C 40 173.894 173.894 174.691 -0.797 18802 2750 1 5 . 1 1 40 40 ILE CA C 40 57.911 57.911 60.069 -2.158 18802 2751 1 5 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.264 1.369 18802 2752 1 5 . 1 1 40 40 ILE H H 40 8.236 8.236 8.431 -0.195 18802 2753 1 5 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.733 -0.242 18802 2754 1 5 . 1 1 41 41 PRO CA C 41 61.624 61.624 60.969 0.654 18802 2755 1 5 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.160 -0.058 18802 2756 1 5 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.371 -0.116 18802 2757 1 5 . 1 1 42 42 PRO C C 42 177.721 177.721 178.215 -0.494 18802 2758 1 5 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.049 -0.249 18802 2759 1 5 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.960 0.395 18802 2760 1 5 . 1 1 43 43 GLY N N 43 107.305 107.305 107.048 0.257 18802 2761 1 5 . 1 1 43 43 GLY C C 43 174.642 174.642 174.092 0.550 18802 2762 1 5 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.826 0.892 18802 2763 1 5 . 1 1 43 43 GLY H H 43 8.321 8.321 8.594 -0.273 18802 2764 1 5 . 1 1 44 44 LEU N N 44 120.897 120.897 121.439 -0.542 18802 2765 1 5 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.570 -0.041 18802 2766 1 5 . 1 1 44 44 LEU C C 44 178.580 178.580 176.261 2.319 18802 2767 1 5 . 1 1 44 44 LEU CA C 44 54.550 54.550 53.887 0.663 18802 2768 1 5 . 1 1 44 44 LEU CB C 44 42.579 42.579 43.163 -0.584 18802 2769 1 5 . 1 1 44 44 LEU H H 44 8.043 8.043 7.731 0.312 18802 2770 1 5 . 1 1 45 45 THR N N 45 113.195 113.195 111.506 1.689 18802 2771 1 5 . 1 1 45 45 THR HA H 45 4.386 4.386 4.545 -0.159 18802 2772 1 5 . 1 1 45 45 THR C C 45 175.377 175.377 175.317 0.060 18802 2773 1 5 . 1 1 45 45 THR CA C 45 61.188 61.188 60.428 0.760 18802 2774 1 5 . 1 1 45 45 THR CB C 45 71.043 71.043 70.684 0.359 18802 2775 1 5 . 1 1 45 45 THR H H 45 8.427 8.427 8.011 0.416 18802 2776 1 5 . 1 1 46 46 ARG N N 46 121.322 121.322 122.064 -0.742 18802 2777 1 5 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.077 -0.040 18802 2778 1 5 . 1 1 46 46 ARG C C 46 179.309 179.309 178.091 1.218 18802 2779 1 5 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.526 -0.142 18802 2780 1 5 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.319 0.497 18802 2781 1 5 . 1 1 46 46 ARG H H 46 8.832 8.832 8.977 -0.145 18802 2782 1 5 . 1 1 47 47 GLU N N 47 119.109 119.109 120.292 -1.183 18802 2783 1 5 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.109 -0.100 18802 2784 1 5 . 1 1 47 47 GLU C C 47 178.931 178.931 179.045 -0.114 18802 2785 1 5 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.980 0.296 18802 2786 1 5 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.652 0.638 18802 2787 1 5 . 1 1 47 47 GLU H H 47 8.754 8.754 8.618 0.136 18802 2788 1 5 . 1 1 48 48 GLN N N 48 119.556 119.556 120.017 -0.461 18802 2789 1 5 . 1 1 48 48 GLN HA H 48 4.066 4.066 3.954 0.112 18802 2790 1 5 . 1 1 48 48 GLN C C 48 179.286 179.286 178.165 1.121 18802 2791 1 5 . 1 1 48 48 GLN CA C 48 58.215 58.215 59.165 -0.950 18802 2792 1 5 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.664 1.003 18802 2793 1 5 . 1 1 48 48 GLN H H 48 7.711 7.711 8.408 -0.697 18802 2794 1 5 . 1 1 49 49 GLU N N 49 122.227 122.227 120.773 1.454 18802 2795 1 5 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.907 -0.034 18802 2796 1 5 . 1 1 49 49 GLU C C 49 177.879 177.879 179.004 -1.125 18802 2797 1 5 . 1 1 49 49 GLU CA C 49 59.958 59.958 60.101 -0.143 18802 2798 1 5 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.531 0.247 18802 2799 1 5 . 1 1 49 49 GLU H H 49 8.730 8.730 8.709 0.021 18802 2800 1 5 . 1 1 50 50 ARG N N 50 119.109 119.109 118.878 0.231 18802 2801 1 5 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.078 -0.009 18802 2802 1 5 . 1 1 50 50 ARG C C 50 177.567 177.567 178.638 -1.071 18802 2803 1 5 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.145 0.081 18802 2804 1 5 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.276 -0.180 18802 2805 1 5 . 1 1 50 50 ARG H H 50 7.906 7.906 8.305 -0.399 18802 2806 1 5 . 1 1 51 51 ALA N N 51 119.411 119.411 123.115 -3.704 18802 2807 1 5 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.877 -0.073 18802 2808 1 5 . 1 1 51 51 ALA C C 51 178.740 178.740 179.035 -0.295 18802 2809 1 5 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.047 0.188 18802 2810 1 5 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.276 -0.017 18802 2811 1 5 . 1 1 51 51 ALA H H 51 7.956 7.956 8.478 -0.522 18802 2812 1 5 . 1 1 52 52 TYR N N 52 119.160 119.160 120.531 -1.371 18802 2813 1 5 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.188 -0.130 18802 2814 1 5 . 1 1 52 52 TYR C C 52 177.367 177.367 177.775 -0.408 18802 2815 1 5 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.470 0.135 18802 2816 1 5 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.660 0.049 18802 2817 1 5 . 1 1 52 52 TYR H H 52 7.854 7.854 8.031 -0.177 18802 2818 1 5 . 1 1 53 53 ILE N N 53 119.173 119.173 119.701 -0.528 18802 2819 1 5 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.313 0.289 18802 2820 1 5 . 1 1 53 53 ILE C C 53 178.711 178.711 178.043 0.668 18802 2821 1 5 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.832 -1.644 18802 2822 1 5 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.978 0.336 18802 2823 1 5 . 1 1 53 53 ILE H H 53 7.809 7.809 8.426 -0.617 18802 2824 1 5 . 1 1 54 54 VAL N N 54 121.549 121.549 119.897 1.652 18802 2825 1 5 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.391 0.083 18802 2826 1 5 . 1 1 54 54 VAL C C 54 177.992 177.992 177.584 0.408 18802 2827 1 5 . 1 1 54 54 VAL CA C 54 66.995 66.995 67.075 -0.080 18802 2828 1 5 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.355 -0.124 18802 2829 1 5 . 1 1 54 54 VAL H H 54 8.572 8.572 8.590 -0.018 18802 2830 1 5 . 1 1 55 55 GLN N N 55 119.997 119.997 119.931 0.066 18802 2831 1 5 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.886 -0.185 18802 2832 1 5 . 1 1 55 55 GLN C C 55 178.604 178.604 178.459 0.145 18802 2833 1 5 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.173 1.022 18802 2834 1 5 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.666 -0.524 18802 2835 1 5 . 1 1 55 55 GLN H H 55 8.183 8.183 7.982 0.201 18802 2836 1 5 . 1 1 56 56 LEU N N 56 119.605 119.605 119.095 0.510 18802 2837 1 5 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.829 0.117 18802 2838 1 5 . 1 1 56 56 LEU C C 56 180.439 180.439 179.394 1.045 18802 2839 1 5 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.591 0.644 18802 2840 1 5 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.400 0.449 18802 2841 1 5 . 1 1 56 56 LEU H H 56 7.586 7.586 7.802 -0.216 18802 2842 1 5 . 1 1 57 57 GLN N N 57 120.332 120.332 118.652 1.680 18802 2843 1 5 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.976 0.133 18802 2844 1 5 . 1 1 57 57 GLN C C 57 179.166 179.166 178.702 0.464 18802 2845 1 5 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.828 0.562 18802 2846 1 5 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.707 0.783 18802 2847 1 5 . 1 1 57 57 GLN H H 57 8.046 8.046 7.831 0.215 18802 2848 1 5 . 1 1 58 58 ILE N N 58 120.945 120.945 120.911 0.034 18802 2849 1 5 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.590 -0.185 18802 2850 1 5 . 1 1 58 58 ILE C C 58 179.368 179.368 178.106 1.262 18802 2851 1 5 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.854 1.212 18802 2852 1 5 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.787 0.469 18802 2853 1 5 . 1 1 58 58 ILE H H 58 8.778 8.778 8.469 0.309 18802 2854 1 5 . 1 1 59 59 GLU N N 59 122.689 122.689 118.950 3.739 18802 2855 1 5 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.942 0.105 18802 2856 1 5 . 1 1 59 59 GLU C C 59 178.901 178.901 178.712 0.189 18802 2857 1 5 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.487 0.377 18802 2858 1 5 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.953 0.583 18802 2859 1 5 . 1 1 59 59 GLU H H 59 8.305 8.305 8.540 -0.235 18802 2860 1 5 . 1 1 60 60 ASP N N 60 121.505 121.505 121.442 0.063 18802 2861 1 5 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.385 0.052 18802 2862 1 5 . 1 1 60 60 ASP C C 60 178.312 178.312 178.633 -0.321 18802 2863 1 5 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.157 0.958 18802 2864 1 5 . 1 1 60 60 ASP CB C 60 42.248 42.248 41.145 1.103 18802 2865 1 5 . 1 1 60 60 ASP H H 60 8.142 8.142 7.724 0.418 18802 2866 1 5 . 1 1 61 61 LEU N N 61 118.666 118.666 120.127 -1.461 18802 2867 1 5 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.917 0.008 18802 2868 1 5 . 1 1 61 61 LEU C C 61 178.866 178.866 179.078 -0.212 18802 2869 1 5 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.325 -0.023 18802 2870 1 5 . 1 1 61 61 LEU CB C 61 42.610 42.610 41.958 0.652 18802 2871 1 5 . 1 1 61 61 LEU H H 61 8.425 8.425 8.553 -0.128 18802 2872 1 5 . 1 1 62 62 THR N N 62 115.786 115.786 114.530 1.256 18802 2873 1 5 . 1 1 62 62 THR HA H 62 3.771 3.771 3.959 -0.188 18802 2874 1 5 . 1 1 62 62 THR C C 62 175.988 175.988 176.270 -0.282 18802 2875 1 5 . 1 1 62 62 THR CA C 62 67.649 67.649 67.463 0.186 18802 2876 1 5 . 1 1 62 62 THR CB C 62 68.848 68.848 68.414 0.434 18802 2877 1 5 . 1 1 62 62 THR H H 62 8.340 8.340 8.464 -0.124 18802 2878 1 5 . 1 1 63 63 ARG N N 63 122.111 122.111 121.435 0.676 18802 2879 1 5 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.945 0.044 18802 2880 1 5 . 1 1 63 63 ARG C C 63 179.715 179.715 178.056 1.659 18802 2881 1 5 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.612 0.474 18802 2882 1 5 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.211 -0.400 18802 2883 1 5 . 1 1 63 63 ARG H H 63 8.024 8.024 8.229 -0.205 18802 2884 1 5 . 1 1 64 64 LYS N N 64 120.824 120.824 120.650 0.174 18802 2885 1 5 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.060 -0.206 18802 2886 1 5 . 1 1 64 64 LYS C C 64 178.707 178.707 179.094 -0.387 18802 2887 1 5 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.507 1.048 18802 2888 1 5 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.383 0.795 18802 2889 1 5 . 1 1 64 64 LYS H H 64 8.130 8.130 7.729 0.401 18802 2890 1 5 . 1 1 65 65 LEU N N 65 118.497 118.497 115.289 3.208 18802 2891 1 5 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.205 -0.236 18802 2892 1 5 . 1 1 65 65 LEU C C 65 179.023 179.023 178.870 0.153 18802 2893 1 5 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.370 -0.089 18802 2894 1 5 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.571 0.819 18802 2895 1 5 . 1 1 65 65 LEU H H 65 8.108 8.108 8.347 -0.239 18802 2896 1 5 . 1 1 66 66 ARG N N 66 119.000 119.000 118.175 0.825 18802 2897 1 5 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.263 -0.049 18802 2898 1 5 . 1 1 66 66 ARG C C 66 178.064 178.064 178.070 -0.006 18802 2899 1 5 . 1 1 66 66 ARG CA C 66 58.224 58.224 57.759 0.465 18802 2900 1 5 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.728 -0.105 18802 2901 1 5 . 1 1 66 66 ARG H H 66 8.102 8.102 8.126 -0.024 18802 2902 1 5 . 1 1 67 67 THR N N 67 109.849 109.849 108.727 1.122 18802 2903 1 5 . 1 1 67 67 THR HA H 67 4.313 4.313 4.479 -0.166 18802 2904 1 5 . 1 1 67 67 THR C C 67 175.834 175.834 176.124 -0.290 18802 2905 1 5 . 1 1 67 67 THR CA C 67 62.681 62.681 62.140 0.541 18802 2906 1 5 . 1 1 67 67 THR CB C 67 70.768 70.768 69.879 0.889 18802 2907 1 5 . 1 1 67 67 THR H H 67 7.956 7.956 8.075 -0.119 18802 2908 1 5 . 1 1 68 68 GLY N N 68 110.673 110.673 111.226 -0.553 18802 2909 1 5 . 1 1 68 68 GLY C C 68 173.968 173.968 173.900 0.068 18802 2910 1 5 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.224 0.806 18802 2911 1 5 . 1 1 68 68 GLY H H 68 8.016 8.016 8.151 -0.135 18802 2912 1 5 . 1 1 69 69 ASP N N 69 121.490 121.490 120.747 0.743 18802 2913 1 5 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.837 -0.182 18802 2914 1 5 . 1 1 69 69 ASP C C 69 175.983 175.983 176.177 -0.194 18802 2915 1 5 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.022 0.833 18802 2916 1 5 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.419 0.227 18802 2917 1 5 . 1 1 69 69 ASP H H 69 8.048 8.048 7.845 0.203 18802 2918 1 5 . 1 1 70 70 LEU N N 70 120.838 120.838 123.178 -2.340 18802 2919 1 5 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.546 -0.407 18802 2920 1 5 . 1 1 70 70 LEU C C 70 177.530 177.530 177.951 -0.421 18802 2921 1 5 . 1 1 70 70 LEU CA C 70 55.280 55.280 54.158 1.122 18802 2922 1 5 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.353 -0.217 18802 2923 1 5 . 1 1 70 70 LEU H H 70 7.988 7.988 7.834 0.154 18802 2924 1 5 . 1 1 71 71 GLY N N 71 108.059 108.059 107.330 0.729 18802 2925 1 5 . 1 1 71 71 GLY C C 71 173.936 173.936 174.885 -0.949 18802 2926 1 5 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.553 0.005 18802 2927 1 5 . 1 1 71 71 GLY H H 71 8.341 8.341 8.209 0.132 18802 2928 1 5 . 1 1 72 72 ILE N N 72 121.037 121.037 122.369 -1.332 18802 2929 1 5 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.390 0.004 18802 2930 1 5 . 1 1 72 72 ILE C C 72 174.227 174.227 174.599 -0.372 18802 2931 1 5 . 1 1 72 72 ILE CA C 72 58.539 58.539 57.484 1.055 18802 2932 1 5 . 1 1 72 72 ILE CB C 72 38.810 38.810 38.304 0.506 18802 2933 1 5 . 1 1 72 72 ILE H H 72 7.793 7.793 7.902 -0.109 18802 2934 1 5 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.683 -0.061 18802 2935 1 5 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.965 -0.325 18802 2936 1 5 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.352 -0.249 18802 2937 1 5 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.432 -0.060 18802 2938 1 5 . 1 1 74 74 PRO C C 74 176.423 176.423 175.988 0.435 18802 2939 1 5 . 1 1 74 74 PRO CA C 74 63.041 63.041 63.226 -0.185 18802 2940 1 5 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.542 -0.512 18802 2941 1 5 . 1 1 75 75 ASN N N 75 119.550 119.550 121.809 -2.259 18802 2942 1 5 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.956 -0.027 18802 2943 1 5 . 1 1 75 75 ASN C C 75 174.066 174.066 175.883 -1.817 18802 2944 1 5 . 1 1 75 75 ASN CA C 75 51.151 51.151 50.520 0.631 18802 2945 1 5 . 1 1 75 75 ASN CB C 75 38.924 38.924 39.726 -0.802 18802 2946 1 5 . 1 1 75 75 ASN H H 75 8.422 8.422 8.375 0.047 18802 2947 1 5 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.129 0.164 18802 2948 1 5 . 1 1 76 76 PRO C C 76 177.322 177.322 178.023 -0.701 18802 2949 1 5 . 1 1 76 76 PRO CA C 76 64.384 64.384 65.414 -1.030 18802 2950 1 5 . 1 1 76 76 PRO CB C 76 32.236 32.236 31.803 0.433 18802 2951 1 5 . 1 1 77 77 GLU N N 77 118.523 118.523 115.299 3.224 18802 2952 1 5 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.227 -0.051 18802 2953 1 5 . 1 1 77 77 GLU C C 77 176.403 176.403 178.586 -2.183 18802 2954 1 5 . 1 1 77 77 GLU CA C 77 56.977 56.977 57.757 -0.780 18802 2955 1 5 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.585 1.275 18802 2956 1 5 . 1 1 77 77 GLU H H 77 8.426 8.426 8.585 -0.159 18802 2957 1 5 . 1 1 78 78 ASP N N 78 120.581 120.581 119.732 0.849 18802 2958 1 5 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.520 0.023 18802 2959 1 5 . 1 1 78 78 ASP C C 78 176.085 176.085 176.783 -0.698 18802 2960 1 5 . 1 1 78 78 ASP CA C 78 54.544 54.544 55.818 -1.274 18802 2961 1 5 . 1 1 78 78 ASP CB C 78 41.239 41.239 41.172 0.067 18802 2962 1 5 . 1 1 78 78 ASP H H 78 7.941 7.941 8.233 -0.292 18802 2963 1 5 . 1 1 79 79 ARG N N 79 121.043 121.043 118.077 2.966 18802 2964 1 5 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.334 -0.009 18802 2965 1 5 . 1 1 79 79 ARG C C 79 176.123 176.123 176.360 -0.237 18802 2966 1 5 . 1 1 79 79 ARG CA C 79 55.927 55.927 55.999 -0.072 18802 2967 1 5 . 1 1 79 79 ARG CB C 79 30.650 30.650 29.421 1.229 18802 2968 1 5 . 1 1 79 79 ARG H H 79 8.066 8.066 7.658 0.408 18802 2969 1 5 . 1 1 80 80 SER N N 80 118.338 118.338 117.960 0.378 18802 2970 1 5 . 1 1 80 80 SER HA H 80 4.672 4.672 4.764 -0.092 18802 2971 1 5 . 1 1 80 80 SER C C 80 172.577 172.577 172.480 0.097 18802 2972 1 5 . 1 1 80 80 SER CA C 80 56.564 56.564 56.156 0.408 18802 2973 1 5 . 1 1 80 80 SER CB C 80 63.415 63.415 63.537 -0.122 18802 2974 1 5 . 1 1 80 80 SER H H 80 8.281 8.281 7.605 0.676 18802 2975 1 5 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.378 0.042 18802 2976 1 5 . 1 1 81 81 PRO C C 81 176.727 176.727 176.015 0.712 18802 2977 1 5 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.050 0.213 18802 2978 1 5 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.199 -0.147 18802 2979 1 5 . 1 1 82 82 SER N N 82 117.341 117.341 119.059 -1.718 18802 2980 1 5 . 1 1 82 82 SER HA H 82 4.693 4.693 4.416 0.277 18802 2981 1 5 . 1 1 82 82 SER C C 82 172.803 172.803 173.103 -0.300 18802 2982 1 5 . 1 1 82 82 SER CA C 82 56.288 56.288 57.394 -1.106 18802 2983 1 5 . 1 1 82 82 SER CB C 82 63.500 63.500 63.293 0.207 18802 2984 1 5 . 1 1 82 82 SER H H 82 8.280 8.280 8.288 -0.008 18802 2985 1 5 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.377 -0.066 18802 2986 1 5 . 1 1 83 83 PRO C C 83 176.273 176.273 175.734 0.539 18802 2987 1 5 . 1 1 83 83 PRO CA C 83 63.115 63.115 63.118 -0.003 18802 2988 1 5 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.279 -0.180 18802 2989 1 5 . 1 1 84 84 GLU N N 84 122.213 122.213 122.237 -0.024 18802 2990 1 5 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.401 0.092 18802 2991 1 5 . 1 1 84 84 GLU C C 84 174.546 174.546 175.433 -0.887 18802 2992 1 5 . 1 1 84 84 GLU CA C 84 54.529 54.529 54.959 -0.430 18802 2993 1 5 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.551 0.387 18802 2994 1 5 . 1 1 84 84 GLU H H 84 8.230 8.230 8.351 -0.121 18802 2995 1 5 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.467 -0.052 18802 2996 1 5 . 1 1 85 85 PRO C C 85 176.024 176.024 175.510 0.514 18802 2997 1 5 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.330 0.912 18802 2998 1 5 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.501 -0.312 18802 2999 1 5 . 1 1 86 86 ILE N N 86 120.281 120.281 119.621 0.660 18802 3000 1 5 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.036 0.026 18802 3001 1 5 . 1 1 86 86 ILE C C 86 175.419 175.419 175.895 -0.476 18802 3002 1 5 . 1 1 86 86 ILE CA C 86 61.029 61.029 60.410 0.619 18802 3003 1 5 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.181 0.077 18802 3004 1 5 . 1 1 86 86 ILE H H 86 7.980 7.980 8.144 -0.164 18802 3005 1 5 . 1 1 87 87 TYR N N 87 123.089 123.089 125.253 -2.164 18802 3006 1 5 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.576 0.241 18802 3007 1 5 . 1 1 87 87 TYR C C 87 175.920 175.920 176.419 -0.499 18802 3008 1 5 . 1 1 87 87 TYR CA C 87 57.197 57.197 57.987 -0.790 18802 3009 1 5 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.076 1.102 18802 3010 1 5 . 1 1 87 87 TYR H H 87 8.194 8.194 8.461 -0.267 18802 3011 1 5 . 1 1 88 88 ASN N N 88 120.117 120.117 120.320 -0.203 18802 3012 1 5 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.781 -0.036 18802 3013 1 5 . 1 1 88 88 ASN C C 88 176.275 176.275 176.814 -0.539 18802 3014 1 5 . 1 1 88 88 ASN CA C 88 52.286 52.286 53.489 -1.204 18802 3015 1 5 . 1 1 88 88 ASN CB C 88 39.082 39.082 39.217 -0.135 18802 3016 1 5 . 1 1 88 88 ASN H H 88 8.386 8.386 8.964 -0.578 18802 3017 1 5 . 1 1 89 89 SER N N 89 115.826 115.826 116.480 -0.654 18802 3018 1 5 . 1 1 89 89 SER HA H 89 4.248 4.248 4.223 0.025 18802 3019 1 5 . 1 1 89 89 SER C C 89 175.066 175.066 174.798 0.268 18802 3020 1 5 . 1 1 89 89 SER CA C 89 60.012 60.012 60.634 -0.622 18802 3021 1 5 . 1 1 89 89 SER CB C 89 63.400 63.400 62.983 0.417 18802 3022 1 5 . 1 1 89 89 SER H H 89 8.371 8.371 8.647 -0.276 18802 3023 1 5 . 1 1 90 90 GLU N N 90 121.062 121.062 119.660 1.402 18802 3024 1 5 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.325 -0.047 18802 3025 1 5 . 1 1 90 90 GLU C C 90 176.936 176.936 176.711 0.225 18802 3026 1 5 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.022 0.759 18802 3027 1 5 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.231 0.832 18802 3028 1 5 . 1 1 90 90 GLU H H 90 8.018 8.018 8.258 -0.240 18802 3029 1 5 . 1 1 91 91 GLY N N 91 108.499 108.499 108.989 -0.490 18802 3030 1 5 . 1 1 91 91 GLY C C 91 174.115 174.115 173.432 0.683 18802 3031 1 5 . 1 1 91 91 GLY CA C 91 45.744 45.744 44.994 0.750 18802 3032 1 5 . 1 1 91 91 GLY H H 91 8.199 8.199 8.203 -0.004 18802 3033 1 5 . 1 1 92 92 LYS N N 92 120.638 120.638 119.907 0.731 18802 3034 1 5 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.604 -0.295 18802 3035 1 5 . 1 1 92 92 LYS C C 92 176.453 176.453 174.639 1.814 18802 3036 1 5 . 1 1 92 92 LYS CA C 92 55.856 55.856 54.895 0.961 18802 3037 1 5 . 1 1 92 92 LYS CB C 92 33.109 33.109 34.925 -1.816 18802 3038 1 5 . 1 1 92 92 LYS H H 92 7.956 7.956 7.565 0.391 18802 3039 1 5 . 1 1 93 93 ARG N N 93 122.999 122.999 124.113 -1.114 18802 3040 1 5 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.405 -0.214 18802 3041 1 5 . 1 1 93 93 ARG C C 93 176.325 176.325 174.375 1.950 18802 3042 1 5 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.432 0.950 18802 3043 1 5 . 1 1 93 93 ARG CB C 93 30.656 30.656 32.266 -1.609 18802 3044 1 5 . 1 1 93 93 ARG H H 93 8.403 8.403 8.601 -0.198 18802 3045 1 5 . 1 1 94 94 LEU N N 94 124.100 124.100 121.784 2.316 18802 3046 1 5 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.725 -0.462 18802 3047 1 5 . 1 1 94 94 LEU C C 94 176.993 176.993 175.064 1.929 18802 3048 1 5 . 1 1 94 94 LEU CA C 94 55.034 55.034 53.005 2.029 18802 3049 1 5 . 1 1 94 94 LEU CB C 94 42.941 42.941 44.144 -1.203 18802 3050 1 5 . 1 1 94 94 LEU H H 94 8.283 8.283 8.284 -0.001 18802 3051 1 5 . 1 1 95 95 ASN N N 95 119.593 119.593 118.120 1.473 18802 3052 1 5 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.789 -0.042 18802 3053 1 5 . 1 1 95 95 ASN C C 95 175.598 175.598 174.840 0.758 18802 3054 1 5 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.756 -1.076 18802 3055 1 5 . 1 1 95 95 ASN CB C 95 38.723 38.723 39.294 -0.571 18802 3056 1 5 . 1 1 95 95 ASN H H 95 8.460 8.460 8.237 0.223 18802 3057 1 5 . 1 1 96 96 THR N N 96 114.100 114.100 116.292 -2.192 18802 3058 1 5 . 1 1 96 96 THR HA H 96 4.226 4.226 4.535 -0.309 18802 3059 1 5 . 1 1 96 96 THR C C 96 175.186 175.186 175.065 0.121 18802 3060 1 5 . 1 1 96 96 THR CA C 96 62.203 62.203 64.728 -2.526 18802 3061 1 5 . 1 1 96 96 THR CB C 96 69.880 69.880 69.920 -0.040 18802 3062 1 5 . 1 1 96 96 THR H H 96 8.031 8.031 8.812 -0.781 18802 3063 1 5 . 1 1 97 97 ARG N N 97 122.587 122.587 122.156 0.431 18802 3064 1 5 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.350 -0.237 18802 3065 1 5 . 1 1 97 97 ARG C C 97 177.938 177.938 178.087 -0.149 18802 3066 1 5 . 1 1 97 97 ARG CA C 97 58.412 58.412 58.914 -0.502 18802 3067 1 5 . 1 1 97 97 ARG CB C 97 30.297 30.297 28.964 1.333 18802 3068 1 5 . 1 1 97 97 ARG H H 97 8.502 8.502 8.538 -0.036 18802 3069 1 5 . 1 1 98 98 GLU N N 98 121.548 121.548 120.607 0.941 18802 3070 1 5 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.146 -0.129 18802 3071 1 5 . 1 1 98 98 GLU C C 98 177.113 177.113 178.896 -1.783 18802 3072 1 5 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.760 -1.080 18802 3073 1 5 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.939 0.727 18802 3074 1 5 . 1 1 98 98 GLU H H 98 8.517 8.517 8.888 -0.371 18802 3075 1 5 . 1 1 99 99 PHE N N 99 121.388 121.388 120.387 1.001 18802 3076 1 5 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.217 0.105 18802 3077 1 5 . 1 1 99 99 PHE C C 99 177.070 177.070 177.080 -0.010 18802 3078 1 5 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.567 -1.492 18802 3079 1 5 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.266 0.220 18802 3080 1 5 . 1 1 99 99 PHE H H 99 8.176 8.176 8.089 0.087 18802 3081 1 5 . 1 1 100 100 ARG N N 100 120.211 120.211 119.286 0.925 18802 3082 1 5 . 1 1 100 100 ARG C C 100 178.159 178.159 178.678 -0.519 18802 3083 1 5 . 1 1 100 100 ARG CA C 100 58.533 58.533 60.140 -1.607 18802 3084 1 5 . 1 1 100 100 ARG CB C 100 30.588 30.588 30.230 0.358 18802 3085 1 5 . 1 1 100 100 ARG H H 100 8.377 8.377 8.365 0.012 18802 3086 1 5 . 1 1 101 101 THR N N 101 115.416 115.416 115.901 -0.485 18802 3087 1 5 . 1 1 101 101 THR HA H 101 4.022 4.022 4.024 -0.002 18802 3088 1 5 . 1 1 101 101 THR C C 101 175.301 175.301 176.918 -1.617 18802 3089 1 5 . 1 1 101 101 THR CA C 101 65.141 65.141 66.476 -1.335 18802 3090 1 5 . 1 1 101 101 THR CB C 101 69.305 69.305 68.303 1.002 18802 3091 1 5 . 1 1 101 101 THR H H 101 7.992 7.992 7.691 0.301 18802 3092 1 5 . 1 1 102 102 ARG N N 102 122.212 122.212 121.356 0.856 18802 3093 1 5 . 1 1 102 102 ARG HA H 102 4.307 4.307 4.007 0.300 18802 3094 1 5 . 1 1 102 102 ARG C C 102 177.644 177.644 178.331 -0.687 18802 3095 1 5 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.468 1.143 18802 3096 1 5 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.021 -0.213 18802 3097 1 5 . 1 1 102 102 ARG H H 102 8.369 8.369 7.682 0.687 18802 3098 1 5 . 1 1 103 103 LYS N N 103 117.591 117.591 120.170 -2.579 18802 3099 1 5 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.836 0.124 18802 3100 1 5 . 1 1 103 103 LYS C C 103 178.913 178.913 178.645 0.268 18802 3101 1 5 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.965 0.085 18802 3102 1 5 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.863 0.278 18802 3103 1 5 . 1 1 103 103 LYS H H 103 7.941 7.941 8.505 -0.564 18802 3104 1 5 . 1 1 104 104 LYS N N 104 119.769 119.769 119.793 -0.024 18802 3105 1 5 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.088 0.058 18802 3106 1 5 . 1 1 104 104 LYS C C 104 179.377 179.377 178.794 0.583 18802 3107 1 5 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.761 0.218 18802 3108 1 5 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.578 0.613 18802 3109 1 5 . 1 1 104 104 LYS H H 104 7.615 7.615 7.885 -0.270 18802 3110 1 5 . 1 1 105 105 LEU N N 105 120.500 120.500 119.138 1.362 18802 3111 1 5 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.978 0.139 18802 3112 1 5 . 1 1 105 105 LEU C C 105 179.481 179.481 179.103 0.378 18802 3113 1 5 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.077 0.184 18802 3114 1 5 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.487 0.517 18802 3115 1 5 . 1 1 105 105 LEU H H 105 8.057 8.057 7.649 0.408 18802 3116 1 5 . 1 1 106 106 GLU N N 106 118.803 118.803 118.644 0.159 18802 3117 1 5 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.978 0.011 18802 3118 1 5 . 1 1 106 106 GLU C C 106 180.577 180.577 179.331 1.246 18802 3119 1 5 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.717 0.093 18802 3120 1 5 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.184 0.825 18802 3121 1 5 . 1 1 106 106 GLU H H 106 8.652 8.652 8.337 0.315 18802 3122 1 5 . 1 1 107 107 GLU N N 107 122.396 122.396 119.526 2.870 18802 3123 1 5 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.253 -0.147 18802 3124 1 5 . 1 1 107 107 GLU C C 107 178.457 178.457 179.237 -0.780 18802 3125 1 5 . 1 1 107 107 GLU CA C 107 59.826 59.826 58.889 0.937 18802 3126 1 5 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.144 0.418 18802 3127 1 5 . 1 1 107 107 GLU H H 107 8.281 8.281 8.508 -0.227 18802 3128 1 5 . 1 1 108 108 GLU N N 108 120.976 120.976 119.441 1.535 18802 3129 1 5 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.034 0.058 18802 3130 1 5 . 1 1 108 108 GLU C C 108 179.343 179.343 179.161 0.182 18802 3131 1 5 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.180 0.516 18802 3132 1 5 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.281 0.289 18802 3133 1 5 . 1 1 108 108 GLU H H 108 8.321 8.321 8.283 0.038 18802 3134 1 5 . 1 1 109 109 ARG N N 109 118.559 118.559 119.788 -1.229 18802 3135 1 5 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.929 -0.137 18802 3136 1 5 . 1 1 109 109 ARG C C 109 177.178 177.178 178.078 -0.900 18802 3137 1 5 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.759 0.724 18802 3138 1 5 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.267 -0.118 18802 3139 1 5 . 1 1 109 109 ARG H H 109 8.594 8.594 8.238 0.356 18802 3140 1 5 . 1 1 110 110 HIS N N 110 119.632 119.632 118.959 0.673 18802 3141 1 5 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.234 0.107 18802 3142 1 5 . 1 1 110 110 HIS C C 110 177.578 177.578 177.313 0.265 18802 3143 1 5 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.653 0.965 18802 3144 1 5 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.108 0.401 18802 3145 1 5 . 1 1 110 110 HIS H H 110 8.465 8.465 8.294 0.171 18802 3146 1 5 . 1 1 111 111 ASN N N 111 119.587 119.587 118.459 1.128 18802 3147 1 5 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.241 0.037 18802 3148 1 5 . 1 1 111 111 ASN C C 111 178.630 178.630 177.929 0.701 18802 3149 1 5 . 1 1 111 111 ASN CA C 111 56.281 56.281 55.874 0.407 18802 3150 1 5 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.111 -0.416 18802 3151 1 5 . 1 1 111 111 ASN H H 111 8.323 8.323 8.552 -0.229 18802 3152 1 5 . 1 1 112 112 LEU N N 112 122.320 122.320 120.389 1.931 18802 3153 1 5 . 1 1 112 112 LEU HA H 112 4.116 4.116 3.977 0.139 18802 3154 1 5 . 1 1 112 112 LEU C C 112 178.539 178.539 178.705 -0.166 18802 3155 1 5 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.761 0.218 18802 3156 1 5 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.786 0.808 18802 3157 1 5 . 1 1 112 112 LEU H H 112 7.966 7.966 7.589 0.377 18802 3158 1 5 . 1 1 113 113 ILE N N 113 121.495 121.495 120.220 1.275 18802 3159 1 5 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.683 -0.447 18802 3160 1 5 . 1 1 113 113 ILE C C 113 176.959 176.959 178.360 -1.401 18802 3161 1 5 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.428 1.626 18802 3162 1 5 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.124 1.479 18802 3163 1 5 . 1 1 113 113 ILE H H 113 8.472 8.472 8.391 0.081 18802 3164 1 5 . 1 1 114 114 THR N N 114 115.066 115.066 115.636 -0.570 18802 3165 1 5 . 1 1 114 114 THR HA H 114 3.718 3.718 3.934 -0.216 18802 3166 1 5 . 1 1 114 114 THR C C 114 176.559 176.559 176.584 -0.025 18802 3167 1 5 . 1 1 114 114 THR CA C 114 66.700 66.700 67.201 -0.501 18802 3168 1 5 . 1 1 114 114 THR CB C 114 68.759 68.759 68.467 0.292 18802 3169 1 5 . 1 1 114 114 THR H H 114 8.075 8.075 8.224 -0.149 18802 3170 1 5 . 1 1 115 115 GLU N N 115 123.259 123.259 122.008 1.251 18802 3171 1 5 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.099 -0.167 18802 3172 1 5 . 1 1 115 115 GLU C C 115 178.191 178.191 178.389 -0.198 18802 3173 1 5 . 1 1 115 115 GLU CA C 115 59.340 59.340 58.812 0.528 18802 3174 1 5 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.242 0.157 18802 3175 1 5 . 1 1 115 115 GLU H H 115 7.368 7.368 7.611 -0.243 18802 3176 1 5 . 1 1 116 116 MET N N 116 119.844 119.844 120.156 -0.312 18802 3177 1 5 . 1 1 116 116 MET HA H 116 4.014 4.014 3.969 0.045 18802 3178 1 5 . 1 1 116 116 MET C C 116 177.888 177.888 178.018 -0.130 18802 3179 1 5 . 1 1 116 116 MET CA C 116 57.183 57.183 59.278 -2.095 18802 3180 1 5 . 1 1 116 116 MET CB C 116 32.126 32.126 32.282 -0.156 18802 3181 1 5 . 1 1 116 116 MET H H 116 8.373 8.373 8.327 0.046 18802 3182 1 5 . 1 1 117 117 VAL N N 117 117.572 117.572 119.751 -2.179 18802 3183 1 5 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.074 -0.178 18802 3184 1 5 . 1 1 117 117 VAL C C 117 177.567 177.567 177.589 -0.022 18802 3185 1 5 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.162 -1.292 18802 3186 1 5 . 1 1 117 117 VAL CB C 117 32.002 32.002 31.729 0.273 18802 3187 1 5 . 1 1 117 117 VAL H H 117 8.279 8.279 8.405 -0.126 18802 3188 1 5 . 1 1 118 118 ALA N N 118 120.560 120.560 121.504 -0.944 18802 3189 1 5 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.148 -0.012 18802 3190 1 5 . 1 1 118 118 ALA C C 118 179.595 179.595 179.230 0.365 18802 3191 1 5 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.712 -0.609 18802 3192 1 5 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.686 -0.436 18802 3193 1 5 . 1 1 118 118 ALA H H 118 7.074 7.074 7.350 -0.276 18802 3194 1 5 . 1 1 119 119 LEU N N 119 117.987 117.987 117.462 0.525 18802 3195 1 5 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.130 0.010 18802 3196 1 5 . 1 1 119 119 LEU C C 119 177.863 177.863 177.135 0.728 18802 3197 1 5 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.791 -0.119 18802 3198 1 5 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.746 0.488 18802 3199 1 5 . 1 1 119 119 LEU H H 119 7.525 7.525 7.722 -0.197 18802 3200 1 5 . 1 1 120 120 ASN N N 120 115.338 115.338 115.857 -0.519 18802 3201 1 5 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.135 -0.117 18802 3202 1 5 . 1 1 120 120 ASN C C 120 172.510 172.510 173.991 -1.481 18802 3203 1 5 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.103 -0.002 18802 3204 1 5 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.704 -1.399 18802 3205 1 5 . 1 1 120 120 ASN H H 120 8.467 8.467 8.010 0.457 18802 3206 1 5 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.497 0.159 18802 3207 1 5 . 1 1 121 121 PRO C C 121 177.020 177.020 176.702 0.318 18802 3208 1 5 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.336 -0.038 18802 3209 1 5 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.314 -0.015 18802 3210 1 5 . 1 1 122 122 ASP N N 122 115.744 115.744 117.862 -2.118 18802 3211 1 5 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.692 -0.023 18802 3212 1 5 . 1 1 122 122 ASP C C 122 176.004 176.004 175.529 0.475 18802 3213 1 5 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.448 0.918 18802 3214 1 5 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.571 -0.246 18802 3215 1 5 . 1 1 122 122 ASP H H 122 7.600 7.600 8.048 -0.448 18802 3216 1 5 . 1 1 123 123 PHE N N 123 122.722 122.722 121.579 1.143 18802 3217 1 5 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.548 -0.413 18802 3218 1 5 . 1 1 123 123 PHE C C 123 173.954 173.954 174.639 -0.685 18802 3219 1 5 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.151 0.842 18802 3220 1 5 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.431 0.165 18802 3221 1 5 . 1 1 123 123 PHE H H 123 7.940 7.940 7.433 0.507 18802 3222 1 5 . 1 1 124 124 LYS N N 124 129.400 129.400 130.257 -0.857 18802 3223 1 5 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.374 0.185 18802 3224 1 5 . 1 1 124 124 LYS C C 124 172.622 172.622 173.962 -1.340 18802 3225 1 5 . 1 1 124 124 LYS CA C 124 51.815 51.815 53.014 -1.199 18802 3226 1 5 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.353 1.228 18802 3227 1 5 . 1 1 124 124 LYS H H 124 7.602 7.602 8.323 -0.721 18802 3228 1 5 . 1 1 125 125 PRO HA H 125 4.089 4.089 3.923 0.166 18802 3229 1 5 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.463 -0.467 18802 3230 1 5 . 1 1 125 125 PRO CB C 125 31.067 31.067 31.244 -0.176 18802 3231 1 5 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.388 -0.014 18802 3232 1 5 . 1 1 126 126 PRO C C 126 177.630 177.630 177.766 -0.136 18802 3233 1 5 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.712 0.102 18802 3234 1 5 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.367 -0.046 18802 3235 1 5 . 1 1 127 127 ALA N N 127 123.830 123.830 123.038 0.792 18802 3236 1 5 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.070 -0.012 18802 3237 1 5 . 1 1 127 127 ALA C C 127 177.641 177.641 178.996 -1.355 18802 3238 1 5 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.425 0.177 18802 3239 1 5 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.646 0.203 18802 3240 1 5 . 1 1 127 127 ALA H H 127 8.630 8.630 8.626 0.004 18802 3241 1 5 . 1 1 128 128 ASP N N 128 112.924 112.924 116.060 -3.136 18802 3242 1 5 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.533 -0.082 18802 3243 1 5 . 1 1 128 128 ASP C C 128 175.724 175.724 176.017 -0.293 18802 3244 1 5 . 1 1 128 128 ASP CA C 128 53.604 53.604 54.744 -1.140 18802 3245 1 5 . 1 1 128 128 ASP CB C 128 40.418 40.418 41.063 -0.645 18802 3246 1 5 . 1 1 128 128 ASP H H 128 8.335 8.335 8.380 -0.045 18802 3247 1 5 . 1 1 129 129 TYR N N 129 121.114 121.114 122.874 -1.760 18802 3248 1 5 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.405 -0.043 18802 3249 1 5 . 1 1 129 129 TYR C C 129 174.190 174.190 174.593 -0.403 18802 3250 1 5 . 1 1 129 129 TYR CA C 129 58.412 58.412 59.016 -0.604 18802 3251 1 5 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.309 0.750 18802 3252 1 5 . 1 1 129 129 TYR H H 129 7.600 7.600 7.616 -0.016 18802 3253 1 5 . 1 1 130 130 LYS N N 130 129.875 129.875 129.035 0.840 18802 3254 1 5 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.500 -0.182 18802 3255 1 5 . 1 1 130 130 LYS C C 130 172.314 172.314 174.140 -1.826 18802 3256 1 5 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.972 0.598 18802 3257 1 5 . 1 1 130 130 LYS CB C 130 33.663 33.663 33.596 0.067 18802 3258 1 5 . 1 1 130 130 LYS H H 130 7.695 7.695 8.312 -0.617 18802 3259 1 5 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.445 -0.168 18802 3260 1 5 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.535 -0.477 18802 3261 1 5 . 1 1 131 131 PRO CB C 131 30.852 30.852 30.840 0.011 18802 3262 1 5 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.422 -0.178 18802 3263 1 5 . 1 1 132 132 PRO C C 132 176.459 176.459 176.199 0.260 18802 3264 1 5 . 1 1 132 132 PRO CA C 132 62.874 62.874 62.527 0.347 18802 3265 1 5 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.633 -0.586 18802 3266 1 5 . 1 1 133 133 ALA N N 133 124.170 124.170 123.355 0.815 18802 3267 1 5 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.327 -0.077 18802 3268 1 5 . 1 1 133 133 ALA C C 133 177.870 177.870 177.799 0.071 18802 3269 1 5 . 1 1 133 133 ALA CA C 133 52.508 52.508 53.401 -0.893 18802 3270 1 5 . 1 1 133 133 ALA CB C 133 19.303 19.303 19.338 -0.035 18802 3271 1 5 . 1 1 133 133 ALA H H 133 8.311 8.311 8.533 -0.222 18802 3272 1 5 . 1 1 134 134 THR N N 134 113.807 113.807 111.859 1.948 18802 3273 1 5 . 1 1 134 134 THR HA H 134 4.228 4.228 4.474 -0.246 18802 3274 1 5 . 1 1 134 134 THR C C 134 174.282 174.282 174.268 0.014 18802 3275 1 5 . 1 1 134 134 THR CA C 134 62.127 62.127 60.704 1.423 18802 3276 1 5 . 1 1 134 134 THR CB C 134 69.870 69.870 70.430 -0.559 18802 3277 1 5 . 1 1 134 134 THR H H 134 8.019 8.019 7.654 0.365 18802 3278 1 5 . 1 1 135 135 ARG N N 135 124.165 124.165 123.903 0.262 18802 3279 1 5 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.359 -0.010 18802 3280 1 5 . 1 1 135 135 ARG C C 135 176.217 176.217 176.444 -0.227 18802 3281 1 5 . 1 1 135 135 ARG CA C 135 55.993 55.993 55.839 0.154 18802 3282 1 5 . 1 1 135 135 ARG CB C 135 30.992 30.992 28.749 2.243 18802 3283 1 5 . 1 1 135 135 ARG H H 135 8.300 8.300 8.635 -0.335 18802 3284 1 5 . 1 1 136 136 VAL N N 136 122.157 122.157 123.248 -1.091 18802 3285 1 5 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.013 0.057 18802 3286 1 5 . 1 1 136 136 VAL C C 136 176.180 176.180 175.260 0.920 18802 3287 1 5 . 1 1 136 136 VAL CA C 136 61.937 61.937 63.212 -1.275 18802 3288 1 5 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.274 0.473 18802 3289 1 5 . 1 1 136 136 VAL H H 136 8.233 8.233 8.105 0.128 18802 3290 1 5 . 1 1 137 137 SER N N 137 118.837 118.837 111.366 7.471 18802 3291 1 5 . 1 1 137 137 SER HA H 137 4.416 4.416 5.035 -0.619 18802 3292 1 5 . 1 1 137 137 SER C C 137 174.258 174.258 173.704 0.554 18802 3293 1 5 . 1 1 137 137 SER CA C 137 58.341 58.341 57.375 0.966 18802 3294 1 5 . 1 1 137 137 SER CB C 137 63.900 63.900 64.606 -0.706 18802 3295 1 5 . 1 1 137 137 SER H H 137 8.264 8.264 7.666 0.598 18802 3296 1 5 . 1 1 138 138 ASP N N 138 122.871 122.871 126.510 -3.639 18802 3297 1 5 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.671 -0.134 18802 3298 1 5 . 1 1 138 138 ASP C C 138 176.053 176.053 176.680 -0.627 18802 3299 1 5 . 1 1 138 138 ASP CA C 138 54.489 54.489 55.727 -1.238 18802 3300 1 5 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.933 -0.785 18802 3301 1 5 . 1 1 138 138 ASP H H 138 8.249 8.249 8.268 -0.019 18802 3302 1 5 . 1 1 139 139 LYS N N 139 120.944 120.944 115.641 5.303 18802 3303 1 5 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.299 -0.039 18802 3304 1 5 . 1 1 139 139 LYS C C 139 176.343 176.343 175.353 0.990 18802 3305 1 5 . 1 1 139 139 LYS CA C 139 56.261 56.261 56.594 -0.333 18802 3306 1 5 . 1 1 139 139 LYS CB C 139 33.077 33.077 32.415 0.662 18802 3307 1 5 . 1 1 139 139 LYS H H 139 8.084 8.084 8.112 -0.028 18802 3308 1 5 . 1 1 140 140 VAL N N 140 121.670 121.670 119.236 2.434 18802 3309 1 5 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.536 -0.524 18802 3310 1 5 . 1 1 140 140 VAL C C 140 175.842 175.842 174.292 1.550 18802 3311 1 5 . 1 1 140 140 VAL CA C 140 62.442 62.442 60.837 1.605 18802 3312 1 5 . 1 1 140 140 VAL CB C 140 32.867 32.867 33.705 -0.838 18802 3313 1 5 . 1 1 140 140 VAL H H 140 8.025 8.025 7.841 0.184 18802 3314 1 5 . 1 1 141 141 MET N N 141 124.839 124.839 121.744 3.095 18802 3315 1 5 . 1 1 141 141 MET HA H 141 4.453 4.453 5.149 -0.696 18802 3316 1 5 . 1 1 141 141 MET C C 141 175.562 175.562 175.103 0.459 18802 3317 1 5 . 1 1 141 141 MET CA C 141 55.349 55.349 53.764 1.585 18802 3318 1 5 . 1 1 141 141 MET CB C 141 32.993 32.993 35.764 -2.772 18802 3319 1 5 . 1 1 141 141 MET H H 141 8.364 8.364 8.233 0.131 18802 3320 1 5 . 1 1 142 142 ILE N N 142 124.515 124.515 125.912 -1.397 18802 3321 1 5 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.482 -0.054 18802 3322 1 5 . 1 1 142 142 ILE C C 142 174.331 174.331 174.308 0.023 18802 3323 1 5 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.471 -0.067 18802 3324 1 5 . 1 1 142 142 ILE CB C 142 38.755 38.755 37.978 0.777 18802 3325 1 5 . 1 1 142 142 ILE H H 142 8.093 8.093 8.508 -0.415 18802 3326 1 5 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.443 -0.093 18802 3327 1 5 . 1 1 143 143 PRO C C 143 176.623 176.623 175.859 0.764 18802 3328 1 5 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.509 0.906 18802 3329 1 5 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.403 -0.170 18802 3330 1 5 . 1 1 144 144 GLN N N 144 121.557 121.557 121.948 -0.391 18802 3331 1 5 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.328 -0.022 18802 3332 1 5 . 1 1 144 144 GLN C C 144 174.751 174.751 175.443 -0.692 18802 3333 1 5 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.853 -0.182 18802 3334 1 5 . 1 1 144 144 GLN CB C 144 30.118 30.118 28.770 1.348 18802 3335 1 5 . 1 1 144 144 GLN H H 144 8.392 8.392 8.416 -0.024 18802 3336 1 6 . 1 1 26 26 ALA N N 26 124.085 124.085 129.255 -5.170 18802 3337 1 6 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.060 0.232 18802 3338 1 6 . 1 1 26 26 ALA C C 26 177.101 177.101 177.872 -0.771 18802 3339 1 6 . 1 1 26 26 ALA CA C 26 52.921 52.921 53.456 -0.535 18802 3340 1 6 . 1 1 26 26 ALA CB C 26 19.426 19.426 18.250 1.176 18802 3341 1 6 . 1 1 26 26 ALA H H 26 8.498 8.498 8.627 -0.129 18802 3342 1 6 . 1 1 27 27 MET N N 27 119.630 119.630 121.344 -1.714 18802 3343 1 6 . 1 1 27 27 MET HA H 27 4.391 4.391 4.526 -0.135 18802 3344 1 6 . 1 1 27 27 MET C C 27 176.296 176.296 175.559 0.737 18802 3345 1 6 . 1 1 27 27 MET CA C 27 55.834 55.834 54.141 1.694 18802 3346 1 6 . 1 1 27 27 MET CB C 27 32.663 32.663 30.429 2.234 18802 3347 1 6 . 1 1 27 27 MET H H 27 8.441 8.441 7.874 0.567 18802 3348 1 6 . 1 1 28 28 GLU N N 28 122.376 122.376 125.860 -3.484 18802 3349 1 6 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.506 -0.292 18802 3350 1 6 . 1 1 28 28 GLU C C 28 176.310 176.310 175.310 1.000 18802 3351 1 6 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.219 0.600 18802 3352 1 6 . 1 1 28 28 GLU CB C 28 30.252 30.252 30.566 -0.314 18802 3353 1 6 . 1 1 28 28 GLU H H 28 8.336 8.336 8.270 0.066 18802 3354 1 6 . 1 1 29 29 GLN N N 29 122.010 122.010 124.573 -2.563 18802 3355 1 6 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.402 -0.111 18802 3356 1 6 . 1 1 29 29 GLN C C 29 175.765 175.765 174.430 1.335 18802 3357 1 6 . 1 1 29 29 GLN CA C 29 55.839 55.839 55.559 0.280 18802 3358 1 6 . 1 1 29 29 GLN CB C 29 29.559 29.559 30.368 -0.809 18802 3359 1 6 . 1 1 29 29 GLN H H 29 8.347 8.347 8.302 0.045 18802 3360 1 6 . 1 1 30 30 LYS N N 30 123.090 123.090 125.479 -2.389 18802 3361 1 6 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.589 -0.253 18802 3362 1 6 . 1 1 30 30 LYS C C 30 176.474 176.474 176.437 0.037 18802 3363 1 6 . 1 1 30 30 LYS CA C 30 56.391 56.391 55.641 0.750 18802 3364 1 6 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.908 0.085 18802 3365 1 6 . 1 1 30 30 LYS H H 30 8.327 8.327 8.646 -0.319 18802 3366 1 6 . 1 1 31 31 THR N N 31 116.800 116.800 120.189 -3.389 18802 3367 1 6 . 1 1 31 31 THR HA H 31 4.273 4.273 4.469 -0.196 18802 3368 1 6 . 1 1 31 31 THR C C 31 174.071 174.071 174.106 -0.035 18802 3369 1 6 . 1 1 31 31 THR CA C 31 62.103 62.103 61.956 0.147 18802 3370 1 6 . 1 1 31 31 THR CB C 31 69.899 69.899 69.667 0.232 18802 3371 1 6 . 1 1 31 31 THR H H 31 8.160 8.160 8.532 -0.372 18802 3372 1 6 . 1 1 32 32 VAL N N 32 124.108 124.108 126.811 -2.703 18802 3373 1 6 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.150 -0.084 18802 3374 1 6 . 1 1 32 32 VAL C C 32 175.573 175.573 175.334 0.239 18802 3375 1 6 . 1 1 32 32 VAL CA C 32 62.344 62.344 62.147 0.197 18802 3376 1 6 . 1 1 32 32 VAL CB C 32 32.912 32.912 32.825 0.087 18802 3377 1 6 . 1 1 32 32 VAL H H 32 8.192 8.192 8.559 -0.367 18802 3378 1 6 . 1 1 33 33 ILE N N 33 127.371 127.371 130.773 -3.402 18802 3379 1 6 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.505 -0.081 18802 3380 1 6 . 1 1 33 33 ILE C C 33 174.335 174.335 174.265 0.070 18802 3381 1 6 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.627 0.767 18802 3382 1 6 . 1 1 33 33 ILE CB C 33 38.799 38.799 38.832 -0.033 18802 3383 1 6 . 1 1 33 33 ILE H H 33 8.275 8.275 8.478 -0.203 18802 3384 1 6 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.469 -0.166 18802 3385 1 6 . 1 1 34 34 PRO C C 34 177.261 177.261 177.768 -0.507 18802 3386 1 6 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.395 0.277 18802 3387 1 6 . 1 1 34 34 PRO CB C 34 32.177 32.177 32.106 0.071 18802 3388 1 6 . 1 1 35 35 GLY N N 35 109.540 109.540 110.146 -0.606 18802 3389 1 6 . 1 1 35 35 GLY C C 35 173.906 173.906 174.325 -0.419 18802 3390 1 6 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.767 0.503 18802 3391 1 6 . 1 1 35 35 GLY H H 35 8.376 8.376 8.564 -0.188 18802 3392 1 6 . 1 1 36 36 MET N N 36 120.834 120.834 121.489 -0.655 18802 3393 1 6 . 1 1 36 36 MET HA H 36 4.780 4.780 4.684 0.096 18802 3394 1 6 . 1 1 36 36 MET C C 36 174.235 174.235 174.173 0.062 18802 3395 1 6 . 1 1 36 36 MET CA C 36 53.258 53.258 53.601 -0.343 18802 3396 1 6 . 1 1 36 36 MET CB C 36 32.734 32.734 32.887 -0.153 18802 3397 1 6 . 1 1 36 36 MET H H 36 7.986 7.986 7.603 0.383 18802 3398 1 6 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.492 -0.030 18802 3399 1 6 . 1 1 37 37 PRO C C 37 176.736 176.736 176.088 0.648 18802 3400 1 6 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.913 0.345 18802 3401 1 6 . 1 1 37 37 PRO CB C 37 32.200 32.200 31.997 0.203 18802 3402 1 6 . 1 1 38 38 THR N N 38 115.642 115.642 120.532 -4.890 18802 3403 1 6 . 1 1 38 38 THR HA H 38 4.226 4.226 4.384 -0.158 18802 3404 1 6 . 1 1 38 38 THR C C 38 174.164 174.164 174.453 -0.289 18802 3405 1 6 . 1 1 38 38 THR CA C 38 62.462 62.462 62.167 0.295 18802 3406 1 6 . 1 1 38 38 THR CB C 38 69.874 69.874 69.504 0.370 18802 3407 1 6 . 1 1 38 38 THR H H 38 8.189 8.189 8.256 -0.067 18802 3408 1 6 . 1 1 39 39 VAL N N 39 123.700 123.700 128.327 -4.627 18802 3409 1 6 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.322 -0.243 18802 3410 1 6 . 1 1 39 39 VAL C C 39 175.177 175.177 174.933 0.244 18802 3411 1 6 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.422 0.569 18802 3412 1 6 . 1 1 39 39 VAL CB C 39 32.898 32.898 33.387 -0.489 18802 3413 1 6 . 1 1 39 39 VAL H H 39 8.036 8.036 8.691 -0.655 18802 3414 1 6 . 1 1 40 40 ILE N N 40 127.780 127.780 128.934 -1.154 18802 3415 1 6 . 1 1 40 40 ILE HA H 40 4.177 4.177 3.999 0.178 18802 3416 1 6 . 1 1 40 40 ILE C C 40 173.894 173.894 174.646 -0.752 18802 3417 1 6 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.547 -1.636 18802 3418 1 6 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.518 1.115 18802 3419 1 6 . 1 1 40 40 ILE H H 40 8.236 8.236 8.351 -0.115 18802 3420 1 6 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.549 -0.058 18802 3421 1 6 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.261 0.363 18802 3422 1 6 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.145 -0.043 18802 3423 1 6 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.301 -0.046 18802 3424 1 6 . 1 1 42 42 PRO C C 42 177.721 177.721 177.490 0.231 18802 3425 1 6 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.059 -0.259 18802 3426 1 6 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.910 0.445 18802 3427 1 6 . 1 1 43 43 GLY N N 43 107.305 107.305 109.868 -2.563 18802 3428 1 6 . 1 1 43 43 GLY C C 43 174.642 174.642 173.688 0.954 18802 3429 1 6 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.791 0.927 18802 3430 1 6 . 1 1 43 43 GLY H H 43 8.321 8.321 8.497 -0.176 18802 3431 1 6 . 1 1 44 44 LEU N N 44 120.897 120.897 122.048 -1.151 18802 3432 1 6 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.455 0.074 18802 3433 1 6 . 1 1 44 44 LEU C C 44 178.580 178.580 176.527 2.053 18802 3434 1 6 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.321 0.229 18802 3435 1 6 . 1 1 44 44 LEU CB C 44 42.579 42.579 42.896 -0.317 18802 3436 1 6 . 1 1 44 44 LEU H H 44 8.043 8.043 7.778 0.265 18802 3437 1 6 . 1 1 45 45 THR N N 45 113.195 113.195 112.849 0.346 18802 3438 1 6 . 1 1 45 45 THR HA H 45 4.386 4.386 4.517 -0.131 18802 3439 1 6 . 1 1 45 45 THR C C 45 175.377 175.377 175.537 -0.160 18802 3440 1 6 . 1 1 45 45 THR CA C 45 61.188 61.188 60.511 0.677 18802 3441 1 6 . 1 1 45 45 THR CB C 45 71.043 71.043 70.776 0.267 18802 3442 1 6 . 1 1 45 45 THR H H 45 8.427 8.427 8.116 0.311 18802 3443 1 6 . 1 1 46 46 ARG N N 46 121.322 121.322 123.119 -1.797 18802 3444 1 6 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.322 -0.285 18802 3445 1 6 . 1 1 46 46 ARG C C 46 179.309 179.309 178.191 1.118 18802 3446 1 6 . 1 1 46 46 ARG CA C 46 59.384 59.384 58.951 0.433 18802 3447 1 6 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.275 0.541 18802 3448 1 6 . 1 1 46 46 ARG H H 46 8.832 8.832 8.875 -0.043 18802 3449 1 6 . 1 1 47 47 GLU N N 47 119.109 119.109 119.462 -0.353 18802 3450 1 6 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.107 -0.098 18802 3451 1 6 . 1 1 47 47 GLU C C 47 178.931 178.931 178.985 -0.054 18802 3452 1 6 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.896 0.380 18802 3453 1 6 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.676 0.615 18802 3454 1 6 . 1 1 47 47 GLU H H 47 8.754 8.754 8.569 0.185 18802 3455 1 6 . 1 1 48 48 GLN N N 48 119.556 119.556 119.960 -0.404 18802 3456 1 6 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.039 0.027 18802 3457 1 6 . 1 1 48 48 GLN C C 48 179.286 179.286 178.228 1.058 18802 3458 1 6 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.690 -0.475 18802 3459 1 6 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.314 1.353 18802 3460 1 6 . 1 1 48 48 GLN H H 48 7.711 7.711 7.882 -0.171 18802 3461 1 6 . 1 1 49 49 GLU N N 49 122.227 122.227 120.614 1.613 18802 3462 1 6 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.941 -0.068 18802 3463 1 6 . 1 1 49 49 GLU C C 49 177.879 177.879 179.050 -1.171 18802 3464 1 6 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.996 -0.038 18802 3465 1 6 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.477 0.301 18802 3466 1 6 . 1 1 49 49 GLU H H 49 8.730 8.730 8.691 0.039 18802 3467 1 6 . 1 1 50 50 ARG N N 50 119.109 119.109 118.443 0.666 18802 3468 1 6 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.008 0.061 18802 3469 1 6 . 1 1 50 50 ARG C C 50 177.567 177.567 178.696 -1.129 18802 3470 1 6 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.048 0.178 18802 3471 1 6 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.280 -0.184 18802 3472 1 6 . 1 1 50 50 ARG H H 50 7.906 7.906 7.877 0.029 18802 3473 1 6 . 1 1 51 51 ALA N N 51 119.411 119.411 123.106 -3.695 18802 3474 1 6 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.888 -0.084 18802 3475 1 6 . 1 1 51 51 ALA C C 51 178.740 178.740 179.135 -0.395 18802 3476 1 6 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.010 0.225 18802 3477 1 6 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.315 -0.056 18802 3478 1 6 . 1 1 51 51 ALA H H 51 7.956 7.956 8.492 -0.536 18802 3479 1 6 . 1 1 52 52 TYR N N 52 119.160 119.160 119.879 -0.719 18802 3480 1 6 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.160 -0.102 18802 3481 1 6 . 1 1 52 52 TYR C C 52 177.367 177.367 177.440 -0.073 18802 3482 1 6 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.345 0.260 18802 3483 1 6 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.494 0.215 18802 3484 1 6 . 1 1 52 52 TYR H H 52 7.854 7.854 8.072 -0.218 18802 3485 1 6 . 1 1 53 53 ILE N N 53 119.173 119.173 119.456 -0.283 18802 3486 1 6 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.219 0.383 18802 3487 1 6 . 1 1 53 53 ILE C C 53 178.711 178.711 177.740 0.971 18802 3488 1 6 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.506 -1.318 18802 3489 1 6 . 1 1 53 53 ILE CB C 53 38.314 38.314 38.114 0.200 18802 3490 1 6 . 1 1 53 53 ILE H H 53 7.809 7.809 8.290 -0.481 18802 3491 1 6 . 1 1 54 54 VAL N N 54 121.549 121.549 117.268 4.281 18802 3492 1 6 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.793 -0.319 18802 3493 1 6 . 1 1 54 54 VAL C C 54 177.992 177.992 177.837 0.155 18802 3494 1 6 . 1 1 54 54 VAL CA C 54 66.995 66.995 65.471 1.524 18802 3495 1 6 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.375 -0.143 18802 3496 1 6 . 1 1 54 54 VAL H H 54 8.572 8.572 8.528 0.044 18802 3497 1 6 . 1 1 55 55 GLN N N 55 119.997 119.997 120.379 -0.382 18802 3498 1 6 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.927 -0.226 18802 3499 1 6 . 1 1 55 55 GLN C C 55 178.604 178.604 178.426 0.178 18802 3500 1 6 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.026 1.169 18802 3501 1 6 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.669 -0.527 18802 3502 1 6 . 1 1 55 55 GLN H H 55 8.183 8.183 7.873 0.310 18802 3503 1 6 . 1 1 56 56 LEU N N 56 119.605 119.605 119.438 0.167 18802 3504 1 6 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.850 0.096 18802 3505 1 6 . 1 1 56 56 LEU C C 56 180.439 180.439 179.319 1.120 18802 3506 1 6 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.608 0.627 18802 3507 1 6 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.446 0.404 18802 3508 1 6 . 1 1 56 56 LEU H H 56 7.586 7.586 7.690 -0.104 18802 3509 1 6 . 1 1 57 57 GLN N N 57 120.332 120.332 118.730 1.602 18802 3510 1 6 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.967 0.142 18802 3511 1 6 . 1 1 57 57 GLN C C 57 179.166 179.166 178.660 0.506 18802 3512 1 6 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.863 0.527 18802 3513 1 6 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.668 0.822 18802 3514 1 6 . 1 1 57 57 GLN H H 57 8.046 8.046 7.735 0.311 18802 3515 1 6 . 1 1 58 58 ILE N N 58 120.945 120.945 120.843 0.102 18802 3516 1 6 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.583 -0.178 18802 3517 1 6 . 1 1 58 58 ILE C C 58 179.368 179.368 178.061 1.307 18802 3518 1 6 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.860 1.206 18802 3519 1 6 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.770 0.486 18802 3520 1 6 . 1 1 58 58 ILE H H 58 8.778 8.778 8.447 0.331 18802 3521 1 6 . 1 1 59 59 GLU N N 59 122.689 122.689 118.899 3.790 18802 3522 1 6 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.955 0.092 18802 3523 1 6 . 1 1 59 59 GLU C C 59 178.901 178.901 178.747 0.154 18802 3524 1 6 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.451 0.413 18802 3525 1 6 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.979 0.557 18802 3526 1 6 . 1 1 59 59 GLU H H 59 8.305 8.305 8.510 -0.205 18802 3527 1 6 . 1 1 60 60 ASP N N 60 121.505 121.505 121.473 0.032 18802 3528 1 6 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.383 0.054 18802 3529 1 6 . 1 1 60 60 ASP C C 60 178.312 178.312 178.664 -0.352 18802 3530 1 6 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.219 0.896 18802 3531 1 6 . 1 1 60 60 ASP CB C 60 42.248 42.248 41.134 1.114 18802 3532 1 6 . 1 1 60 60 ASP H H 60 8.142 8.142 7.797 0.345 18802 3533 1 6 . 1 1 61 61 LEU N N 61 118.666 118.666 119.947 -1.281 18802 3534 1 6 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.893 0.032 18802 3535 1 6 . 1 1 61 61 LEU C C 61 178.866 178.866 179.104 -0.238 18802 3536 1 6 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.131 0.171 18802 3537 1 6 . 1 1 61 61 LEU CB C 61 42.610 42.610 42.004 0.606 18802 3538 1 6 . 1 1 61 61 LEU H H 61 8.425 8.425 8.501 -0.076 18802 3539 1 6 . 1 1 62 62 THR N N 62 115.786 115.786 114.699 1.087 18802 3540 1 6 . 1 1 62 62 THR HA H 62 3.771 3.771 3.905 -0.134 18802 3541 1 6 . 1 1 62 62 THR C C 62 175.988 175.988 176.546 -0.558 18802 3542 1 6 . 1 1 62 62 THR CA C 62 67.649 67.649 66.695 0.954 18802 3543 1 6 . 1 1 62 62 THR CB C 62 68.848 68.848 68.501 0.347 18802 3544 1 6 . 1 1 62 62 THR H H 62 8.340 8.340 8.417 -0.077 18802 3545 1 6 . 1 1 63 63 ARG N N 63 122.111 122.111 121.718 0.393 18802 3546 1 6 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.967 0.022 18802 3547 1 6 . 1 1 63 63 ARG C C 63 179.715 179.715 177.701 2.014 18802 3548 1 6 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.760 0.326 18802 3549 1 6 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.169 -0.358 18802 3550 1 6 . 1 1 63 63 ARG H H 63 8.024 8.024 8.375 -0.351 18802 3551 1 6 . 1 1 64 64 LYS N N 64 120.824 120.824 119.992 0.832 18802 3552 1 6 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.080 -0.226 18802 3553 1 6 . 1 1 64 64 LYS C C 64 178.707 178.707 179.176 -0.469 18802 3554 1 6 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.613 0.942 18802 3555 1 6 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.352 0.826 18802 3556 1 6 . 1 1 64 64 LYS H H 64 8.130 8.130 7.538 0.592 18802 3557 1 6 . 1 1 65 65 LEU N N 65 118.497 118.497 115.119 3.378 18802 3558 1 6 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.144 -0.175 18802 3559 1 6 . 1 1 65 65 LEU C C 65 179.023 179.023 178.518 0.505 18802 3560 1 6 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.391 -0.110 18802 3561 1 6 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.436 0.954 18802 3562 1 6 . 1 1 65 65 LEU H H 65 8.108 8.108 7.878 0.230 18802 3563 1 6 . 1 1 66 66 ARG N N 66 119.000 119.000 117.810 1.190 18802 3564 1 6 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.166 0.048 18802 3565 1 6 . 1 1 66 66 ARG C C 66 178.064 178.064 178.401 -0.337 18802 3566 1 6 . 1 1 66 66 ARG CA C 66 58.224 58.224 58.490 -0.266 18802 3567 1 6 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.863 -0.240 18802 3568 1 6 . 1 1 66 66 ARG H H 66 8.102 8.102 8.045 0.057 18802 3569 1 6 . 1 1 67 67 THR N N 67 109.849 109.849 108.691 1.158 18802 3570 1 6 . 1 1 67 67 THR HA H 67 4.313 4.313 4.421 -0.108 18802 3571 1 6 . 1 1 67 67 THR C C 67 175.834 175.834 176.235 -0.401 18802 3572 1 6 . 1 1 67 67 THR CA C 67 62.681 62.681 62.378 0.303 18802 3573 1 6 . 1 1 67 67 THR CB C 67 70.768 70.768 70.354 0.414 18802 3574 1 6 . 1 1 67 67 THR H H 67 7.956 7.956 8.061 -0.105 18802 3575 1 6 . 1 1 68 68 GLY N N 68 110.673 110.673 111.049 -0.376 18802 3576 1 6 . 1 1 68 68 GLY C C 68 173.968 173.968 173.692 0.276 18802 3577 1 6 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.110 0.920 18802 3578 1 6 . 1 1 68 68 GLY H H 68 8.016 8.016 8.198 -0.182 18802 3579 1 6 . 1 1 69 69 ASP N N 69 121.490 121.490 121.008 0.482 18802 3580 1 6 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.746 -0.091 18802 3581 1 6 . 1 1 69 69 ASP C C 69 175.983 175.983 176.240 -0.257 18802 3582 1 6 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.713 0.142 18802 3583 1 6 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.618 0.028 18802 3584 1 6 . 1 1 69 69 ASP H H 69 8.048 8.048 7.721 0.327 18802 3585 1 6 . 1 1 70 70 LEU N N 70 120.838 120.838 125.890 -5.052 18802 3586 1 6 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.570 -0.431 18802 3587 1 6 . 1 1 70 70 LEU C C 70 177.530 177.530 178.418 -0.888 18802 3588 1 6 . 1 1 70 70 LEU CA C 70 55.280 55.280 54.992 0.287 18802 3589 1 6 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.790 -0.654 18802 3590 1 6 . 1 1 70 70 LEU H H 70 7.988 7.988 7.986 0.002 18802 3591 1 6 . 1 1 71 71 GLY N N 71 108.059 108.059 107.903 0.156 18802 3592 1 6 . 1 1 71 71 GLY C C 71 173.936 173.936 174.603 -0.667 18802 3593 1 6 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.647 -0.089 18802 3594 1 6 . 1 1 71 71 GLY H H 71 8.341 8.341 8.350 -0.009 18802 3595 1 6 . 1 1 72 72 ILE N N 72 121.037 121.037 122.668 -1.631 18802 3596 1 6 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.392 0.002 18802 3597 1 6 . 1 1 72 72 ILE C C 72 174.227 174.227 175.221 -0.994 18802 3598 1 6 . 1 1 72 72 ILE CA C 72 58.539 58.539 57.640 0.899 18802 3599 1 6 . 1 1 72 72 ILE CB C 72 38.810 38.810 38.552 0.258 18802 3600 1 6 . 1 1 72 72 ILE H H 72 7.793 7.793 7.952 -0.159 18802 3601 1 6 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.796 -0.174 18802 3602 1 6 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.722 -0.082 18802 3603 1 6 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.405 -0.301 18802 3604 1 6 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.622 -0.250 18802 3605 1 6 . 1 1 74 74 PRO C C 74 176.423 176.423 176.019 0.404 18802 3606 1 6 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.691 0.351 18802 3607 1 6 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.496 -0.466 18802 3608 1 6 . 1 1 75 75 ASN N N 75 119.550 119.550 120.027 -0.477 18802 3609 1 6 . 1 1 75 75 ASN HA H 75 4.929 4.929 5.001 -0.072 18802 3610 1 6 . 1 1 75 75 ASN C C 75 174.066 174.066 175.377 -1.311 18802 3611 1 6 . 1 1 75 75 ASN CA C 75 51.151 51.151 51.288 -0.137 18802 3612 1 6 . 1 1 75 75 ASN CB C 75 38.924 38.924 38.953 -0.029 18802 3613 1 6 . 1 1 75 75 ASN H H 75 8.422 8.422 8.425 -0.003 18802 3614 1 6 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.367 -0.074 18802 3615 1 6 . 1 1 76 76 PRO C C 76 177.322 177.322 177.989 -0.667 18802 3616 1 6 . 1 1 76 76 PRO CA C 76 64.384 64.384 64.819 -0.435 18802 3617 1 6 . 1 1 76 76 PRO CB C 76 32.236 32.236 32.039 0.197 18802 3618 1 6 . 1 1 77 77 GLU N N 77 118.523 118.523 117.710 0.813 18802 3619 1 6 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.125 0.051 18802 3620 1 6 . 1 1 77 77 GLU C C 77 176.403 176.403 178.328 -1.925 18802 3621 1 6 . 1 1 77 77 GLU CA C 77 56.977 56.977 58.525 -1.548 18802 3622 1 6 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.397 1.463 18802 3623 1 6 . 1 1 77 77 GLU H H 77 8.426 8.426 8.749 -0.323 18802 3624 1 6 . 1 1 78 78 ASP N N 78 120.581 120.581 118.744 1.837 18802 3625 1 6 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.522 0.021 18802 3626 1 6 . 1 1 78 78 ASP C C 78 176.085 176.085 176.420 -0.335 18802 3627 1 6 . 1 1 78 78 ASP CA C 78 54.544 54.544 54.596 -0.052 18802 3628 1 6 . 1 1 78 78 ASP CB C 78 41.239 41.239 40.803 0.436 18802 3629 1 6 . 1 1 78 78 ASP H H 78 7.941 7.941 7.694 0.247 18802 3630 1 6 . 1 1 79 79 ARG N N 79 121.043 121.043 117.966 3.077 18802 3631 1 6 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.230 0.095 18802 3632 1 6 . 1 1 79 79 ARG C C 79 176.123 176.123 176.892 -0.769 18802 3633 1 6 . 1 1 79 79 ARG CA C 79 55.927 55.927 56.117 -0.190 18802 3634 1 6 . 1 1 79 79 ARG CB C 79 30.650 30.650 29.151 1.499 18802 3635 1 6 . 1 1 79 79 ARG H H 79 8.066 8.066 7.422 0.644 18802 3636 1 6 . 1 1 80 80 SER N N 80 118.338 118.338 119.139 -0.801 18802 3637 1 6 . 1 1 80 80 SER HA H 80 4.672 4.672 4.704 -0.032 18802 3638 1 6 . 1 1 80 80 SER C C 80 172.577 172.577 172.659 -0.082 18802 3639 1 6 . 1 1 80 80 SER CA C 80 56.564 56.564 56.778 -0.214 18802 3640 1 6 . 1 1 80 80 SER CB C 80 63.415 63.415 62.946 0.469 18802 3641 1 6 . 1 1 80 80 SER H H 80 8.281 8.281 7.700 0.581 18802 3642 1 6 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.405 0.015 18802 3643 1 6 . 1 1 81 81 PRO C C 81 176.727 176.727 176.382 0.345 18802 3644 1 6 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.481 -0.218 18802 3645 1 6 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.176 -0.124 18802 3646 1 6 . 1 1 82 82 SER N N 82 117.341 117.341 119.987 -2.646 18802 3647 1 6 . 1 1 82 82 SER HA H 82 4.693 4.693 4.757 -0.064 18802 3648 1 6 . 1 1 82 82 SER C C 82 172.803 172.803 172.970 -0.167 18802 3649 1 6 . 1 1 82 82 SER CA C 82 56.288 56.288 56.568 -0.280 18802 3650 1 6 . 1 1 82 82 SER CB C 82 63.500 63.500 63.181 0.319 18802 3651 1 6 . 1 1 82 82 SER H H 82 8.280 8.280 8.277 0.003 18802 3652 1 6 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.480 -0.169 18802 3653 1 6 . 1 1 83 83 PRO C C 83 176.273 176.273 176.051 0.222 18802 3654 1 6 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.842 0.273 18802 3655 1 6 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.323 -0.224 18802 3656 1 6 . 1 1 84 84 GLU N N 84 122.213 122.213 122.293 -0.080 18802 3657 1 6 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.323 0.170 18802 3658 1 6 . 1 1 84 84 GLU C C 84 174.546 174.546 175.450 -0.904 18802 3659 1 6 . 1 1 84 84 GLU CA C 84 54.529 54.529 55.184 -0.655 18802 3660 1 6 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.485 0.453 18802 3661 1 6 . 1 1 84 84 GLU H H 84 8.230 8.230 8.449 -0.219 18802 3662 1 6 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.291 0.124 18802 3663 1 6 . 1 1 85 85 PRO C C 85 176.024 176.024 175.581 0.443 18802 3664 1 6 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.850 0.392 18802 3665 1 6 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.110 0.079 18802 3666 1 6 . 1 1 86 86 ILE N N 86 120.281 120.281 119.661 0.620 18802 3667 1 6 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.161 -0.099 18802 3668 1 6 . 1 1 86 86 ILE C C 86 175.419 175.419 176.323 -0.904 18802 3669 1 6 . 1 1 86 86 ILE CA C 86 61.029 61.029 60.748 0.281 18802 3670 1 6 . 1 1 86 86 ILE CB C 86 39.258 39.258 38.620 0.638 18802 3671 1 6 . 1 1 86 86 ILE H H 86 7.980 7.980 8.120 -0.140 18802 3672 1 6 . 1 1 87 87 TYR N N 87 123.089 123.089 124.835 -1.746 18802 3673 1 6 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.305 0.512 18802 3674 1 6 . 1 1 87 87 TYR C C 87 175.920 175.920 176.242 -0.322 18802 3675 1 6 . 1 1 87 87 TYR CA C 87 57.197 57.197 58.802 -1.605 18802 3676 1 6 . 1 1 87 87 TYR CB C 87 40.178 40.178 38.800 1.378 18802 3677 1 6 . 1 1 87 87 TYR H H 87 8.194 8.194 8.423 -0.229 18802 3678 1 6 . 1 1 88 88 ASN N N 88 120.117 120.117 122.148 -2.031 18802 3679 1 6 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.706 0.039 18802 3680 1 6 . 1 1 88 88 ASN C C 88 176.275 176.275 176.733 -0.458 18802 3681 1 6 . 1 1 88 88 ASN CA C 88 52.286 52.286 53.481 -1.196 18802 3682 1 6 . 1 1 88 88 ASN CB C 88 39.082 39.082 39.062 0.020 18802 3683 1 6 . 1 1 88 88 ASN H H 88 8.386 8.386 8.803 -0.417 18802 3684 1 6 . 1 1 89 89 SER N N 89 115.826 115.826 115.455 0.371 18802 3685 1 6 . 1 1 89 89 SER HA H 89 4.248 4.248 4.292 -0.044 18802 3686 1 6 . 1 1 89 89 SER C C 89 175.066 175.066 174.807 0.259 18802 3687 1 6 . 1 1 89 89 SER CA C 89 60.012 60.012 60.759 -0.747 18802 3688 1 6 . 1 1 89 89 SER CB C 89 63.400 63.400 63.103 0.297 18802 3689 1 6 . 1 1 89 89 SER H H 89 8.371 8.371 8.834 -0.463 18802 3690 1 6 . 1 1 90 90 GLU N N 90 121.062 121.062 119.377 1.685 18802 3691 1 6 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.323 -0.045 18802 3692 1 6 . 1 1 90 90 GLU C C 90 176.936 176.936 177.112 -0.176 18802 3693 1 6 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.229 0.552 18802 3694 1 6 . 1 1 90 90 GLU CB C 90 30.063 30.063 28.958 1.105 18802 3695 1 6 . 1 1 90 90 GLU H H 90 8.018 8.018 8.117 -0.099 18802 3696 1 6 . 1 1 91 91 GLY N N 91 108.499 108.499 108.966 -0.467 18802 3697 1 6 . 1 1 91 91 GLY C C 91 174.115 174.115 173.806 0.309 18802 3698 1 6 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.282 0.462 18802 3699 1 6 . 1 1 91 91 GLY H H 91 8.199 8.199 7.848 0.351 18802 3700 1 6 . 1 1 92 92 LYS N N 92 120.638 120.638 120.220 0.418 18802 3701 1 6 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.488 -0.179 18802 3702 1 6 . 1 1 92 92 LYS C C 92 176.453 176.453 175.180 1.273 18802 3703 1 6 . 1 1 92 92 LYS CA C 92 55.856 55.856 54.946 0.910 18802 3704 1 6 . 1 1 92 92 LYS CB C 92 33.109 33.109 34.088 -0.979 18802 3705 1 6 . 1 1 92 92 LYS H H 92 7.956 7.956 7.750 0.206 18802 3706 1 6 . 1 1 93 93 ARG N N 93 122.999 122.999 124.757 -1.758 18802 3707 1 6 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.297 -0.106 18802 3708 1 6 . 1 1 93 93 ARG C C 93 176.325 176.325 175.748 0.577 18802 3709 1 6 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.244 1.138 18802 3710 1 6 . 1 1 93 93 ARG CB C 93 30.656 30.656 30.959 -0.303 18802 3711 1 6 . 1 1 93 93 ARG H H 93 8.403 8.403 8.579 -0.176 18802 3712 1 6 . 1 1 94 94 LEU N N 94 124.100 124.100 125.349 -1.249 18802 3713 1 6 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.567 -0.304 18802 3714 1 6 . 1 1 94 94 LEU C C 94 176.993 176.993 175.190 1.803 18802 3715 1 6 . 1 1 94 94 LEU CA C 94 55.034 55.034 52.855 2.179 18802 3716 1 6 . 1 1 94 94 LEU CB C 94 42.941 42.941 43.541 -0.600 18802 3717 1 6 . 1 1 94 94 LEU H H 94 8.283 8.283 8.017 0.266 18802 3718 1 6 . 1 1 95 95 ASN N N 95 119.593 119.593 117.900 1.693 18802 3719 1 6 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.689 0.058 18802 3720 1 6 . 1 1 95 95 ASN C C 95 175.598 175.598 174.373 1.225 18802 3721 1 6 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.919 -1.239 18802 3722 1 6 . 1 1 95 95 ASN CB C 95 38.723 38.723 39.246 -0.523 18802 3723 1 6 . 1 1 95 95 ASN H H 95 8.460 8.460 8.252 0.208 18802 3724 1 6 . 1 1 96 96 THR N N 96 114.100 114.100 117.808 -3.708 18802 3725 1 6 . 1 1 96 96 THR HA H 96 4.226 4.226 4.467 -0.241 18802 3726 1 6 . 1 1 96 96 THR C C 96 175.186 175.186 176.063 -0.877 18802 3727 1 6 . 1 1 96 96 THR CA C 96 62.203 62.203 64.374 -2.171 18802 3728 1 6 . 1 1 96 96 THR CB C 96 69.880 69.880 69.321 0.559 18802 3729 1 6 . 1 1 96 96 THR H H 96 8.031 8.031 8.646 -0.615 18802 3730 1 6 . 1 1 97 97 ARG N N 97 122.587 122.587 120.235 2.352 18802 3731 1 6 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.088 0.025 18802 3732 1 6 . 1 1 97 97 ARG C C 97 177.938 177.938 178.458 -0.520 18802 3733 1 6 . 1 1 97 97 ARG CA C 97 58.412 58.412 60.590 -2.178 18802 3734 1 6 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.853 0.444 18802 3735 1 6 . 1 1 97 97 ARG H H 97 8.502 8.502 8.534 -0.032 18802 3736 1 6 . 1 1 98 98 GLU N N 98 121.548 121.548 120.464 1.084 18802 3737 1 6 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.145 -0.128 18802 3738 1 6 . 1 1 98 98 GLU C C 98 177.113 177.113 178.975 -1.862 18802 3739 1 6 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.596 -0.916 18802 3740 1 6 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.900 0.766 18802 3741 1 6 . 1 1 98 98 GLU H H 98 8.517 8.517 8.737 -0.220 18802 3742 1 6 . 1 1 99 99 PHE N N 99 121.388 121.388 119.831 1.557 18802 3743 1 6 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.228 0.094 18802 3744 1 6 . 1 1 99 99 PHE C C 99 177.070 177.070 177.171 -0.101 18802 3745 1 6 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.596 -1.521 18802 3746 1 6 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.318 0.168 18802 3747 1 6 . 1 1 99 99 PHE H H 99 8.176 8.176 8.157 0.019 18802 3748 1 6 . 1 1 100 100 ARG N N 100 120.211 120.211 119.187 1.024 18802 3749 1 6 . 1 1 100 100 ARG C C 100 178.159 178.159 179.102 -0.943 18802 3750 1 6 . 1 1 100 100 ARG CA C 100 58.533 58.533 59.024 -0.491 18802 3751 1 6 . 1 1 100 100 ARG CB C 100 30.588 30.588 29.370 1.218 18802 3752 1 6 . 1 1 100 100 ARG H H 100 8.377 8.377 8.857 -0.480 18802 3753 1 6 . 1 1 101 101 THR N N 101 115.416 115.416 116.639 -1.223 18802 3754 1 6 . 1 1 101 101 THR HA H 101 4.022 4.022 3.970 0.052 18802 3755 1 6 . 1 1 101 101 THR C C 101 175.301 175.301 176.515 -1.214 18802 3756 1 6 . 1 1 101 101 THR CA C 101 65.141 65.141 66.903 -1.762 18802 3757 1 6 . 1 1 101 101 THR CB C 101 69.305 69.305 68.507 0.798 18802 3758 1 6 . 1 1 101 101 THR H H 101 7.992 7.992 8.568 -0.576 18802 3759 1 6 . 1 1 102 102 ARG N N 102 122.212 122.212 121.545 0.667 18802 3760 1 6 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.983 0.324 18802 3761 1 6 . 1 1 102 102 ARG C C 102 177.644 177.644 178.276 -0.632 18802 3762 1 6 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.410 1.201 18802 3763 1 6 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.261 -0.453 18802 3764 1 6 . 1 1 102 102 ARG H H 102 8.369 8.369 7.748 0.621 18802 3765 1 6 . 1 1 103 103 LYS N N 103 117.591 117.591 119.576 -1.985 18802 3766 1 6 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.992 -0.032 18802 3767 1 6 . 1 1 103 103 LYS C C 103 178.913 178.913 178.936 -0.023 18802 3768 1 6 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.434 0.616 18802 3769 1 6 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.874 0.267 18802 3770 1 6 . 1 1 103 103 LYS H H 103 7.941 7.941 8.275 -0.334 18802 3771 1 6 . 1 1 104 104 LYS N N 104 119.769 119.769 120.386 -0.617 18802 3772 1 6 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.096 0.050 18802 3773 1 6 . 1 1 104 104 LYS C C 104 179.377 179.377 178.731 0.646 18802 3774 1 6 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.761 0.218 18802 3775 1 6 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.558 0.633 18802 3776 1 6 . 1 1 104 104 LYS H H 104 7.615 7.615 8.042 -0.427 18802 3777 1 6 . 1 1 105 105 LEU N N 105 120.500 120.500 118.812 1.688 18802 3778 1 6 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.943 0.174 18802 3779 1 6 . 1 1 105 105 LEU C C 105 179.481 179.481 179.142 0.339 18802 3780 1 6 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.128 0.133 18802 3781 1 6 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.464 0.540 18802 3782 1 6 . 1 1 105 105 LEU H H 105 8.057 8.057 7.748 0.309 18802 3783 1 6 . 1 1 106 106 GLU N N 106 118.803 118.803 118.627 0.176 18802 3784 1 6 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.998 -0.009 18802 3785 1 6 . 1 1 106 106 GLU C C 106 180.577 180.577 179.202 1.375 18802 3786 1 6 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.719 0.091 18802 3787 1 6 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.305 0.705 18802 3788 1 6 . 1 1 106 106 GLU H H 106 8.652 8.652 7.835 0.817 18802 3789 1 6 . 1 1 107 107 GLU N N 107 122.396 122.396 119.700 2.696 18802 3790 1 6 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.279 -0.173 18802 3791 1 6 . 1 1 107 107 GLU C C 107 178.457 178.457 179.312 -0.855 18802 3792 1 6 . 1 1 107 107 GLU CA C 107 59.826 59.826 59.293 0.533 18802 3793 1 6 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.368 0.194 18802 3794 1 6 . 1 1 107 107 GLU H H 107 8.281 8.281 8.455 -0.174 18802 3795 1 6 . 1 1 108 108 GLU N N 108 120.976 120.976 118.896 2.080 18802 3796 1 6 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.061 0.031 18802 3797 1 6 . 1 1 108 108 GLU C C 108 179.343 179.343 179.001 0.342 18802 3798 1 6 . 1 1 108 108 GLU CA C 108 59.696 59.696 58.939 0.757 18802 3799 1 6 . 1 1 108 108 GLU CB C 108 29.570 29.570 28.960 0.610 18802 3800 1 6 . 1 1 108 108 GLU H H 108 8.321 8.321 8.431 -0.110 18802 3801 1 6 . 1 1 109 109 ARG N N 109 118.559 118.559 120.331 -1.772 18802 3802 1 6 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.925 -0.133 18802 3803 1 6 . 1 1 109 109 ARG C C 109 177.178 177.178 178.170 -0.992 18802 3804 1 6 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.893 0.590 18802 3805 1 6 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.273 -0.124 18802 3806 1 6 . 1 1 109 109 ARG H H 109 8.594 8.594 8.103 0.491 18802 3807 1 6 . 1 1 110 110 HIS N N 110 119.632 119.632 118.391 1.241 18802 3808 1 6 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.134 0.207 18802 3809 1 6 . 1 1 110 110 HIS C C 110 177.578 177.578 177.410 0.168 18802 3810 1 6 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.543 1.074 18802 3811 1 6 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.264 0.245 18802 3812 1 6 . 1 1 110 110 HIS H H 110 8.465 8.465 8.559 -0.094 18802 3813 1 6 . 1 1 111 111 ASN N N 111 119.587 119.587 118.734 0.853 18802 3814 1 6 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.260 0.018 18802 3815 1 6 . 1 1 111 111 ASN C C 111 178.630 178.630 177.865 0.765 18802 3816 1 6 . 1 1 111 111 ASN CA C 111 56.281 56.281 55.866 0.415 18802 3817 1 6 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.131 -0.436 18802 3818 1 6 . 1 1 111 111 ASN H H 111 8.323 8.323 8.505 -0.182 18802 3819 1 6 . 1 1 112 112 LEU N N 112 122.320 122.320 120.384 1.936 18802 3820 1 6 . 1 1 112 112 LEU HA H 112 4.116 4.116 3.990 0.126 18802 3821 1 6 . 1 1 112 112 LEU C C 112 178.539 178.539 178.773 -0.234 18802 3822 1 6 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.712 0.266 18802 3823 1 6 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.743 0.851 18802 3824 1 6 . 1 1 112 112 LEU H H 112 7.966 7.966 8.063 -0.097 18802 3825 1 6 . 1 1 113 113 ILE N N 113 121.495 121.495 120.556 0.939 18802 3826 1 6 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.686 -0.450 18802 3827 1 6 . 1 1 113 113 ILE C C 113 176.959 176.959 178.391 -1.432 18802 3828 1 6 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.715 1.339 18802 3829 1 6 . 1 1 113 113 ILE CB C 113 37.603 37.603 35.972 1.631 18802 3830 1 6 . 1 1 113 113 ILE H H 113 8.472 8.472 8.568 -0.096 18802 3831 1 6 . 1 1 114 114 THR N N 114 115.066 115.066 115.288 -0.222 18802 3832 1 6 . 1 1 114 114 THR HA H 114 3.718 3.718 4.005 -0.287 18802 3833 1 6 . 1 1 114 114 THR C C 114 176.559 176.559 176.764 -0.205 18802 3834 1 6 . 1 1 114 114 THR CA C 114 66.700 66.700 67.167 -0.467 18802 3835 1 6 . 1 1 114 114 THR CB C 114 68.759 68.759 68.129 0.630 18802 3836 1 6 . 1 1 114 114 THR H H 114 8.075 8.075 8.133 -0.058 18802 3837 1 6 . 1 1 115 115 GLU N N 115 123.259 123.259 121.964 1.295 18802 3838 1 6 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.057 -0.125 18802 3839 1 6 . 1 1 115 115 GLU C C 115 178.191 178.191 178.680 -0.489 18802 3840 1 6 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.195 0.145 18802 3841 1 6 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.496 -0.097 18802 3842 1 6 . 1 1 115 115 GLU H H 115 7.368 7.368 7.463 -0.095 18802 3843 1 6 . 1 1 116 116 MET N N 116 119.844 119.844 119.910 -0.066 18802 3844 1 6 . 1 1 116 116 MET HA H 116 4.014 4.014 3.932 0.082 18802 3845 1 6 . 1 1 116 116 MET C C 116 177.888 177.888 178.163 -0.275 18802 3846 1 6 . 1 1 116 116 MET CA C 116 57.183 57.183 57.170 0.013 18802 3847 1 6 . 1 1 116 116 MET CB C 116 32.126 32.126 31.533 0.593 18802 3848 1 6 . 1 1 116 116 MET H H 116 8.373 8.373 8.388 -0.015 18802 3849 1 6 . 1 1 117 117 VAL N N 117 117.572 117.572 118.811 -1.239 18802 3850 1 6 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.120 -0.224 18802 3851 1 6 . 1 1 117 117 VAL C C 117 177.567 177.567 178.191 -0.624 18802 3852 1 6 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.515 -1.645 18802 3853 1 6 . 1 1 117 117 VAL CB C 117 32.002 32.002 30.945 1.057 18802 3854 1 6 . 1 1 117 117 VAL H H 117 8.279 8.279 8.553 -0.274 18802 3855 1 6 . 1 1 118 118 ALA N N 118 120.560 120.560 121.069 -0.509 18802 3856 1 6 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.179 -0.043 18802 3857 1 6 . 1 1 118 118 ALA C C 118 179.595 179.595 179.428 0.167 18802 3858 1 6 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.585 -0.482 18802 3859 1 6 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.791 -0.541 18802 3860 1 6 . 1 1 118 118 ALA H H 118 7.074 7.074 7.337 -0.263 18802 3861 1 6 . 1 1 119 119 LEU N N 119 117.987 117.987 117.077 0.910 18802 3862 1 6 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.252 -0.112 18802 3863 1 6 . 1 1 119 119 LEU C C 119 177.863 177.863 176.865 0.998 18802 3864 1 6 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.281 0.391 18802 3865 1 6 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.866 0.368 18802 3866 1 6 . 1 1 119 119 LEU H H 119 7.525 7.525 7.700 -0.175 18802 3867 1 6 . 1 1 120 120 ASN N N 120 115.338 115.338 116.046 -0.708 18802 3868 1 6 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.108 -0.090 18802 3869 1 6 . 1 1 120 120 ASN C C 120 172.510 172.510 173.741 -1.231 18802 3870 1 6 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.368 -0.267 18802 3871 1 6 . 1 1 120 120 ASN CB C 120 39.305 39.305 41.088 -1.783 18802 3872 1 6 . 1 1 120 120 ASN H H 120 8.467 8.467 8.005 0.462 18802 3873 1 6 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.532 0.124 18802 3874 1 6 . 1 1 121 121 PRO C C 121 177.020 177.020 176.764 0.256 18802 3875 1 6 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.007 0.290 18802 3876 1 6 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.334 -0.035 18802 3877 1 6 . 1 1 122 122 ASP N N 122 115.744 115.744 118.748 -3.004 18802 3878 1 6 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.712 -0.043 18802 3879 1 6 . 1 1 122 122 ASP C C 122 176.004 176.004 175.502 0.502 18802 3880 1 6 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.542 0.824 18802 3881 1 6 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.443 -0.118 18802 3882 1 6 . 1 1 122 122 ASP H H 122 7.600 7.600 8.591 -0.991 18802 3883 1 6 . 1 1 123 123 PHE N N 123 122.722 122.722 121.231 1.491 18802 3884 1 6 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.460 -0.325 18802 3885 1 6 . 1 1 123 123 PHE C C 123 173.954 173.954 174.677 -0.723 18802 3886 1 6 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.314 0.679 18802 3887 1 6 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.577 0.019 18802 3888 1 6 . 1 1 123 123 PHE H H 123 7.940 7.940 7.391 0.549 18802 3889 1 6 . 1 1 124 124 LYS N N 124 129.400 129.400 129.751 -0.351 18802 3890 1 6 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.442 0.117 18802 3891 1 6 . 1 1 124 124 LYS C C 124 172.622 172.622 173.968 -1.346 18802 3892 1 6 . 1 1 124 124 LYS CA C 124 51.815 51.815 52.735 -0.920 18802 3893 1 6 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.860 0.721 18802 3894 1 6 . 1 1 124 124 LYS H H 124 7.602 7.602 8.363 -0.761 18802 3895 1 6 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.023 0.066 18802 3896 1 6 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.138 -0.142 18802 3897 1 6 . 1 1 125 125 PRO CB C 125 31.067 31.067 30.988 0.079 18802 3898 1 6 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.411 -0.037 18802 3899 1 6 . 1 1 126 126 PRO C C 126 177.630 177.630 177.718 -0.088 18802 3900 1 6 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.538 0.275 18802 3901 1 6 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.302 0.019 18802 3902 1 6 . 1 1 127 127 ALA N N 127 123.830 123.830 124.124 -0.294 18802 3903 1 6 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.091 -0.033 18802 3904 1 6 . 1 1 127 127 ALA C C 127 177.641 177.641 178.848 -1.207 18802 3905 1 6 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.462 0.140 18802 3906 1 6 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.657 0.192 18802 3907 1 6 . 1 1 127 127 ALA H H 127 8.630 8.630 8.701 -0.071 18802 3908 1 6 . 1 1 128 128 ASP N N 128 112.924 112.924 116.422 -3.498 18802 3909 1 6 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.559 -0.108 18802 3910 1 6 . 1 1 128 128 ASP C C 128 175.724 175.724 176.030 -0.306 18802 3911 1 6 . 1 1 128 128 ASP CA C 128 53.604 53.604 55.553 -1.949 18802 3912 1 6 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.753 -0.335 18802 3913 1 6 . 1 1 128 128 ASP H H 128 8.335 8.335 8.673 -0.338 18802 3914 1 6 . 1 1 129 129 TYR N N 129 121.114 121.114 122.538 -1.424 18802 3915 1 6 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.367 -0.005 18802 3916 1 6 . 1 1 129 129 TYR C C 129 174.190 174.190 174.535 -0.345 18802 3917 1 6 . 1 1 129 129 TYR CA C 129 58.412 58.412 58.962 -0.550 18802 3918 1 6 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.477 0.582 18802 3919 1 6 . 1 1 129 129 TYR H H 129 7.600 7.600 7.601 -0.001 18802 3920 1 6 . 1 1 130 130 LYS N N 130 129.875 129.875 128.967 0.908 18802 3921 1 6 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.505 -0.187 18802 3922 1 6 . 1 1 130 130 LYS C C 130 172.314 172.314 174.037 -1.723 18802 3923 1 6 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.746 0.824 18802 3924 1 6 . 1 1 130 130 LYS CB C 130 33.663 33.663 33.281 0.382 18802 3925 1 6 . 1 1 130 130 LYS H H 130 7.695 7.695 8.328 -0.633 18802 3926 1 6 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.163 0.114 18802 3927 1 6 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.363 -0.305 18802 3928 1 6 . 1 1 131 131 PRO CB C 131 30.852 30.852 31.021 -0.169 18802 3929 1 6 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.230 0.014 18802 3930 1 6 . 1 1 132 132 PRO C C 132 176.459 176.459 176.906 -0.447 18802 3931 1 6 . 1 1 132 132 PRO CA C 132 62.874 62.874 62.835 0.039 18802 3932 1 6 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.057 -0.010 18802 3933 1 6 . 1 1 133 133 ALA N N 133 124.170 124.170 126.260 -2.090 18802 3934 1 6 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.356 -0.106 18802 3935 1 6 . 1 1 133 133 ALA C C 133 177.870 177.870 177.423 0.447 18802 3936 1 6 . 1 1 133 133 ALA CA C 133 52.508 52.508 52.534 -0.026 18802 3937 1 6 . 1 1 133 133 ALA CB C 133 19.303 19.303 18.986 0.317 18802 3938 1 6 . 1 1 133 133 ALA H H 133 8.311 8.311 8.269 0.042 18802 3939 1 6 . 1 1 134 134 THR N N 134 113.807 113.807 113.927 -0.120 18802 3940 1 6 . 1 1 134 134 THR HA H 134 4.228 4.228 4.374 -0.146 18802 3941 1 6 . 1 1 134 134 THR C C 134 174.282 174.282 173.932 0.350 18802 3942 1 6 . 1 1 134 134 THR CA C 134 62.127 62.127 61.614 0.513 18802 3943 1 6 . 1 1 134 134 THR CB C 134 69.870 69.870 68.288 1.582 18802 3944 1 6 . 1 1 134 134 THR H H 134 8.019 8.019 7.658 0.361 18802 3945 1 6 . 1 1 135 135 ARG N N 135 124.165 124.165 128.066 -3.901 18802 3946 1 6 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.549 -0.200 18802 3947 1 6 . 1 1 135 135 ARG C C 135 176.217 176.217 175.910 0.307 18802 3948 1 6 . 1 1 135 135 ARG CA C 135 55.993 55.993 55.100 0.893 18802 3949 1 6 . 1 1 135 135 ARG CB C 135 30.992 30.992 30.920 0.072 18802 3950 1 6 . 1 1 135 135 ARG H H 135 8.300 8.300 8.406 -0.106 18802 3951 1 6 . 1 1 136 136 VAL N N 136 122.157 122.157 122.909 -0.752 18802 3952 1 6 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.170 -0.100 18802 3953 1 6 . 1 1 136 136 VAL C C 136 176.180 176.180 175.881 0.299 18802 3954 1 6 . 1 1 136 136 VAL CA C 136 61.937 61.937 62.268 -0.331 18802 3955 1 6 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.362 0.385 18802 3956 1 6 . 1 1 136 136 VAL H H 136 8.233 8.233 8.416 -0.183 18802 3957 1 6 . 1 1 137 137 SER N N 137 118.837 118.837 122.032 -3.195 18802 3958 1 6 . 1 1 137 137 SER HA H 137 4.416 4.416 4.372 0.044 18802 3959 1 6 . 1 1 137 137 SER C C 137 174.258 174.258 174.316 -0.058 18802 3960 1 6 . 1 1 137 137 SER CA C 137 58.341 58.341 58.962 -0.622 18802 3961 1 6 . 1 1 137 137 SER CB C 137 63.900 63.900 64.440 -0.540 18802 3962 1 6 . 1 1 137 137 SER H H 137 8.264 8.264 8.523 -0.259 18802 3963 1 6 . 1 1 138 138 ASP N N 138 122.871 122.871 122.983 -0.112 18802 3964 1 6 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.437 0.100 18802 3965 1 6 . 1 1 138 138 ASP C C 138 176.053 176.053 177.613 -1.560 18802 3966 1 6 . 1 1 138 138 ASP CA C 138 54.489 54.489 56.521 -2.032 18802 3967 1 6 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.176 -0.028 18802 3968 1 6 . 1 1 138 138 ASP H H 138 8.249 8.249 8.530 -0.281 18802 3969 1 6 . 1 1 139 139 LYS N N 139 120.944 120.944 119.151 1.793 18802 3970 1 6 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.211 0.049 18802 3971 1 6 . 1 1 139 139 LYS C C 139 176.343 176.343 176.290 0.053 18802 3972 1 6 . 1 1 139 139 LYS CA C 139 56.261 56.261 57.532 -1.272 18802 3973 1 6 . 1 1 139 139 LYS CB C 139 33.077 33.077 32.633 0.444 18802 3974 1 6 . 1 1 139 139 LYS H H 139 8.084 8.084 8.145 -0.061 18802 3975 1 6 . 1 1 140 140 VAL N N 140 121.670 121.670 114.577 7.093 18802 3976 1 6 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.254 -0.242 18802 3977 1 6 . 1 1 140 140 VAL C C 140 175.842 175.842 174.809 1.033 18802 3978 1 6 . 1 1 140 140 VAL CA C 140 62.442 62.442 60.920 1.522 18802 3979 1 6 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.474 0.393 18802 3980 1 6 . 1 1 140 140 VAL H H 140 8.025 8.025 7.577 0.448 18802 3981 1 6 . 1 1 141 141 MET N N 141 124.839 124.839 126.071 -1.232 18802 3982 1 6 . 1 1 141 141 MET HA H 141 4.453 4.453 4.589 -0.136 18802 3983 1 6 . 1 1 141 141 MET C C 141 175.562 175.562 175.755 -0.193 18802 3984 1 6 . 1 1 141 141 MET CA C 141 55.349 55.349 55.032 0.317 18802 3985 1 6 . 1 1 141 141 MET CB C 141 32.993 32.993 33.214 -0.221 18802 3986 1 6 . 1 1 141 141 MET H H 141 8.364 8.364 8.496 -0.132 18802 3987 1 6 . 1 1 142 142 ILE N N 142 124.515 124.515 127.668 -3.153 18802 3988 1 6 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.446 -0.018 18802 3989 1 6 . 1 1 142 142 ILE C C 142 174.331 174.331 174.789 -0.458 18802 3990 1 6 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.640 -0.236 18802 3991 1 6 . 1 1 142 142 ILE CB C 142 38.755 38.755 38.508 0.247 18802 3992 1 6 . 1 1 142 142 ILE H H 142 8.093 8.093 8.414 -0.321 18802 3993 1 6 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.496 -0.146 18802 3994 1 6 . 1 1 143 143 PRO C C 143 176.623 176.623 175.832 0.791 18802 3995 1 6 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.481 0.934 18802 3996 1 6 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.439 -0.206 18802 3997 1 6 . 1 1 144 144 GLN N N 144 121.557 121.557 120.789 0.768 18802 3998 1 6 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.387 -0.081 18802 3999 1 6 . 1 1 144 144 GLN C C 144 174.751 174.751 175.786 -1.035 18802 4000 1 6 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.762 -0.091 18802 4001 1 6 . 1 1 144 144 GLN CB C 144 30.118 30.118 28.806 1.312 18802 4002 1 6 . 1 1 144 144 GLN H H 144 8.392 8.392 8.491 -0.099 18802 4003 1 7 . 1 1 26 26 ALA N N 26 124.085 124.085 123.599 0.486 18802 4004 1 7 . 1 1 26 26 ALA HA H 26 4.292 4.292 3.926 0.366 18802 4005 1 7 . 1 1 26 26 ALA C C 26 177.101 177.101 177.530 -0.429 18802 4006 1 7 . 1 1 26 26 ALA CA C 26 52.921 52.921 54.583 -1.662 18802 4007 1 7 . 1 1 26 26 ALA CB C 26 19.426 19.426 17.176 2.250 18802 4008 1 7 . 1 1 26 26 ALA H H 26 8.498 8.498 8.286 0.212 18802 4009 1 7 . 1 1 27 27 MET N N 27 119.630 119.630 115.843 3.787 18802 4010 1 7 . 1 1 27 27 MET HA H 27 4.391 4.391 4.548 -0.157 18802 4011 1 7 . 1 1 27 27 MET C C 27 176.296 176.296 176.357 -0.061 18802 4012 1 7 . 1 1 27 27 MET CA C 27 55.834 55.834 55.888 -0.054 18802 4013 1 7 . 1 1 27 27 MET CB C 27 32.663 32.663 32.881 -0.218 18802 4014 1 7 . 1 1 27 27 MET H H 27 8.441 8.441 8.037 0.404 18802 4015 1 7 . 1 1 28 28 GLU N N 28 122.376 122.376 120.638 1.738 18802 4016 1 7 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.188 0.026 18802 4017 1 7 . 1 1 28 28 GLU C C 28 176.310 176.310 177.243 -0.933 18802 4018 1 7 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.969 -0.150 18802 4019 1 7 . 1 1 28 28 GLU CB C 28 30.252 30.252 30.013 0.239 18802 4020 1 7 . 1 1 28 28 GLU H H 28 8.336 8.336 7.798 0.538 18802 4021 1 7 . 1 1 29 29 GLN N N 29 122.010 122.010 116.527 5.483 18802 4022 1 7 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.061 0.230 18802 4023 1 7 . 1 1 29 29 GLN C C 29 175.765 175.765 174.605 1.160 18802 4024 1 7 . 1 1 29 29 GLN CA C 29 55.839 55.839 56.072 -0.233 18802 4025 1 7 . 1 1 29 29 GLN CB C 29 29.559 29.559 28.876 0.683 18802 4026 1 7 . 1 1 29 29 GLN H H 29 8.347 8.347 8.222 0.125 18802 4027 1 7 . 1 1 30 30 LYS N N 30 123.090 123.090 121.618 1.472 18802 4028 1 7 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.416 -0.080 18802 4029 1 7 . 1 1 30 30 LYS C C 30 176.474 176.474 176.079 0.395 18802 4030 1 7 . 1 1 30 30 LYS CA C 30 56.391 56.391 55.492 0.899 18802 4031 1 7 . 1 1 30 30 LYS CB C 30 32.993 32.993 33.122 -0.129 18802 4032 1 7 . 1 1 30 30 LYS H H 30 8.327 8.327 8.330 -0.003 18802 4033 1 7 . 1 1 31 31 THR N N 31 116.800 116.800 119.309 -2.509 18802 4034 1 7 . 1 1 31 31 THR HA H 31 4.273 4.273 4.194 0.079 18802 4035 1 7 . 1 1 31 31 THR C C 31 174.071 174.071 174.402 -0.331 18802 4036 1 7 . 1 1 31 31 THR CA C 31 62.103 62.103 62.933 -0.830 18802 4037 1 7 . 1 1 31 31 THR CB C 31 69.899 69.899 69.456 0.443 18802 4038 1 7 . 1 1 31 31 THR H H 31 8.160 8.160 8.346 -0.186 18802 4039 1 7 . 1 1 32 32 VAL N N 32 124.108 124.108 125.113 -1.005 18802 4040 1 7 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.049 0.017 18802 4041 1 7 . 1 1 32 32 VAL C C 32 175.573 175.573 175.209 0.364 18802 4042 1 7 . 1 1 32 32 VAL CA C 32 62.344 62.344 62.313 0.031 18802 4043 1 7 . 1 1 32 32 VAL CB C 32 32.912 32.912 32.533 0.379 18802 4044 1 7 . 1 1 32 32 VAL H H 32 8.192 8.192 8.276 -0.084 18802 4045 1 7 . 1 1 33 33 ILE N N 33 127.371 127.371 130.379 -3.008 18802 4046 1 7 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.499 -0.075 18802 4047 1 7 . 1 1 33 33 ILE C C 33 174.335 174.335 174.681 -0.346 18802 4048 1 7 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.020 1.374 18802 4049 1 7 . 1 1 33 33 ILE CB C 33 38.799 38.799 37.586 1.213 18802 4050 1 7 . 1 1 33 33 ILE H H 33 8.275 8.275 8.325 -0.050 18802 4051 1 7 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.451 -0.148 18802 4052 1 7 . 1 1 34 34 PRO C C 34 177.261 177.261 177.371 -0.110 18802 4053 1 7 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.598 0.074 18802 4054 1 7 . 1 1 34 34 PRO CB C 34 32.177 32.177 31.909 0.268 18802 4055 1 7 . 1 1 35 35 GLY N N 35 109.540 109.540 111.643 -2.103 18802 4056 1 7 . 1 1 35 35 GLY C C 35 173.906 173.906 174.350 -0.444 18802 4057 1 7 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.895 0.375 18802 4058 1 7 . 1 1 35 35 GLY H H 35 8.376 8.376 8.664 -0.288 18802 4059 1 7 . 1 1 36 36 MET N N 36 120.834 120.834 122.234 -1.400 18802 4060 1 7 . 1 1 36 36 MET HA H 36 4.780 4.780 4.879 -0.099 18802 4061 1 7 . 1 1 36 36 MET C C 36 174.235 174.235 173.906 0.329 18802 4062 1 7 . 1 1 36 36 MET CA C 36 53.258 53.258 52.290 0.968 18802 4063 1 7 . 1 1 36 36 MET CB C 36 32.734 32.734 32.900 -0.166 18802 4064 1 7 . 1 1 36 36 MET H H 36 7.986 7.986 7.644 0.342 18802 4065 1 7 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.671 -0.209 18802 4066 1 7 . 1 1 37 37 PRO C C 37 176.736 176.736 176.521 0.215 18802 4067 1 7 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.220 1.038 18802 4068 1 7 . 1 1 37 37 PRO CB C 37 32.200 32.200 32.802 -0.602 18802 4069 1 7 . 1 1 38 38 THR N N 38 115.642 115.642 117.963 -2.321 18802 4070 1 7 . 1 1 38 38 THR HA H 38 4.226 4.226 4.579 -0.353 18802 4071 1 7 . 1 1 38 38 THR C C 38 174.164 174.164 174.589 -0.425 18802 4072 1 7 . 1 1 38 38 THR CA C 38 62.462 62.462 62.275 0.187 18802 4073 1 7 . 1 1 38 38 THR CB C 38 69.874 69.874 69.326 0.548 18802 4074 1 7 . 1 1 38 38 THR H H 38 8.189 8.189 8.316 -0.127 18802 4075 1 7 . 1 1 39 39 VAL N N 39 123.700 123.700 125.101 -1.401 18802 4076 1 7 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.570 -0.491 18802 4077 1 7 . 1 1 39 39 VAL C C 39 175.177 175.177 174.792 0.385 18802 4078 1 7 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.752 0.239 18802 4079 1 7 . 1 1 39 39 VAL CB C 39 32.898 32.898 32.501 0.397 18802 4080 1 7 . 1 1 39 39 VAL H H 39 8.036 8.036 8.362 -0.326 18802 4081 1 7 . 1 1 40 40 ILE N N 40 127.780 127.780 127.727 0.053 18802 4082 1 7 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.483 -0.306 18802 4083 1 7 . 1 1 40 40 ILE C C 40 173.894 173.894 174.913 -1.019 18802 4084 1 7 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.038 -1.127 18802 4085 1 7 . 1 1 40 40 ILE CB C 40 38.633 38.633 38.757 -0.124 18802 4086 1 7 . 1 1 40 40 ILE H H 40 8.236 8.236 8.335 -0.099 18802 4087 1 7 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.763 -0.272 18802 4088 1 7 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.189 0.435 18802 4089 1 7 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.101 0.001 18802 4090 1 7 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.467 -0.212 18802 4091 1 7 . 1 1 42 42 PRO C C 42 177.721 177.721 178.137 -0.416 18802 4092 1 7 . 1 1 42 42 PRO CA C 42 62.800 62.800 62.797 0.003 18802 4093 1 7 . 1 1 42 42 PRO CB C 42 32.355 32.355 32.094 0.261 18802 4094 1 7 . 1 1 43 43 GLY N N 43 107.305 107.305 108.273 -0.968 18802 4095 1 7 . 1 1 43 43 GLY C C 43 174.642 174.642 174.111 0.531 18802 4096 1 7 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.780 0.938 18802 4097 1 7 . 1 1 43 43 GLY H H 43 8.321 8.321 8.598 -0.277 18802 4098 1 7 . 1 1 44 44 LEU N N 44 120.897 120.897 122.126 -1.229 18802 4099 1 7 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.487 0.042 18802 4100 1 7 . 1 1 44 44 LEU C C 44 178.580 178.580 176.603 1.977 18802 4101 1 7 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.365 0.184 18802 4102 1 7 . 1 1 44 44 LEU CB C 44 42.579 42.579 42.905 -0.326 18802 4103 1 7 . 1 1 44 44 LEU H H 44 8.043 8.043 7.712 0.331 18802 4104 1 7 . 1 1 45 45 THR N N 45 113.195 113.195 113.154 0.041 18802 4105 1 7 . 1 1 45 45 THR HA H 45 4.386 4.386 4.476 -0.090 18802 4106 1 7 . 1 1 45 45 THR C C 45 175.377 175.377 175.621 -0.244 18802 4107 1 7 . 1 1 45 45 THR CA C 45 61.188 61.188 60.322 0.866 18802 4108 1 7 . 1 1 45 45 THR CB C 45 71.043 71.043 70.796 0.247 18802 4109 1 7 . 1 1 45 45 THR H H 45 8.427 8.427 8.071 0.356 18802 4110 1 7 . 1 1 46 46 ARG N N 46 121.322 121.322 123.110 -1.788 18802 4111 1 7 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.340 -0.303 18802 4112 1 7 . 1 1 46 46 ARG C C 46 179.309 179.309 178.160 1.149 18802 4113 1 7 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.095 0.289 18802 4114 1 7 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.241 0.575 18802 4115 1 7 . 1 1 46 46 ARG H H 46 8.832 8.832 8.927 -0.095 18802 4116 1 7 . 1 1 47 47 GLU N N 47 119.109 119.109 119.299 -0.190 18802 4117 1 7 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.103 -0.094 18802 4118 1 7 . 1 1 47 47 GLU C C 47 178.931 178.931 179.010 -0.079 18802 4119 1 7 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.809 0.467 18802 4120 1 7 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.514 0.777 18802 4121 1 7 . 1 1 47 47 GLU H H 47 8.754 8.754 8.678 0.076 18802 4122 1 7 . 1 1 48 48 GLN N N 48 119.556 119.556 120.003 -0.447 18802 4123 1 7 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.034 0.032 18802 4124 1 7 . 1 1 48 48 GLN C C 48 179.286 179.286 178.244 1.042 18802 4125 1 7 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.787 -0.572 18802 4126 1 7 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.342 1.325 18802 4127 1 7 . 1 1 48 48 GLN H H 48 7.711 7.711 7.689 0.022 18802 4128 1 7 . 1 1 49 49 GLU N N 49 122.227 122.227 120.538 1.689 18802 4129 1 7 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.974 -0.101 18802 4130 1 7 . 1 1 49 49 GLU C C 49 177.879 177.879 179.125 -1.246 18802 4131 1 7 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.937 0.021 18802 4132 1 7 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.530 0.248 18802 4133 1 7 . 1 1 49 49 GLU H H 49 8.730 8.730 8.718 0.012 18802 4134 1 7 . 1 1 50 50 ARG N N 50 119.109 119.109 118.656 0.453 18802 4135 1 7 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.095 -0.026 18802 4136 1 7 . 1 1 50 50 ARG C C 50 177.567 177.567 178.623 -1.056 18802 4137 1 7 . 1 1 50 50 ARG CA C 50 58.226 58.226 57.802 0.424 18802 4138 1 7 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.224 -0.127 18802 4139 1 7 . 1 1 50 50 ARG H H 50 7.906 7.906 8.102 -0.196 18802 4140 1 7 . 1 1 51 51 ALA N N 51 119.411 119.411 123.238 -3.827 18802 4141 1 7 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.877 -0.073 18802 4142 1 7 . 1 1 51 51 ALA C C 51 178.740 178.740 179.069 -0.329 18802 4143 1 7 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.012 0.223 18802 4144 1 7 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.275 -0.016 18802 4145 1 7 . 1 1 51 51 ALA H H 51 7.956 7.956 8.361 -0.405 18802 4146 1 7 . 1 1 52 52 TYR N N 52 119.160 119.160 120.183 -1.023 18802 4147 1 7 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.218 -0.160 18802 4148 1 7 . 1 1 52 52 TYR C C 52 177.367 177.367 177.578 -0.211 18802 4149 1 7 . 1 1 52 52 TYR CA C 52 61.605 61.605 60.615 0.990 18802 4150 1 7 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.504 0.205 18802 4151 1 7 . 1 1 52 52 TYR H H 52 7.854 7.854 7.824 0.030 18802 4152 1 7 . 1 1 53 53 ILE N N 53 119.173 119.173 119.210 -0.037 18802 4153 1 7 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.107 0.495 18802 4154 1 7 . 1 1 53 53 ILE C C 53 178.711 178.711 177.973 0.738 18802 4155 1 7 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.372 -1.184 18802 4156 1 7 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.781 0.533 18802 4157 1 7 . 1 1 53 53 ILE H H 53 7.809 7.809 8.252 -0.443 18802 4158 1 7 . 1 1 54 54 VAL N N 54 121.549 121.549 119.376 2.173 18802 4159 1 7 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.482 -0.008 18802 4160 1 7 . 1 1 54 54 VAL C C 54 177.992 177.992 177.451 0.541 18802 4161 1 7 . 1 1 54 54 VAL CA C 54 66.995 66.995 66.937 0.058 18802 4162 1 7 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.242 -0.011 18802 4163 1 7 . 1 1 54 54 VAL H H 54 8.572 8.572 8.412 0.160 18802 4164 1 7 . 1 1 55 55 GLN N N 55 119.997 119.997 120.055 -0.058 18802 4165 1 7 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.901 -0.200 18802 4166 1 7 . 1 1 55 55 GLN C C 55 178.604 178.604 178.478 0.126 18802 4167 1 7 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.252 0.943 18802 4168 1 7 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.442 -0.300 18802 4169 1 7 . 1 1 55 55 GLN H H 55 8.183 8.183 7.588 0.595 18802 4170 1 7 . 1 1 56 56 LEU N N 56 119.605 119.605 118.906 0.699 18802 4171 1 7 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.905 0.041 18802 4172 1 7 . 1 1 56 56 LEU C C 56 180.439 180.439 179.265 1.174 18802 4173 1 7 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.536 0.699 18802 4174 1 7 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.476 0.373 18802 4175 1 7 . 1 1 56 56 LEU H H 56 7.586 7.586 7.627 -0.041 18802 4176 1 7 . 1 1 57 57 GLN N N 57 120.332 120.332 118.222 2.110 18802 4177 1 7 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.905 0.204 18802 4178 1 7 . 1 1 57 57 GLN C C 57 179.166 179.166 178.605 0.561 18802 4179 1 7 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.945 0.445 18802 4180 1 7 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.807 0.683 18802 4181 1 7 . 1 1 57 57 GLN H H 57 8.046 8.046 7.457 0.589 18802 4182 1 7 . 1 1 58 58 ILE N N 58 120.945 120.945 120.649 0.296 18802 4183 1 7 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.519 -0.114 18802 4184 1 7 . 1 1 58 58 ILE C C 58 179.368 179.368 177.682 1.686 18802 4185 1 7 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.971 1.095 18802 4186 1 7 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.759 0.497 18802 4187 1 7 . 1 1 58 58 ILE H H 58 8.778 8.778 8.557 0.221 18802 4188 1 7 . 1 1 59 59 GLU N N 59 122.689 122.689 118.863 3.826 18802 4189 1 7 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.935 0.112 18802 4190 1 7 . 1 1 59 59 GLU C C 59 178.901 178.901 178.541 0.360 18802 4191 1 7 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.366 0.498 18802 4192 1 7 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.906 0.630 18802 4193 1 7 . 1 1 59 59 GLU H H 59 8.305 8.305 8.094 0.211 18802 4194 1 7 . 1 1 60 60 ASP N N 60 121.505 121.505 121.192 0.313 18802 4195 1 7 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.387 0.050 18802 4196 1 7 . 1 1 60 60 ASP C C 60 178.312 178.312 178.638 -0.326 18802 4197 1 7 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.228 0.887 18802 4198 1 7 . 1 1 60 60 ASP CB C 60 42.248 42.248 40.892 1.356 18802 4199 1 7 . 1 1 60 60 ASP H H 60 8.142 8.142 7.779 0.363 18802 4200 1 7 . 1 1 61 61 LEU N N 61 118.666 118.666 119.922 -1.256 18802 4201 1 7 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.872 0.053 18802 4202 1 7 . 1 1 61 61 LEU C C 61 178.866 178.866 179.028 -0.162 18802 4203 1 7 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.316 -0.014 18802 4204 1 7 . 1 1 61 61 LEU CB C 61 42.610 42.610 41.908 0.702 18802 4205 1 7 . 1 1 61 61 LEU H H 61 8.425 8.425 8.331 0.094 18802 4206 1 7 . 1 1 62 62 THR N N 62 115.786 115.786 114.509 1.277 18802 4207 1 7 . 1 1 62 62 THR HA H 62 3.771 3.771 4.003 -0.232 18802 4208 1 7 . 1 1 62 62 THR C C 62 175.988 175.988 176.519 -0.531 18802 4209 1 7 . 1 1 62 62 THR CA C 62 67.649 67.649 66.889 0.760 18802 4210 1 7 . 1 1 62 62 THR CB C 62 68.848 68.848 68.373 0.475 18802 4211 1 7 . 1 1 62 62 THR H H 62 8.340 8.340 8.450 -0.110 18802 4212 1 7 . 1 1 63 63 ARG N N 63 122.111 122.111 121.744 0.367 18802 4213 1 7 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.980 0.009 18802 4214 1 7 . 1 1 63 63 ARG C C 63 179.715 179.715 178.024 1.691 18802 4215 1 7 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.791 0.295 18802 4216 1 7 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.127 -0.316 18802 4217 1 7 . 1 1 63 63 ARG H H 63 8.024 8.024 8.476 -0.452 18802 4218 1 7 . 1 1 64 64 LYS N N 64 120.824 120.824 120.294 0.530 18802 4219 1 7 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.226 -0.372 18802 4220 1 7 . 1 1 64 64 LYS C C 64 178.707 178.707 179.162 -0.455 18802 4221 1 7 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.409 1.146 18802 4222 1 7 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.423 0.755 18802 4223 1 7 . 1 1 64 64 LYS H H 64 8.130 8.130 7.735 0.395 18802 4224 1 7 . 1 1 65 65 LEU N N 65 118.497 118.497 116.294 2.203 18802 4225 1 7 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.157 -0.188 18802 4226 1 7 . 1 1 65 65 LEU C C 65 179.023 179.023 179.123 -0.100 18802 4227 1 7 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.721 -0.441 18802 4228 1 7 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.292 1.097 18802 4229 1 7 . 1 1 65 65 LEU H H 65 8.108 8.108 8.182 -0.074 18802 4230 1 7 . 1 1 66 66 ARG N N 66 119.000 119.000 120.179 -1.179 18802 4231 1 7 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.143 0.071 18802 4232 1 7 . 1 1 66 66 ARG C C 66 178.064 178.064 179.287 -1.223 18802 4233 1 7 . 1 1 66 66 ARG CA C 66 58.224 58.224 59.715 -1.492 18802 4234 1 7 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.425 0.198 18802 4235 1 7 . 1 1 66 66 ARG H H 66 8.102 8.102 8.636 -0.534 18802 4236 1 7 . 1 1 67 67 THR N N 67 109.849 109.849 108.070 1.779 18802 4237 1 7 . 1 1 67 67 THR HA H 67 4.313 4.313 4.364 -0.051 18802 4238 1 7 . 1 1 67 67 THR C C 67 175.834 175.834 176.137 -0.303 18802 4239 1 7 . 1 1 67 67 THR CA C 67 62.681 62.681 62.814 -0.133 18802 4240 1 7 . 1 1 67 67 THR CB C 67 70.768 70.768 70.138 0.630 18802 4241 1 7 . 1 1 67 67 THR H H 67 7.956 7.956 8.007 -0.051 18802 4242 1 7 . 1 1 68 68 GLY N N 68 110.673 110.673 111.204 -0.531 18802 4243 1 7 . 1 1 68 68 GLY C C 68 173.968 173.968 173.363 0.605 18802 4244 1 7 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.164 0.866 18802 4245 1 7 . 1 1 68 68 GLY H H 68 8.016 8.016 8.254 -0.238 18802 4246 1 7 . 1 1 69 69 ASP N N 69 121.490 121.490 120.629 0.861 18802 4247 1 7 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.841 -0.186 18802 4248 1 7 . 1 1 69 69 ASP C C 69 175.983 175.983 176.331 -0.348 18802 4249 1 7 . 1 1 69 69 ASP CA C 69 53.855 53.855 52.988 0.867 18802 4250 1 7 . 1 1 69 69 ASP CB C 69 40.646 40.646 41.403 -0.757 18802 4251 1 7 . 1 1 69 69 ASP H H 69 8.048 8.048 7.689 0.359 18802 4252 1 7 . 1 1 70 70 LEU N N 70 120.838 120.838 126.968 -6.130 18802 4253 1 7 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.413 -0.274 18802 4254 1 7 . 1 1 70 70 LEU C C 70 177.530 177.530 178.194 -0.664 18802 4255 1 7 . 1 1 70 70 LEU CA C 70 55.280 55.280 55.491 -0.211 18802 4256 1 7 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.788 -0.652 18802 4257 1 7 . 1 1 70 70 LEU H H 70 7.988 7.988 8.602 -0.614 18802 4258 1 7 . 1 1 71 71 GLY N N 71 108.059 108.059 106.630 1.429 18802 4259 1 7 . 1 1 71 71 GLY C C 71 173.936 173.936 174.186 -0.250 18802 4260 1 7 . 1 1 71 71 GLY CA C 71 45.558 45.558 46.034 -0.476 18802 4261 1 7 . 1 1 71 71 GLY H H 71 8.341 8.341 8.541 -0.200 18802 4262 1 7 . 1 1 72 72 ILE N N 72 121.037 121.037 120.671 0.366 18802 4263 1 7 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.479 -0.085 18802 4264 1 7 . 1 1 72 72 ILE C C 72 174.227 174.227 174.077 0.150 18802 4265 1 7 . 1 1 72 72 ILE CA C 72 58.539 58.539 56.946 1.593 18802 4266 1 7 . 1 1 72 72 ILE CB C 72 38.810 38.810 37.406 1.404 18802 4267 1 7 . 1 1 72 72 ILE H H 72 7.793 7.793 7.678 0.115 18802 4268 1 7 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.635 -0.013 18802 4269 1 7 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.985 -0.345 18802 4270 1 7 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.129 -0.025 18802 4271 1 7 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.534 -0.162 18802 4272 1 7 . 1 1 74 74 PRO C C 74 176.423 176.423 175.523 0.900 18802 4273 1 7 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.759 0.282 18802 4274 1 7 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.681 -0.651 18802 4275 1 7 . 1 1 75 75 ASN N N 75 119.550 119.550 120.689 -1.139 18802 4276 1 7 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.897 0.032 18802 4277 1 7 . 1 1 75 75 ASN C C 75 174.066 174.066 175.305 -1.239 18802 4278 1 7 . 1 1 75 75 ASN CA C 75 51.151 51.151 49.844 1.307 18802 4279 1 7 . 1 1 75 75 ASN CB C 75 38.924 38.924 39.155 -0.231 18802 4280 1 7 . 1 1 75 75 ASN H H 75 8.422 8.422 8.520 -0.098 18802 4281 1 7 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.154 0.139 18802 4282 1 7 . 1 1 76 76 PRO C C 76 177.322 177.322 178.043 -0.721 18802 4283 1 7 . 1 1 76 76 PRO CA C 76 64.384 64.384 65.009 -0.625 18802 4284 1 7 . 1 1 76 76 PRO CB C 76 32.236 32.236 31.734 0.502 18802 4285 1 7 . 1 1 77 77 GLU N N 77 118.523 118.523 116.188 2.335 18802 4286 1 7 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.076 0.100 18802 4287 1 7 . 1 1 77 77 GLU C C 77 176.403 176.403 176.552 -0.149 18802 4288 1 7 . 1 1 77 77 GLU CA C 77 56.977 56.977 58.247 -1.270 18802 4289 1 7 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.452 1.408 18802 4290 1 7 . 1 1 77 77 GLU H H 77 8.426 8.426 8.567 -0.141 18802 4291 1 7 . 1 1 78 78 ASP N N 78 120.581 120.581 119.318 1.263 18802 4292 1 7 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.486 0.057 18802 4293 1 7 . 1 1 78 78 ASP C C 78 176.085 176.085 176.696 -0.611 18802 4294 1 7 . 1 1 78 78 ASP CA C 78 54.544 54.544 54.815 -0.271 18802 4295 1 7 . 1 1 78 78 ASP CB C 78 41.239 41.239 40.992 0.247 18802 4296 1 7 . 1 1 78 78 ASP H H 78 7.941 7.941 8.017 -0.076 18802 4297 1 7 . 1 1 79 79 ARG N N 79 121.043 121.043 121.232 -0.189 18802 4298 1 7 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.517 -0.192 18802 4299 1 7 . 1 1 79 79 ARG C C 79 176.123 176.123 175.741 0.382 18802 4300 1 7 . 1 1 79 79 ARG CA C 79 55.927 55.927 54.251 1.676 18802 4301 1 7 . 1 1 79 79 ARG CB C 79 30.650 30.650 27.955 2.695 18802 4302 1 7 . 1 1 79 79 ARG H H 79 8.066 8.066 7.485 0.581 18802 4303 1 7 . 1 1 80 80 SER N N 80 118.338 118.338 118.975 -0.637 18802 4304 1 7 . 1 1 80 80 SER HA H 80 4.672 4.672 4.760 -0.088 18802 4305 1 7 . 1 1 80 80 SER C C 80 172.577 172.577 173.141 -0.564 18802 4306 1 7 . 1 1 80 80 SER CA C 80 56.564 56.564 55.466 1.098 18802 4307 1 7 . 1 1 80 80 SER CB C 80 63.415 63.415 63.167 0.248 18802 4308 1 7 . 1 1 80 80 SER H H 80 8.281 8.281 7.991 0.290 18802 4309 1 7 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.365 0.055 18802 4310 1 7 . 1 1 81 81 PRO C C 81 176.727 176.727 175.780 0.947 18802 4311 1 7 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.339 -0.076 18802 4312 1 7 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.000 0.052 18802 4313 1 7 . 1 1 82 82 SER N N 82 117.341 117.341 118.786 -1.445 18802 4314 1 7 . 1 1 82 82 SER HA H 82 4.693 4.693 4.460 0.233 18802 4315 1 7 . 1 1 82 82 SER C C 82 172.803 172.803 172.820 -0.017 18802 4316 1 7 . 1 1 82 82 SER CA C 82 56.288 56.288 57.607 -1.319 18802 4317 1 7 . 1 1 82 82 SER CB C 82 63.500 63.500 63.550 -0.050 18802 4318 1 7 . 1 1 82 82 SER H H 82 8.280 8.280 8.372 -0.092 18802 4319 1 7 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.617 -0.306 18802 4320 1 7 . 1 1 83 83 PRO C C 83 176.273 176.273 176.019 0.254 18802 4321 1 7 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.399 0.716 18802 4322 1 7 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.416 -0.317 18802 4323 1 7 . 1 1 84 84 GLU N N 84 122.213 122.213 121.912 0.301 18802 4324 1 7 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.623 -0.130 18802 4325 1 7 . 1 1 84 84 GLU C C 84 174.546 174.546 174.550 -0.004 18802 4326 1 7 . 1 1 84 84 GLU CA C 84 54.529 54.529 53.103 1.426 18802 4327 1 7 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.044 0.894 18802 4328 1 7 . 1 1 84 84 GLU H H 84 8.230 8.230 8.498 -0.268 18802 4329 1 7 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.476 -0.061 18802 4330 1 7 . 1 1 85 85 PRO C C 85 176.024 176.024 175.663 0.361 18802 4331 1 7 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.685 0.557 18802 4332 1 7 . 1 1 85 85 PRO CB C 85 32.189 32.189 31.998 0.191 18802 4333 1 7 . 1 1 86 86 ILE N N 86 120.281 120.281 121.861 -1.580 18802 4334 1 7 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.111 -0.049 18802 4335 1 7 . 1 1 86 86 ILE C C 86 175.419 175.419 176.284 -0.865 18802 4336 1 7 . 1 1 86 86 ILE CA C 86 61.029 61.029 60.800 0.229 18802 4337 1 7 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.123 0.135 18802 4338 1 7 . 1 1 86 86 ILE H H 86 7.980 7.980 8.211 -0.231 18802 4339 1 7 . 1 1 87 87 TYR N N 87 123.089 123.089 124.160 -1.071 18802 4340 1 7 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.606 0.211 18802 4341 1 7 . 1 1 87 87 TYR C C 87 175.920 175.920 176.427 -0.507 18802 4342 1 7 . 1 1 87 87 TYR CA C 87 57.197 57.197 58.171 -0.974 18802 4343 1 7 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.337 0.841 18802 4344 1 7 . 1 1 87 87 TYR H H 87 8.194 8.194 8.305 -0.111 18802 4345 1 7 . 1 1 88 88 ASN N N 88 120.117 120.117 121.195 -1.078 18802 4346 1 7 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.710 0.035 18802 4347 1 7 . 1 1 88 88 ASN C C 88 176.275 176.275 177.224 -0.949 18802 4348 1 7 . 1 1 88 88 ASN CA C 88 52.286 52.286 53.044 -0.758 18802 4349 1 7 . 1 1 88 88 ASN CB C 88 39.082 39.082 40.043 -0.961 18802 4350 1 7 . 1 1 88 88 ASN H H 88 8.386 8.386 8.852 -0.466 18802 4351 1 7 . 1 1 89 89 SER N N 89 115.826 115.826 117.777 -1.951 18802 4352 1 7 . 1 1 89 89 SER HA H 89 4.248 4.248 4.282 -0.034 18802 4353 1 7 . 1 1 89 89 SER C C 89 175.066 175.066 174.594 0.472 18802 4354 1 7 . 1 1 89 89 SER CA C 89 60.012 60.012 60.728 -0.716 18802 4355 1 7 . 1 1 89 89 SER CB C 89 63.400 63.400 62.999 0.401 18802 4356 1 7 . 1 1 89 89 SER H H 89 8.371 8.371 8.870 -0.499 18802 4357 1 7 . 1 1 90 90 GLU N N 90 121.062 121.062 118.816 2.246 18802 4358 1 7 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.350 -0.072 18802 4359 1 7 . 1 1 90 90 GLU C C 90 176.936 176.936 177.063 -0.127 18802 4360 1 7 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.126 0.655 18802 4361 1 7 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.170 0.893 18802 4362 1 7 . 1 1 90 90 GLU H H 90 8.018 8.018 7.978 0.040 18802 4363 1 7 . 1 1 91 91 GLY N N 91 108.499 108.499 108.714 -0.215 18802 4364 1 7 . 1 1 91 91 GLY C C 91 174.115 174.115 173.777 0.338 18802 4365 1 7 . 1 1 91 91 GLY CA C 91 45.744 45.744 44.965 0.779 18802 4366 1 7 . 1 1 91 91 GLY H H 91 8.199 8.199 8.197 0.002 18802 4367 1 7 . 1 1 92 92 LYS N N 92 120.638 120.638 120.123 0.515 18802 4368 1 7 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.473 -0.164 18802 4369 1 7 . 1 1 92 92 LYS C C 92 176.453 176.453 174.971 1.482 18802 4370 1 7 . 1 1 92 92 LYS CA C 92 55.856 55.856 55.672 0.184 18802 4371 1 7 . 1 1 92 92 LYS CB C 92 33.109 33.109 33.686 -0.577 18802 4372 1 7 . 1 1 92 92 LYS H H 92 7.956 7.956 7.847 0.109 18802 4373 1 7 . 1 1 93 93 ARG N N 93 122.999 122.999 123.165 -0.166 18802 4374 1 7 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.332 -0.141 18802 4375 1 7 . 1 1 93 93 ARG C C 93 176.325 176.325 174.905 1.420 18802 4376 1 7 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.376 1.006 18802 4377 1 7 . 1 1 93 93 ARG CB C 93 30.656 30.656 32.169 -1.513 18802 4378 1 7 . 1 1 93 93 ARG H H 93 8.403 8.403 8.514 -0.111 18802 4379 1 7 . 1 1 94 94 LEU N N 94 124.100 124.100 121.240 2.860 18802 4380 1 7 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.775 -0.512 18802 4381 1 7 . 1 1 94 94 LEU C C 94 176.993 176.993 175.986 1.007 18802 4382 1 7 . 1 1 94 94 LEU CA C 94 55.034 55.034 54.611 0.423 18802 4383 1 7 . 1 1 94 94 LEU CB C 94 42.941 42.941 42.426 0.515 18802 4384 1 7 . 1 1 94 94 LEU H H 94 8.283 8.283 8.467 -0.184 18802 4385 1 7 . 1 1 95 95 ASN N N 95 119.593 119.593 117.104 2.489 18802 4386 1 7 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.958 -0.211 18802 4387 1 7 . 1 1 95 95 ASN C C 95 175.598 175.598 173.808 1.790 18802 4388 1 7 . 1 1 95 95 ASN CA C 95 52.680 52.680 52.277 0.403 18802 4389 1 7 . 1 1 95 95 ASN CB C 95 38.723 38.723 41.037 -2.314 18802 4390 1 7 . 1 1 95 95 ASN H H 95 8.460 8.460 8.022 0.438 18802 4391 1 7 . 1 1 96 96 THR N N 96 114.100 114.100 115.556 -1.456 18802 4392 1 7 . 1 1 96 96 THR HA H 96 4.226 4.226 4.324 -0.098 18802 4393 1 7 . 1 1 96 96 THR C C 96 175.186 175.186 176.030 -0.844 18802 4394 1 7 . 1 1 96 96 THR CA C 96 62.203 62.203 64.149 -1.946 18802 4395 1 7 . 1 1 96 96 THR CB C 96 69.880 69.880 69.972 -0.092 18802 4396 1 7 . 1 1 96 96 THR H H 96 8.031 8.031 8.368 -0.337 18802 4397 1 7 . 1 1 97 97 ARG N N 97 122.587 122.587 121.668 0.919 18802 4398 1 7 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.109 0.004 18802 4399 1 7 . 1 1 97 97 ARG C C 97 177.938 177.938 178.285 -0.347 18802 4400 1 7 . 1 1 97 97 ARG CA C 97 58.412 58.412 60.787 -2.375 18802 4401 1 7 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.852 0.445 18802 4402 1 7 . 1 1 97 97 ARG H H 97 8.502 8.502 8.611 -0.109 18802 4403 1 7 . 1 1 98 98 GLU N N 98 121.548 121.548 118.338 3.210 18802 4404 1 7 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.107 -0.090 18802 4405 1 7 . 1 1 98 98 GLU C C 98 177.113 177.113 179.154 -2.041 18802 4406 1 7 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.323 -0.643 18802 4407 1 7 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.916 0.750 18802 4408 1 7 . 1 1 98 98 GLU H H 98 8.517 8.517 8.907 -0.390 18802 4409 1 7 . 1 1 99 99 PHE N N 99 121.388 121.388 120.680 0.708 18802 4410 1 7 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.251 0.071 18802 4411 1 7 . 1 1 99 99 PHE C C 99 177.070 177.070 177.025 0.045 18802 4412 1 7 . 1 1 99 99 PHE CA C 99 60.075 60.075 60.736 -0.661 18802 4413 1 7 . 1 1 99 99 PHE CB C 99 39.486 39.486 38.892 0.594 18802 4414 1 7 . 1 1 99 99 PHE H H 99 8.176 8.176 8.307 -0.131 18802 4415 1 7 . 1 1 100 100 ARG N N 100 120.211 120.211 118.798 1.413 18802 4416 1 7 . 1 1 100 100 ARG C C 100 178.159 178.159 179.012 -0.853 18802 4417 1 7 . 1 1 100 100 ARG CA C 100 58.533 58.533 58.824 -0.291 18802 4418 1 7 . 1 1 100 100 ARG CB C 100 30.588 30.588 29.065 1.523 18802 4419 1 7 . 1 1 100 100 ARG H H 100 8.377 8.377 8.543 -0.166 18802 4420 1 7 . 1 1 101 101 THR N N 101 115.416 115.416 116.291 -0.875 18802 4421 1 7 . 1 1 101 101 THR HA H 101 4.022 4.022 3.964 0.058 18802 4422 1 7 . 1 1 101 101 THR C C 101 175.301 175.301 176.387 -1.086 18802 4423 1 7 . 1 1 101 101 THR CA C 101 65.141 65.141 66.847 -1.706 18802 4424 1 7 . 1 1 101 101 THR CB C 101 69.305 69.305 68.682 0.623 18802 4425 1 7 . 1 1 101 101 THR H H 101 7.992 7.992 8.106 -0.114 18802 4426 1 7 . 1 1 102 102 ARG N N 102 122.212 122.212 120.367 1.845 18802 4427 1 7 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.973 0.334 18802 4428 1 7 . 1 1 102 102 ARG C C 102 177.644 177.644 178.470 -0.826 18802 4429 1 7 . 1 1 102 102 ARG CA C 102 60.611 60.611 58.270 2.341 18802 4430 1 7 . 1 1 102 102 ARG CB C 102 29.808 29.808 29.383 0.425 18802 4431 1 7 . 1 1 102 102 ARG H H 102 8.369 8.369 8.758 -0.389 18802 4432 1 7 . 1 1 103 103 LYS N N 103 117.591 117.591 119.754 -2.163 18802 4433 1 7 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.897 0.063 18802 4434 1 7 . 1 1 103 103 LYS C C 103 178.913 178.913 178.536 0.377 18802 4435 1 7 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.728 0.322 18802 4436 1 7 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.325 0.816 18802 4437 1 7 . 1 1 103 103 LYS H H 103 7.941 7.941 8.142 -0.201 18802 4438 1 7 . 1 1 104 104 LYS N N 104 119.769 119.769 119.800 -0.031 18802 4439 1 7 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.050 0.096 18802 4440 1 7 . 1 1 104 104 LYS C C 104 179.377 179.377 178.832 0.545 18802 4441 1 7 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.685 0.294 18802 4442 1 7 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.870 0.321 18802 4443 1 7 . 1 1 104 104 LYS H H 104 7.615 7.615 7.449 0.166 18802 4444 1 7 . 1 1 105 105 LEU N N 105 120.500 120.500 119.364 1.136 18802 4445 1 7 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.914 0.203 18802 4446 1 7 . 1 1 105 105 LEU C C 105 179.481 179.481 178.958 0.523 18802 4447 1 7 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.168 0.093 18802 4448 1 7 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.637 0.367 18802 4449 1 7 . 1 1 105 105 LEU H H 105 8.057 8.057 8.320 -0.263 18802 4450 1 7 . 1 1 106 106 GLU N N 106 118.803 118.803 119.020 -0.217 18802 4451 1 7 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.962 0.027 18802 4452 1 7 . 1 1 106 106 GLU C C 106 180.577 180.577 179.367 1.210 18802 4453 1 7 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.747 0.063 18802 4454 1 7 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.287 0.722 18802 4455 1 7 . 1 1 106 106 GLU H H 106 8.652 8.652 8.416 0.236 18802 4456 1 7 . 1 1 107 107 GLU N N 107 122.396 122.396 118.974 3.422 18802 4457 1 7 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.313 -0.207 18802 4458 1 7 . 1 1 107 107 GLU C C 107 178.457 178.457 179.254 -0.797 18802 4459 1 7 . 1 1 107 107 GLU CA C 107 59.826 59.826 58.984 0.842 18802 4460 1 7 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.237 0.325 18802 4461 1 7 . 1 1 107 107 GLU H H 107 8.281 8.281 8.178 0.103 18802 4462 1 7 . 1 1 108 108 GLU N N 108 120.976 120.976 119.631 1.345 18802 4463 1 7 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.012 0.080 18802 4464 1 7 . 1 1 108 108 GLU C C 108 179.343 179.343 179.051 0.292 18802 4465 1 7 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.246 0.450 18802 4466 1 7 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.205 0.365 18802 4467 1 7 . 1 1 108 108 GLU H H 108 8.321 8.321 8.171 0.150 18802 4468 1 7 . 1 1 109 109 ARG N N 109 118.559 118.559 119.882 -1.323 18802 4469 1 7 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.906 -0.114 18802 4470 1 7 . 1 1 109 109 ARG C C 109 177.178 177.178 178.078 -0.900 18802 4471 1 7 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.803 0.680 18802 4472 1 7 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.216 -0.067 18802 4473 1 7 . 1 1 109 109 ARG H H 109 8.594 8.594 8.193 0.401 18802 4474 1 7 . 1 1 110 110 HIS N N 110 119.632 119.632 118.837 0.795 18802 4475 1 7 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.075 0.266 18802 4476 1 7 . 1 1 110 110 HIS C C 110 177.578 177.578 177.567 0.011 18802 4477 1 7 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.077 1.540 18802 4478 1 7 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.018 0.491 18802 4479 1 7 . 1 1 110 110 HIS H H 110 8.465 8.465 8.469 -0.004 18802 4480 1 7 . 1 1 111 111 ASN N N 111 119.587 119.587 118.539 1.048 18802 4481 1 7 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.315 -0.037 18802 4482 1 7 . 1 1 111 111 ASN C C 111 178.630 178.630 177.745 0.885 18802 4483 1 7 . 1 1 111 111 ASN CA C 111 56.281 56.281 55.964 0.317 18802 4484 1 7 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.120 -0.425 18802 4485 1 7 . 1 1 111 111 ASN H H 111 8.323 8.323 8.477 -0.154 18802 4486 1 7 . 1 1 112 112 LEU N N 112 122.320 122.320 120.411 1.909 18802 4487 1 7 . 1 1 112 112 LEU HA H 112 4.116 4.116 4.016 0.100 18802 4488 1 7 . 1 1 112 112 LEU C C 112 178.539 178.539 178.884 -0.345 18802 4489 1 7 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.720 0.259 18802 4490 1 7 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.738 0.856 18802 4491 1 7 . 1 1 112 112 LEU H H 112 7.966 7.966 7.707 0.259 18802 4492 1 7 . 1 1 113 113 ILE N N 113 121.495 121.495 120.469 1.026 18802 4493 1 7 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.749 -0.513 18802 4494 1 7 . 1 1 113 113 ILE C C 113 176.959 176.959 178.308 -1.349 18802 4495 1 7 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.500 1.554 18802 4496 1 7 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.120 1.483 18802 4497 1 7 . 1 1 113 113 ILE H H 113 8.472 8.472 8.654 -0.182 18802 4498 1 7 . 1 1 114 114 THR N N 114 115.066 115.066 116.416 -1.350 18802 4499 1 7 . 1 1 114 114 THR HA H 114 3.718 3.718 3.984 -0.266 18802 4500 1 7 . 1 1 114 114 THR C C 114 176.559 176.559 176.622 -0.063 18802 4501 1 7 . 1 1 114 114 THR CA C 114 66.700 66.700 67.468 -0.768 18802 4502 1 7 . 1 1 114 114 THR CB C 114 68.759 68.759 68.565 0.194 18802 4503 1 7 . 1 1 114 114 THR H H 114 8.075 8.075 8.243 -0.168 18802 4504 1 7 . 1 1 115 115 GLU N N 115 123.259 123.259 121.986 1.273 18802 4505 1 7 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.065 -0.133 18802 4506 1 7 . 1 1 115 115 GLU C C 115 178.191 178.191 178.628 -0.437 18802 4507 1 7 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.065 0.275 18802 4508 1 7 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.299 0.100 18802 4509 1 7 . 1 1 115 115 GLU H H 115 7.368 7.368 7.722 -0.354 18802 4510 1 7 . 1 1 116 116 MET N N 116 119.844 119.844 119.836 0.008 18802 4511 1 7 . 1 1 116 116 MET HA H 116 4.014 4.014 3.986 0.028 18802 4512 1 7 . 1 1 116 116 MET C C 116 177.888 177.888 178.219 -0.331 18802 4513 1 7 . 1 1 116 116 MET CA C 116 57.183 57.183 57.151 0.032 18802 4514 1 7 . 1 1 116 116 MET CB C 116 32.126 32.126 31.757 0.369 18802 4515 1 7 . 1 1 116 116 MET H H 116 8.373 8.373 8.283 0.090 18802 4516 1 7 . 1 1 117 117 VAL N N 117 117.572 117.572 119.352 -1.780 18802 4517 1 7 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.099 -0.203 18802 4518 1 7 . 1 1 117 117 VAL C C 117 177.567 177.567 177.903 -0.336 18802 4519 1 7 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.221 -1.351 18802 4520 1 7 . 1 1 117 117 VAL CB C 117 32.002 32.002 31.562 0.440 18802 4521 1 7 . 1 1 117 117 VAL H H 117 8.279 8.279 8.708 -0.429 18802 4522 1 7 . 1 1 118 118 ALA N N 118 120.560 120.560 121.684 -1.124 18802 4523 1 7 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.149 -0.013 18802 4524 1 7 . 1 1 118 118 ALA C C 118 179.595 179.595 179.251 0.344 18802 4525 1 7 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.812 -0.709 18802 4526 1 7 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.689 -0.439 18802 4527 1 7 . 1 1 118 118 ALA H H 118 7.074 7.074 7.519 -0.445 18802 4528 1 7 . 1 1 119 119 LEU N N 119 117.987 117.987 117.286 0.701 18802 4529 1 7 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.144 -0.004 18802 4530 1 7 . 1 1 119 119 LEU C C 119 177.863 177.863 177.135 0.728 18802 4531 1 7 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.745 -0.072 18802 4532 1 7 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.791 0.443 18802 4533 1 7 . 1 1 119 119 LEU H H 119 7.525 7.525 7.766 -0.241 18802 4534 1 7 . 1 1 120 120 ASN N N 120 115.338 115.338 115.977 -0.639 18802 4535 1 7 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.148 -0.130 18802 4536 1 7 . 1 1 120 120 ASN C C 120 172.510 172.510 173.980 -1.470 18802 4537 1 7 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.114 -0.012 18802 4538 1 7 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.693 -1.388 18802 4539 1 7 . 1 1 120 120 ASN H H 120 8.467 8.467 8.142 0.325 18802 4540 1 7 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.495 0.161 18802 4541 1 7 . 1 1 121 121 PRO C C 121 177.020 177.020 176.726 0.294 18802 4542 1 7 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.382 -0.084 18802 4543 1 7 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.220 0.079 18802 4544 1 7 . 1 1 122 122 ASP N N 122 115.744 115.744 117.960 -2.216 18802 4545 1 7 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.694 -0.025 18802 4546 1 7 . 1 1 122 122 ASP C C 122 176.004 176.004 175.812 0.192 18802 4547 1 7 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.249 1.117 18802 4548 1 7 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.640 -0.316 18802 4549 1 7 . 1 1 122 122 ASP H H 122 7.600 7.600 8.105 -0.505 18802 4550 1 7 . 1 1 123 123 PHE N N 123 122.722 122.722 122.347 0.375 18802 4551 1 7 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.408 -0.273 18802 4552 1 7 . 1 1 123 123 PHE C C 123 173.954 173.954 174.206 -0.252 18802 4553 1 7 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.452 0.541 18802 4554 1 7 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.884 -0.288 18802 4555 1 7 . 1 1 123 123 PHE H H 123 7.940 7.940 7.556 0.384 18802 4556 1 7 . 1 1 124 124 LYS N N 124 129.400 129.400 128.251 1.149 18802 4557 1 7 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.398 0.161 18802 4558 1 7 . 1 1 124 124 LYS C C 124 172.622 172.622 173.843 -1.221 18802 4559 1 7 . 1 1 124 124 LYS CA C 124 51.815 51.815 52.141 -0.326 18802 4560 1 7 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.833 0.748 18802 4561 1 7 . 1 1 124 124 LYS H H 124 7.602 7.602 8.134 -0.532 18802 4562 1 7 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.091 -0.002 18802 4563 1 7 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.469 -0.473 18802 4564 1 7 . 1 1 125 125 PRO CB C 125 31.067 31.067 30.557 0.510 18802 4565 1 7 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.428 -0.054 18802 4566 1 7 . 1 1 126 126 PRO C C 126 177.630 177.630 177.797 -0.167 18802 4567 1 7 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.761 0.052 18802 4568 1 7 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.170 0.151 18802 4569 1 7 . 1 1 127 127 ALA N N 127 123.830 123.830 123.204 0.626 18802 4570 1 7 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.063 -0.005 18802 4571 1 7 . 1 1 127 127 ALA C C 127 177.641 177.641 177.944 -0.303 18802 4572 1 7 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.337 0.266 18802 4573 1 7 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.701 0.148 18802 4574 1 7 . 1 1 127 127 ALA H H 127 8.630 8.630 8.562 0.068 18802 4575 1 7 . 1 1 128 128 ASP N N 128 112.924 112.924 113.638 -0.714 18802 4576 1 7 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.510 -0.059 18802 4577 1 7 . 1 1 128 128 ASP C C 128 175.724 175.724 176.147 -0.423 18802 4578 1 7 . 1 1 128 128 ASP CA C 128 53.604 53.604 54.449 -0.845 18802 4579 1 7 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.599 -0.181 18802 4580 1 7 . 1 1 128 128 ASP H H 128 8.335 8.335 8.236 0.099 18802 4581 1 7 . 1 1 129 129 TYR N N 129 121.114 121.114 122.973 -1.859 18802 4582 1 7 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.324 0.038 18802 4583 1 7 . 1 1 129 129 TYR C C 129 174.190 174.190 174.195 -0.005 18802 4584 1 7 . 1 1 129 129 TYR CA C 129 58.412 58.412 59.038 -0.627 18802 4585 1 7 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.840 0.218 18802 4586 1 7 . 1 1 129 129 TYR H H 129 7.600 7.600 7.685 -0.085 18802 4587 1 7 . 1 1 130 130 LYS N N 130 129.875 129.875 128.446 1.429 18802 4588 1 7 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.311 0.007 18802 4589 1 7 . 1 1 130 130 LYS C C 130 172.314 172.314 173.369 -1.055 18802 4590 1 7 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.898 0.672 18802 4591 1 7 . 1 1 130 130 LYS CB C 130 33.663 33.663 33.194 0.469 18802 4592 1 7 . 1 1 130 130 LYS H H 130 7.695 7.695 8.137 -0.442 18802 4593 1 7 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.084 0.193 18802 4594 1 7 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.494 -0.436 18802 4595 1 7 . 1 1 131 131 PRO CB C 131 30.852 30.852 30.962 -0.110 18802 4596 1 7 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.208 0.036 18802 4597 1 7 . 1 1 132 132 PRO C C 132 176.459 176.459 176.697 -0.238 18802 4598 1 7 . 1 1 132 132 PRO CA C 132 62.874 62.874 63.326 -0.452 18802 4599 1 7 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.030 0.017 18802 4600 1 7 . 1 1 133 133 ALA N N 133 124.170 124.170 124.666 -0.496 18802 4601 1 7 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.235 0.015 18802 4602 1 7 . 1 1 133 133 ALA C C 133 177.870 177.870 177.565 0.305 18802 4603 1 7 . 1 1 133 133 ALA CA C 133 52.508 52.508 52.364 0.144 18802 4604 1 7 . 1 1 133 133 ALA CB C 133 19.303 19.303 18.741 0.562 18802 4605 1 7 . 1 1 133 133 ALA H H 133 8.311 8.311 8.183 0.128 18802 4606 1 7 . 1 1 134 134 THR N N 134 113.807 113.807 117.028 -3.221 18802 4607 1 7 . 1 1 134 134 THR HA H 134 4.228 4.228 4.358 -0.130 18802 4608 1 7 . 1 1 134 134 THR C C 134 174.282 174.282 174.464 -0.182 18802 4609 1 7 . 1 1 134 134 THR CA C 134 62.127 62.127 61.791 0.336 18802 4610 1 7 . 1 1 134 134 THR CB C 134 69.870 69.870 69.653 0.217 18802 4611 1 7 . 1 1 134 134 THR H H 134 8.019 8.019 8.276 -0.257 18802 4612 1 7 . 1 1 135 135 ARG N N 135 124.165 124.165 125.074 -0.909 18802 4613 1 7 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.646 -0.297 18802 4614 1 7 . 1 1 135 135 ARG C C 135 176.217 176.217 177.679 -1.462 18802 4615 1 7 . 1 1 135 135 ARG CA C 135 55.993 55.993 54.341 1.652 18802 4616 1 7 . 1 1 135 135 ARG CB C 135 30.992 30.992 30.057 0.935 18802 4617 1 7 . 1 1 135 135 ARG H H 135 8.300 8.300 8.561 -0.261 18802 4618 1 7 . 1 1 136 136 VAL N N 136 122.157 122.157 122.197 -0.040 18802 4619 1 7 . 1 1 136 136 VAL HA H 136 4.070 4.070 3.949 0.121 18802 4620 1 7 . 1 1 136 136 VAL C C 136 176.180 176.180 176.455 -0.275 18802 4621 1 7 . 1 1 136 136 VAL CA C 136 61.937 61.937 64.391 -2.454 18802 4622 1 7 . 1 1 136 136 VAL CB C 136 32.747 32.747 31.683 1.064 18802 4623 1 7 . 1 1 136 136 VAL H H 136 8.233 8.233 8.380 -0.147 18802 4624 1 7 . 1 1 137 137 SER N N 137 118.837 118.837 110.704 8.133 18802 4625 1 7 . 1 1 137 137 SER HA H 137 4.416 4.416 4.371 0.045 18802 4626 1 7 . 1 1 137 137 SER C C 137 174.258 174.258 174.792 -0.534 18802 4627 1 7 . 1 1 137 137 SER CA C 137 58.341 58.341 58.047 0.294 18802 4628 1 7 . 1 1 137 137 SER CB C 137 63.900 63.900 62.127 1.773 18802 4629 1 7 . 1 1 137 137 SER H H 137 8.264 8.264 7.928 0.336 18802 4630 1 7 . 1 1 138 138 ASP N N 138 122.871 122.871 123.430 -0.559 18802 4631 1 7 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.415 0.122 18802 4632 1 7 . 1 1 138 138 ASP C C 138 176.053 176.053 176.698 -0.645 18802 4633 1 7 . 1 1 138 138 ASP CA C 138 54.489 54.489 56.497 -2.008 18802 4634 1 7 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.360 -0.212 18802 4635 1 7 . 1 1 138 138 ASP H H 138 8.249 8.249 7.745 0.504 18802 4636 1 7 . 1 1 139 139 LYS N N 139 120.944 120.944 120.776 0.168 18802 4637 1 7 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.546 -0.286 18802 4638 1 7 . 1 1 139 139 LYS C C 139 176.343 176.343 175.781 0.562 18802 4639 1 7 . 1 1 139 139 LYS CA C 139 56.261 56.261 55.254 1.007 18802 4640 1 7 . 1 1 139 139 LYS CB C 139 33.077 33.077 33.070 0.007 18802 4641 1 7 . 1 1 139 139 LYS H H 139 8.084 8.084 7.951 0.133 18802 4642 1 7 . 1 1 140 140 VAL N N 140 121.670 121.670 120.697 0.973 18802 4643 1 7 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.241 -0.229 18802 4644 1 7 . 1 1 140 140 VAL C C 140 175.842 175.842 176.197 -0.355 18802 4645 1 7 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.563 0.879 18802 4646 1 7 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.763 0.104 18802 4647 1 7 . 1 1 140 140 VAL H H 140 8.025 8.025 8.294 -0.269 18802 4648 1 7 . 1 1 141 141 MET N N 141 124.839 124.839 122.320 2.519 18802 4649 1 7 . 1 1 141 141 MET HA H 141 4.453 4.453 4.545 -0.092 18802 4650 1 7 . 1 1 141 141 MET C C 141 175.562 175.562 175.913 -0.351 18802 4651 1 7 . 1 1 141 141 MET CA C 141 55.349 55.349 54.770 0.579 18802 4652 1 7 . 1 1 141 141 MET CB C 141 32.993 32.993 32.032 0.961 18802 4653 1 7 . 1 1 141 141 MET H H 141 8.364 8.364 8.313 0.051 18802 4654 1 7 . 1 1 142 142 ILE N N 142 124.515 124.515 128.318 -3.803 18802 4655 1 7 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.241 0.187 18802 4656 1 7 . 1 1 142 142 ILE C C 142 174.331 174.331 174.764 -0.433 18802 4657 1 7 . 1 1 142 142 ILE CA C 142 58.404 58.404 59.279 -0.875 18802 4658 1 7 . 1 1 142 142 ILE CB C 142 38.755 38.755 37.957 0.798 18802 4659 1 7 . 1 1 142 142 ILE H H 142 8.093 8.093 8.329 -0.236 18802 4660 1 7 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.485 -0.135 18802 4661 1 7 . 1 1 143 143 PRO C C 143 176.623 176.623 176.161 0.462 18802 4662 1 7 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.562 0.853 18802 4663 1 7 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.195 0.038 18802 4664 1 7 . 1 1 144 144 GLN N N 144 121.557 121.557 121.495 0.062 18802 4665 1 7 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.449 -0.143 18802 4666 1 7 . 1 1 144 144 GLN C C 144 174.751 174.751 175.916 -1.165 18802 4667 1 7 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.574 0.097 18802 4668 1 7 . 1 1 144 144 GLN CB C 144 30.118 30.118 29.198 0.920 18802 4669 1 7 . 1 1 144 144 GLN H H 144 8.392 8.392 8.438 -0.046 18802 4670 1 8 . 1 1 26 26 ALA N N 26 124.085 124.085 121.484 2.601 18802 4671 1 8 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.776 -0.484 18802 4672 1 8 . 1 1 26 26 ALA C C 26 177.101 177.101 176.939 0.162 18802 4673 1 8 . 1 1 26 26 ALA CA C 26 52.921 52.921 51.552 1.369 18802 4674 1 8 . 1 1 26 26 ALA CB C 26 19.426 19.426 20.861 -1.435 18802 4675 1 8 . 1 1 26 26 ALA H H 26 8.498 8.498 8.181 0.317 18802 4676 1 8 . 1 1 27 27 MET N N 27 119.630 119.630 118.057 1.573 18802 4677 1 8 . 1 1 27 27 MET HA H 27 4.391 4.391 4.152 0.239 18802 4678 1 8 . 1 1 27 27 MET C C 27 176.296 176.296 175.335 0.961 18802 4679 1 8 . 1 1 27 27 MET CA C 27 55.834 55.834 55.665 0.169 18802 4680 1 8 . 1 1 27 27 MET CB C 27 32.663 32.663 32.464 0.199 18802 4681 1 8 . 1 1 27 27 MET H H 27 8.441 8.441 8.535 -0.094 18802 4682 1 8 . 1 1 28 28 GLU N N 28 122.376 122.376 117.963 4.413 18802 4683 1 8 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.107 0.107 18802 4684 1 8 . 1 1 28 28 GLU C C 28 176.310 176.310 177.655 -1.345 18802 4685 1 8 . 1 1 28 28 GLU CA C 28 56.819 56.819 58.043 -1.224 18802 4686 1 8 . 1 1 28 28 GLU CB C 28 30.252 30.252 29.809 0.443 18802 4687 1 8 . 1 1 28 28 GLU H H 28 8.336 8.336 8.561 -0.225 18802 4688 1 8 . 1 1 29 29 GLN N N 29 122.010 122.010 120.207 1.803 18802 4689 1 8 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.364 -0.073 18802 4690 1 8 . 1 1 29 29 GLN C C 29 175.765 175.765 174.823 0.942 18802 4691 1 8 . 1 1 29 29 GLN CA C 29 55.839 55.839 54.738 1.101 18802 4692 1 8 . 1 1 29 29 GLN CB C 29 29.559 29.559 28.329 1.230 18802 4693 1 8 . 1 1 29 29 GLN H H 29 8.347 8.347 7.971 0.376 18802 4694 1 8 . 1 1 30 30 LYS N N 30 123.090 123.090 126.926 -3.836 18802 4695 1 8 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.230 0.106 18802 4696 1 8 . 1 1 30 30 LYS C C 30 176.474 176.474 176.486 -0.012 18802 4697 1 8 . 1 1 30 30 LYS CA C 30 56.391 56.391 56.334 0.057 18802 4698 1 8 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.650 0.343 18802 4699 1 8 . 1 1 30 30 LYS H H 30 8.327 8.327 8.051 0.276 18802 4700 1 8 . 1 1 31 31 THR N N 31 116.800 116.800 118.997 -2.197 18802 4701 1 8 . 1 1 31 31 THR HA H 31 4.273 4.273 4.233 0.040 18802 4702 1 8 . 1 1 31 31 THR C C 31 174.071 174.071 173.514 0.557 18802 4703 1 8 . 1 1 31 31 THR CA C 31 62.103 62.103 62.393 -0.290 18802 4704 1 8 . 1 1 31 31 THR CB C 31 69.899 69.899 68.613 1.286 18802 4705 1 8 . 1 1 31 31 THR H H 31 8.160 8.160 8.491 -0.331 18802 4706 1 8 . 1 1 32 32 VAL N N 32 124.108 124.108 125.335 -1.227 18802 4707 1 8 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.405 -0.339 18802 4708 1 8 . 1 1 32 32 VAL C C 32 175.573 175.573 174.361 1.212 18802 4709 1 8 . 1 1 32 32 VAL CA C 32 62.344 62.344 60.163 2.181 18802 4710 1 8 . 1 1 32 32 VAL CB C 32 32.912 32.912 35.229 -2.317 18802 4711 1 8 . 1 1 32 32 VAL H H 32 8.192 8.192 8.178 0.014 18802 4712 1 8 . 1 1 33 33 ILE N N 33 127.371 127.371 128.642 -1.271 18802 4713 1 8 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.480 -0.056 18802 4714 1 8 . 1 1 33 33 ILE C C 33 174.335 174.335 174.599 -0.264 18802 4715 1 8 . 1 1 33 33 ILE CA C 33 58.394 58.394 58.012 0.382 18802 4716 1 8 . 1 1 33 33 ILE CB C 33 38.799 38.799 37.851 0.948 18802 4717 1 8 . 1 1 33 33 ILE H H 33 8.275 8.275 8.421 -0.146 18802 4718 1 8 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.511 -0.208 18802 4719 1 8 . 1 1 34 34 PRO C C 34 177.261 177.261 177.853 -0.592 18802 4720 1 8 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.214 0.458 18802 4721 1 8 . 1 1 34 34 PRO CB C 34 32.177 32.177 32.086 0.091 18802 4722 1 8 . 1 1 35 35 GLY N N 35 109.540 109.540 109.741 -0.201 18802 4723 1 8 . 1 1 35 35 GLY C C 35 173.906 173.906 174.489 -0.583 18802 4724 1 8 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.833 0.437 18802 4725 1 8 . 1 1 35 35 GLY H H 35 8.376 8.376 8.545 -0.169 18802 4726 1 8 . 1 1 36 36 MET N N 36 120.834 120.834 122.334 -1.500 18802 4727 1 8 . 1 1 36 36 MET HA H 36 4.780 4.780 4.767 0.013 18802 4728 1 8 . 1 1 36 36 MET C C 36 174.235 174.235 174.856 -0.621 18802 4729 1 8 . 1 1 36 36 MET CA C 36 53.258 53.258 51.910 1.348 18802 4730 1 8 . 1 1 36 36 MET CB C 36 32.734 32.734 31.746 0.988 18802 4731 1 8 . 1 1 36 36 MET H H 36 7.986 7.986 7.732 0.254 18802 4732 1 8 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.585 -0.123 18802 4733 1 8 . 1 1 37 37 PRO C C 37 176.736 176.736 176.278 0.458 18802 4734 1 8 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.766 0.492 18802 4735 1 8 . 1 1 37 37 PRO CB C 37 32.200 32.200 32.026 0.174 18802 4736 1 8 . 1 1 38 38 THR N N 38 115.642 115.642 117.934 -2.292 18802 4737 1 8 . 1 1 38 38 THR HA H 38 4.226 4.226 4.573 -0.347 18802 4738 1 8 . 1 1 38 38 THR C C 38 174.164 174.164 173.893 0.271 18802 4739 1 8 . 1 1 38 38 THR CA C 38 62.462 62.462 62.055 0.407 18802 4740 1 8 . 1 1 38 38 THR CB C 38 69.874 69.874 70.201 -0.327 18802 4741 1 8 . 1 1 38 38 THR H H 38 8.189 8.189 8.297 -0.108 18802 4742 1 8 . 1 1 39 39 VAL N N 39 123.700 123.700 127.563 -3.863 18802 4743 1 8 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.416 -0.337 18802 4744 1 8 . 1 1 39 39 VAL C C 39 175.177 175.177 174.333 0.844 18802 4745 1 8 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.190 0.801 18802 4746 1 8 . 1 1 39 39 VAL CB C 39 32.898 32.898 33.124 -0.226 18802 4747 1 8 . 1 1 39 39 VAL H H 39 8.036 8.036 8.689 -0.653 18802 4748 1 8 . 1 1 40 40 ILE N N 40 127.780 127.780 129.956 -2.176 18802 4749 1 8 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.256 -0.079 18802 4750 1 8 . 1 1 40 40 ILE C C 40 173.894 173.894 174.472 -0.578 18802 4751 1 8 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.026 -1.115 18802 4752 1 8 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.619 1.014 18802 4753 1 8 . 1 1 40 40 ILE H H 40 8.236 8.236 8.360 -0.124 18802 4754 1 8 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.535 -0.044 18802 4755 1 8 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.354 0.270 18802 4756 1 8 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.072 0.030 18802 4757 1 8 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.345 -0.090 18802 4758 1 8 . 1 1 42 42 PRO C C 42 177.721 177.721 178.306 -0.585 18802 4759 1 8 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.242 -0.442 18802 4760 1 8 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.831 0.524 18802 4761 1 8 . 1 1 43 43 GLY N N 43 107.305 107.305 109.238 -1.933 18802 4762 1 8 . 1 1 43 43 GLY C C 43 174.642 174.642 174.045 0.597 18802 4763 1 8 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.756 0.962 18802 4764 1 8 . 1 1 43 43 GLY H H 43 8.321 8.321 8.595 -0.274 18802 4765 1 8 . 1 1 44 44 LEU N N 44 120.897 120.897 121.935 -1.038 18802 4766 1 8 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.491 0.038 18802 4767 1 8 . 1 1 44 44 LEU C C 44 178.580 178.580 176.588 1.992 18802 4768 1 8 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.334 0.215 18802 4769 1 8 . 1 1 44 44 LEU CB C 44 42.579 42.579 42.893 -0.314 18802 4770 1 8 . 1 1 44 44 LEU H H 44 8.043 8.043 7.613 0.430 18802 4771 1 8 . 1 1 45 45 THR N N 45 113.195 113.195 112.819 0.376 18802 4772 1 8 . 1 1 45 45 THR HA H 45 4.386 4.386 4.509 -0.123 18802 4773 1 8 . 1 1 45 45 THR C C 45 175.377 175.377 175.600 -0.223 18802 4774 1 8 . 1 1 45 45 THR CA C 45 61.188 61.188 60.748 0.440 18802 4775 1 8 . 1 1 45 45 THR CB C 45 71.043 71.043 70.990 0.053 18802 4776 1 8 . 1 1 45 45 THR H H 45 8.427 8.427 8.114 0.313 18802 4777 1 8 . 1 1 46 46 ARG N N 46 121.322 121.322 121.566 -0.244 18802 4778 1 8 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.263 -0.226 18802 4779 1 8 . 1 1 46 46 ARG C C 46 179.309 179.309 178.328 0.981 18802 4780 1 8 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.331 0.053 18802 4781 1 8 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.454 0.362 18802 4782 1 8 . 1 1 46 46 ARG H H 46 8.832 8.832 8.847 -0.015 18802 4783 1 8 . 1 1 47 47 GLU N N 47 119.109 119.109 119.655 -0.546 18802 4784 1 8 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.107 -0.098 18802 4785 1 8 . 1 1 47 47 GLU C C 47 178.931 178.931 179.013 -0.082 18802 4786 1 8 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.689 0.587 18802 4787 1 8 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.594 0.697 18802 4788 1 8 . 1 1 47 47 GLU H H 47 8.754 8.754 8.187 0.567 18802 4789 1 8 . 1 1 48 48 GLN N N 48 119.556 119.556 119.963 -0.407 18802 4790 1 8 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.056 0.010 18802 4791 1 8 . 1 1 48 48 GLN C C 48 179.286 179.286 178.204 1.082 18802 4792 1 8 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.628 -0.413 18802 4793 1 8 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.371 1.296 18802 4794 1 8 . 1 1 48 48 GLN H H 48 7.711 7.711 7.818 -0.107 18802 4795 1 8 . 1 1 49 49 GLU N N 49 122.227 122.227 120.894 1.333 18802 4796 1 8 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.958 -0.085 18802 4797 1 8 . 1 1 49 49 GLU C C 49 177.879 177.879 179.117 -1.238 18802 4798 1 8 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.984 -0.026 18802 4799 1 8 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.513 0.265 18802 4800 1 8 . 1 1 49 49 GLU H H 49 8.730 8.730 8.754 -0.024 18802 4801 1 8 . 1 1 50 50 ARG N N 50 119.109 119.109 118.651 0.458 18802 4802 1 8 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.081 -0.012 18802 4803 1 8 . 1 1 50 50 ARG C C 50 177.567 177.567 178.597 -1.030 18802 4804 1 8 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.038 0.188 18802 4805 1 8 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.267 -0.171 18802 4806 1 8 . 1 1 50 50 ARG H H 50 7.906 7.906 8.068 -0.162 18802 4807 1 8 . 1 1 51 51 ALA N N 51 119.411 119.411 123.141 -3.730 18802 4808 1 8 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.880 -0.076 18802 4809 1 8 . 1 1 51 51 ALA C C 51 178.740 178.740 179.012 -0.272 18802 4810 1 8 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.069 0.166 18802 4811 1 8 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.279 -0.020 18802 4812 1 8 . 1 1 51 51 ALA H H 51 7.956 7.956 8.270 -0.314 18802 4813 1 8 . 1 1 52 52 TYR N N 52 119.160 119.160 120.140 -0.980 18802 4814 1 8 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.215 -0.157 18802 4815 1 8 . 1 1 52 52 TYR C C 52 177.367 177.367 177.595 -0.228 18802 4816 1 8 . 1 1 52 52 TYR CA C 52 61.605 61.605 60.857 0.748 18802 4817 1 8 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.510 0.199 18802 4818 1 8 . 1 1 52 52 TYR H H 52 7.854 7.854 7.972 -0.118 18802 4819 1 8 . 1 1 53 53 ILE N N 53 119.173 119.173 119.596 -0.423 18802 4820 1 8 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.163 0.439 18802 4821 1 8 . 1 1 53 53 ILE C C 53 178.711 178.711 177.950 0.761 18802 4822 1 8 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.496 -1.308 18802 4823 1 8 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.920 0.394 18802 4824 1 8 . 1 1 53 53 ILE H H 53 7.809 7.809 8.198 -0.389 18802 4825 1 8 . 1 1 54 54 VAL N N 54 121.549 121.549 119.476 2.073 18802 4826 1 8 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.405 0.069 18802 4827 1 8 . 1 1 54 54 VAL C C 54 177.992 177.992 177.511 0.481 18802 4828 1 8 . 1 1 54 54 VAL CA C 54 66.995 66.995 66.710 0.285 18802 4829 1 8 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.309 -0.078 18802 4830 1 8 . 1 1 54 54 VAL H H 54 8.572 8.572 8.470 0.102 18802 4831 1 8 . 1 1 55 55 GLN N N 55 119.997 119.997 120.234 -0.237 18802 4832 1 8 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.841 -0.140 18802 4833 1 8 . 1 1 55 55 GLN C C 55 178.604 178.604 178.359 0.245 18802 4834 1 8 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.083 1.112 18802 4835 1 8 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.575 -0.433 18802 4836 1 8 . 1 1 55 55 GLN H H 55 8.183 8.183 7.863 0.320 18802 4837 1 8 . 1 1 56 56 LEU N N 56 119.605 119.605 118.644 0.961 18802 4838 1 8 . 1 1 56 56 LEU HA H 56 3.946 3.946 4.020 -0.074 18802 4839 1 8 . 1 1 56 56 LEU C C 56 180.439 180.439 179.351 1.088 18802 4840 1 8 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.564 0.671 18802 4841 1 8 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.407 0.442 18802 4842 1 8 . 1 1 56 56 LEU H H 56 7.586 7.586 7.599 -0.013 18802 4843 1 8 . 1 1 57 57 GLN N N 57 120.332 120.332 118.475 1.857 18802 4844 1 8 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.977 0.132 18802 4845 1 8 . 1 1 57 57 GLN C C 57 179.166 179.166 178.733 0.433 18802 4846 1 8 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.717 0.673 18802 4847 1 8 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.643 0.847 18802 4848 1 8 . 1 1 57 57 GLN H H 57 8.046 8.046 7.373 0.673 18802 4849 1 8 . 1 1 58 58 ILE N N 58 120.945 120.945 121.013 -0.068 18802 4850 1 8 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.584 -0.179 18802 4851 1 8 . 1 1 58 58 ILE C C 58 179.368 179.368 178.092 1.276 18802 4852 1 8 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.808 1.258 18802 4853 1 8 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.759 0.497 18802 4854 1 8 . 1 1 58 58 ILE H H 58 8.778 8.778 8.371 0.407 18802 4855 1 8 . 1 1 59 59 GLU N N 59 122.689 122.689 119.049 3.640 18802 4856 1 8 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.937 0.110 18802 4857 1 8 . 1 1 59 59 GLU C C 59 178.901 178.901 178.692 0.209 18802 4858 1 8 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.499 0.365 18802 4859 1 8 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.943 0.593 18802 4860 1 8 . 1 1 59 59 GLU H H 59 8.305 8.305 8.664 -0.359 18802 4861 1 8 . 1 1 60 60 ASP N N 60 121.505 121.505 121.430 0.075 18802 4862 1 8 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.375 0.062 18802 4863 1 8 . 1 1 60 60 ASP C C 60 178.312 178.312 178.623 -0.311 18802 4864 1 8 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.163 0.952 18802 4865 1 8 . 1 1 60 60 ASP CB C 60 42.248 42.248 41.081 1.167 18802 4866 1 8 . 1 1 60 60 ASP H H 60 8.142 8.142 7.734 0.408 18802 4867 1 8 . 1 1 61 61 LEU N N 61 118.666 118.666 119.991 -1.325 18802 4868 1 8 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.916 0.009 18802 4869 1 8 . 1 1 61 61 LEU C C 61 178.866 178.866 179.160 -0.294 18802 4870 1 8 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.131 0.171 18802 4871 1 8 . 1 1 61 61 LEU CB C 61 42.610 42.610 42.071 0.539 18802 4872 1 8 . 1 1 61 61 LEU H H 61 8.425 8.425 8.201 0.224 18802 4873 1 8 . 1 1 62 62 THR N N 62 115.786 115.786 114.955 0.831 18802 4874 1 8 . 1 1 62 62 THR HA H 62 3.771 3.771 3.945 -0.174 18802 4875 1 8 . 1 1 62 62 THR C C 62 175.988 175.988 176.400 -0.412 18802 4876 1 8 . 1 1 62 62 THR CA C 62 67.649 67.649 67.032 0.617 18802 4877 1 8 . 1 1 62 62 THR CB C 62 68.848 68.848 68.653 0.195 18802 4878 1 8 . 1 1 62 62 THR H H 62 8.340 8.340 8.523 -0.183 18802 4879 1 8 . 1 1 63 63 ARG N N 63 122.111 122.111 121.683 0.428 18802 4880 1 8 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.984 0.005 18802 4881 1 8 . 1 1 63 63 ARG C C 63 179.715 179.715 178.025 1.690 18802 4882 1 8 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.672 0.414 18802 4883 1 8 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.169 -0.358 18802 4884 1 8 . 1 1 63 63 ARG H H 63 8.024 8.024 8.401 -0.377 18802 4885 1 8 . 1 1 64 64 LYS N N 64 120.824 120.824 120.614 0.210 18802 4886 1 8 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.169 -0.315 18802 4887 1 8 . 1 1 64 64 LYS C C 64 178.707 178.707 179.058 -0.351 18802 4888 1 8 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.453 1.102 18802 4889 1 8 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.365 0.813 18802 4890 1 8 . 1 1 64 64 LYS H H 64 8.130 8.130 7.789 0.341 18802 4891 1 8 . 1 1 65 65 LEU N N 65 118.497 118.497 115.969 2.528 18802 4892 1 8 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.182 -0.213 18802 4893 1 8 . 1 1 65 65 LEU C C 65 179.023 179.023 179.141 -0.118 18802 4894 1 8 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.777 -0.496 18802 4895 1 8 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.269 1.121 18802 4896 1 8 . 1 1 65 65 LEU H H 65 8.108 8.108 8.151 -0.043 18802 4897 1 8 . 1 1 66 66 ARG N N 66 119.000 119.000 119.779 -0.779 18802 4898 1 8 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.240 -0.026 18802 4899 1 8 . 1 1 66 66 ARG C C 66 178.064 178.064 178.481 -0.417 18802 4900 1 8 . 1 1 66 66 ARG CA C 66 58.224 58.224 59.064 -0.840 18802 4901 1 8 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.677 -0.054 18802 4902 1 8 . 1 1 66 66 ARG H H 66 8.102 8.102 8.349 -0.247 18802 4903 1 8 . 1 1 67 67 THR N N 67 109.849 109.849 108.198 1.651 18802 4904 1 8 . 1 1 67 67 THR HA H 67 4.313 4.313 4.460 -0.147 18802 4905 1 8 . 1 1 67 67 THR C C 67 175.834 175.834 176.045 -0.211 18802 4906 1 8 . 1 1 67 67 THR CA C 67 62.681 62.681 62.306 0.375 18802 4907 1 8 . 1 1 67 67 THR CB C 67 70.768 70.768 69.979 0.789 18802 4908 1 8 . 1 1 67 67 THR H H 67 7.956 7.956 8.084 -0.128 18802 4909 1 8 . 1 1 68 68 GLY N N 68 110.673 110.673 110.803 -0.130 18802 4910 1 8 . 1 1 68 68 GLY C C 68 173.968 173.968 173.459 0.509 18802 4911 1 8 . 1 1 68 68 GLY CA C 68 46.030 46.030 44.830 1.200 18802 4912 1 8 . 1 1 68 68 GLY H H 68 8.016 8.016 8.206 -0.190 18802 4913 1 8 . 1 1 69 69 ASP N N 69 121.490 121.490 121.401 0.089 18802 4914 1 8 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.773 -0.118 18802 4915 1 8 . 1 1 69 69 ASP C C 69 175.983 175.983 176.522 -0.539 18802 4916 1 8 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.184 0.672 18802 4917 1 8 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.651 -0.005 18802 4918 1 8 . 1 1 69 69 ASP H H 69 8.048 8.048 7.700 0.348 18802 4919 1 8 . 1 1 70 70 LEU N N 70 120.838 120.838 125.308 -4.470 18802 4920 1 8 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.409 -0.270 18802 4921 1 8 . 1 1 70 70 LEU C C 70 177.530 177.530 178.177 -0.647 18802 4922 1 8 . 1 1 70 70 LEU CA C 70 55.280 55.280 55.279 0.001 18802 4923 1 8 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.789 -0.653 18802 4924 1 8 . 1 1 70 70 LEU H H 70 7.988 7.988 7.820 0.168 18802 4925 1 8 . 1 1 71 71 GLY N N 71 108.059 108.059 106.015 2.044 18802 4926 1 8 . 1 1 71 71 GLY C C 71 173.936 173.936 174.281 -0.345 18802 4927 1 8 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.432 0.126 18802 4928 1 8 . 1 1 71 71 GLY H H 71 8.341 8.341 8.444 -0.103 18802 4929 1 8 . 1 1 72 72 ILE N N 72 121.037 121.037 120.794 0.243 18802 4930 1 8 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.392 0.002 18802 4931 1 8 . 1 1 72 72 ILE C C 72 174.227 174.227 174.766 -0.539 18802 4932 1 8 . 1 1 72 72 ILE CA C 72 58.539 58.539 57.666 0.873 18802 4933 1 8 . 1 1 72 72 ILE CB C 72 38.810 38.810 37.147 1.663 18802 4934 1 8 . 1 1 72 72 ILE H H 72 7.793 7.793 7.861 -0.068 18802 4935 1 8 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.612 0.010 18802 4936 1 8 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.615 0.025 18802 4937 1 8 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.272 -0.168 18802 4938 1 8 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.457 -0.085 18802 4939 1 8 . 1 1 74 74 PRO C C 74 176.423 176.423 176.229 0.194 18802 4940 1 8 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.583 0.458 18802 4941 1 8 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.300 -0.270 18802 4942 1 8 . 1 1 75 75 ASN N N 75 119.550 119.550 121.511 -1.961 18802 4943 1 8 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.985 -0.056 18802 4944 1 8 . 1 1 75 75 ASN C C 75 174.066 174.066 175.136 -1.070 18802 4945 1 8 . 1 1 75 75 ASN CA C 75 51.151 51.151 51.354 -0.203 18802 4946 1 8 . 1 1 75 75 ASN CB C 75 38.924 38.924 38.573 0.351 18802 4947 1 8 . 1 1 75 75 ASN H H 75 8.422 8.422 8.386 0.036 18802 4948 1 8 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.360 -0.067 18802 4949 1 8 . 1 1 76 76 PRO C C 76 177.322 177.322 177.792 -0.470 18802 4950 1 8 . 1 1 76 76 PRO CA C 76 64.384 64.384 64.738 -0.354 18802 4951 1 8 . 1 1 76 76 PRO CB C 76 32.236 32.236 32.025 0.211 18802 4952 1 8 . 1 1 77 77 GLU N N 77 118.523 118.523 116.085 2.438 18802 4953 1 8 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.199 -0.023 18802 4954 1 8 . 1 1 77 77 GLU C C 77 176.403 176.403 177.981 -1.578 18802 4955 1 8 . 1 1 77 77 GLU CA C 77 56.977 56.977 57.996 -1.019 18802 4956 1 8 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.490 1.370 18802 4957 1 8 . 1 1 77 77 GLU H H 77 8.426 8.426 8.824 -0.398 18802 4958 1 8 . 1 1 78 78 ASP N N 78 120.581 120.581 120.300 0.281 18802 4959 1 8 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.414 0.129 18802 4960 1 8 . 1 1 78 78 ASP C C 78 176.085 176.085 177.022 -0.937 18802 4961 1 8 . 1 1 78 78 ASP CA C 78 54.544 54.544 56.416 -1.872 18802 4962 1 8 . 1 1 78 78 ASP CB C 78 41.239 41.239 41.001 0.238 18802 4963 1 8 . 1 1 78 78 ASP H H 78 7.941 7.941 7.668 0.273 18802 4964 1 8 . 1 1 79 79 ARG N N 79 121.043 121.043 118.112 2.931 18802 4965 1 8 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.271 0.054 18802 4966 1 8 . 1 1 79 79 ARG C C 79 176.123 176.123 176.911 -0.788 18802 4967 1 8 . 1 1 79 79 ARG CA C 79 55.927 55.927 56.416 -0.490 18802 4968 1 8 . 1 1 79 79 ARG CB C 79 30.650 30.650 29.663 0.987 18802 4969 1 8 . 1 1 79 79 ARG H H 79 8.066 8.066 8.134 -0.068 18802 4970 1 8 . 1 1 80 80 SER N N 80 118.338 118.338 118.598 -0.260 18802 4971 1 8 . 1 1 80 80 SER HA H 80 4.672 4.672 4.676 -0.004 18802 4972 1 8 . 1 1 80 80 SER C C 80 172.577 172.577 172.862 -0.285 18802 4973 1 8 . 1 1 80 80 SER CA C 80 56.564 56.564 57.452 -0.888 18802 4974 1 8 . 1 1 80 80 SER CB C 80 63.415 63.415 63.073 0.342 18802 4975 1 8 . 1 1 80 80 SER H H 80 8.281 8.281 7.637 0.644 18802 4976 1 8 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.430 -0.010 18802 4977 1 8 . 1 1 81 81 PRO C C 81 176.727 176.727 176.664 0.063 18802 4978 1 8 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.255 0.008 18802 4979 1 8 . 1 1 81 81 PRO CB C 81 32.052 32.052 31.976 0.076 18802 4980 1 8 . 1 1 82 82 SER N N 82 117.341 117.341 120.113 -2.772 18802 4981 1 8 . 1 1 82 82 SER HA H 82 4.693 4.693 4.738 -0.045 18802 4982 1 8 . 1 1 82 82 SER C C 82 172.803 172.803 173.048 -0.245 18802 4983 1 8 . 1 1 82 82 SER CA C 82 56.288 56.288 56.848 -0.560 18802 4984 1 8 . 1 1 82 82 SER CB C 82 63.500 63.500 63.157 0.343 18802 4985 1 8 . 1 1 82 82 SER H H 82 8.280 8.280 8.298 -0.018 18802 4986 1 8 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.379 -0.068 18802 4987 1 8 . 1 1 83 83 PRO C C 83 176.273 176.273 175.897 0.376 18802 4988 1 8 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.897 0.218 18802 4989 1 8 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.195 -0.096 18802 4990 1 8 . 1 1 84 84 GLU N N 84 122.213 122.213 121.617 0.596 18802 4991 1 8 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.350 0.143 18802 4992 1 8 . 1 1 84 84 GLU C C 84 174.546 174.546 175.374 -0.828 18802 4993 1 8 . 1 1 84 84 GLU CA C 84 54.529 54.529 54.833 -0.304 18802 4994 1 8 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.209 0.729 18802 4995 1 8 . 1 1 84 84 GLU H H 84 8.230 8.230 8.434 -0.204 18802 4996 1 8 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.424 -0.009 18802 4997 1 8 . 1 1 85 85 PRO C C 85 176.024 176.024 175.958 0.066 18802 4998 1 8 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.720 0.522 18802 4999 1 8 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.139 0.050 18802 5000 1 8 . 1 1 86 86 ILE N N 86 120.281 120.281 121.229 -0.948 18802 5001 1 8 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.169 -0.107 18802 5002 1 8 . 1 1 86 86 ILE C C 86 175.419 175.419 175.558 -0.139 18802 5003 1 8 . 1 1 86 86 ILE CA C 86 61.029 61.029 61.163 -0.134 18802 5004 1 8 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.737 -0.479 18802 5005 1 8 . 1 1 86 86 ILE H H 86 7.980 7.980 7.931 0.050 18802 5006 1 8 . 1 1 87 87 TYR N N 87 123.089 123.089 123.804 -0.715 18802 5007 1 8 . 1 1 87 87 TYR HA H 87 4.817 4.817 5.164 -0.347 18802 5008 1 8 . 1 1 87 87 TYR C C 87 175.920 175.920 176.267 -0.347 18802 5009 1 8 . 1 1 87 87 TYR CA C 87 57.197 57.197 57.069 0.128 18802 5010 1 8 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.388 0.790 18802 5011 1 8 . 1 1 87 87 TYR H H 87 8.194 8.194 8.558 -0.364 18802 5012 1 8 . 1 1 88 88 ASN N N 88 120.117 120.117 119.788 0.329 18802 5013 1 8 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.821 -0.076 18802 5014 1 8 . 1 1 88 88 ASN C C 88 176.275 176.275 176.986 -0.711 18802 5015 1 8 . 1 1 88 88 ASN CA C 88 52.286 52.286 52.166 0.120 18802 5016 1 8 . 1 1 88 88 ASN CB C 88 39.082 39.082 40.434 -1.352 18802 5017 1 8 . 1 1 88 88 ASN H H 88 8.386 8.386 8.437 -0.051 18802 5018 1 8 . 1 1 89 89 SER N N 89 115.826 115.826 116.973 -1.147 18802 5019 1 8 . 1 1 89 89 SER HA H 89 4.248 4.248 4.291 -0.043 18802 5020 1 8 . 1 1 89 89 SER C C 89 175.066 175.066 174.741 0.325 18802 5021 1 8 . 1 1 89 89 SER CA C 89 60.012 60.012 60.837 -0.824 18802 5022 1 8 . 1 1 89 89 SER CB C 89 63.400 63.400 62.678 0.722 18802 5023 1 8 . 1 1 89 89 SER H H 89 8.371 8.371 8.723 -0.352 18802 5024 1 8 . 1 1 90 90 GLU N N 90 121.062 121.062 118.755 2.307 18802 5025 1 8 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.395 -0.117 18802 5026 1 8 . 1 1 90 90 GLU C C 90 176.936 176.936 176.978 -0.042 18802 5027 1 8 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.061 0.720 18802 5028 1 8 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.190 0.873 18802 5029 1 8 . 1 1 90 90 GLU H H 90 8.018 8.018 7.928 0.090 18802 5030 1 8 . 1 1 91 91 GLY N N 91 108.499 108.499 109.418 -0.919 18802 5031 1 8 . 1 1 91 91 GLY C C 91 174.115 174.115 174.159 -0.044 18802 5032 1 8 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.454 0.290 18802 5033 1 8 . 1 1 91 91 GLY H H 91 8.199 8.199 8.298 -0.099 18802 5034 1 8 . 1 1 92 92 LYS N N 92 120.638 120.638 121.157 -0.519 18802 5035 1 8 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.378 -0.069 18802 5036 1 8 . 1 1 92 92 LYS C C 92 176.453 176.453 175.267 1.186 18802 5037 1 8 . 1 1 92 92 LYS CA C 92 55.856 55.856 55.825 0.031 18802 5038 1 8 . 1 1 92 92 LYS CB C 92 33.109 33.109 33.674 -0.565 18802 5039 1 8 . 1 1 92 92 LYS H H 92 7.956 7.956 7.667 0.289 18802 5040 1 8 . 1 1 93 93 ARG N N 93 122.999 122.999 125.775 -2.776 18802 5041 1 8 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.295 -0.104 18802 5042 1 8 . 1 1 93 93 ARG C C 93 176.325 176.325 174.545 1.780 18802 5043 1 8 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.337 1.045 18802 5044 1 8 . 1 1 93 93 ARG CB C 93 30.656 30.656 32.009 -1.353 18802 5045 1 8 . 1 1 93 93 ARG H H 93 8.403 8.403 8.684 -0.281 18802 5046 1 8 . 1 1 94 94 LEU N N 94 124.100 124.100 123.742 0.358 18802 5047 1 8 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.776 -0.513 18802 5048 1 8 . 1 1 94 94 LEU C C 94 176.993 176.993 175.063 1.930 18802 5049 1 8 . 1 1 94 94 LEU CA C 94 55.034 55.034 52.793 2.241 18802 5050 1 8 . 1 1 94 94 LEU CB C 94 42.941 42.941 44.002 -1.061 18802 5051 1 8 . 1 1 94 94 LEU H H 94 8.283 8.283 8.390 -0.107 18802 5052 1 8 . 1 1 95 95 ASN N N 95 119.593 119.593 118.589 1.004 18802 5053 1 8 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.968 -0.221 18802 5054 1 8 . 1 1 95 95 ASN C C 95 175.598 175.598 175.578 0.020 18802 5055 1 8 . 1 1 95 95 ASN CA C 95 52.680 52.680 52.196 0.484 18802 5056 1 8 . 1 1 95 95 ASN CB C 95 38.723 38.723 40.436 -1.713 18802 5057 1 8 . 1 1 95 95 ASN H H 95 8.460 8.460 8.282 0.178 18802 5058 1 8 . 1 1 96 96 THR N N 96 114.100 114.100 121.143 -7.043 18802 5059 1 8 . 1 1 96 96 THR HA H 96 4.226 4.226 4.047 0.179 18802 5060 1 8 . 1 1 96 96 THR C C 96 175.186 175.186 176.228 -1.042 18802 5061 1 8 . 1 1 96 96 THR CA C 96 62.203 62.203 66.271 -4.068 18802 5062 1 8 . 1 1 96 96 THR CB C 96 69.880 69.880 69.168 0.712 18802 5063 1 8 . 1 1 96 96 THR H H 96 8.031 8.031 8.999 -0.968 18802 5064 1 8 . 1 1 97 97 ARG N N 97 122.587 122.587 120.818 1.769 18802 5065 1 8 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.047 0.066 18802 5066 1 8 . 1 1 97 97 ARG C C 97 177.938 177.938 178.710 -0.772 18802 5067 1 8 . 1 1 97 97 ARG CA C 97 58.412 58.412 59.472 -1.060 18802 5068 1 8 . 1 1 97 97 ARG CB C 97 30.297 30.297 30.062 0.235 18802 5069 1 8 . 1 1 97 97 ARG H H 97 8.502 8.502 7.865 0.637 18802 5070 1 8 . 1 1 98 98 GLU N N 98 121.548 121.548 119.690 1.858 18802 5071 1 8 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.068 -0.051 18802 5072 1 8 . 1 1 98 98 GLU C C 98 177.113 177.113 178.922 -1.809 18802 5073 1 8 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.248 -0.568 18802 5074 1 8 . 1 1 98 98 GLU CB C 98 29.666 29.666 29.298 0.368 18802 5075 1 8 . 1 1 98 98 GLU H H 98 8.517 8.517 8.688 -0.171 18802 5076 1 8 . 1 1 99 99 PHE N N 99 121.388 121.388 121.486 -0.098 18802 5077 1 8 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.129 0.193 18802 5078 1 8 . 1 1 99 99 PHE C C 99 177.070 177.070 177.284 -0.214 18802 5079 1 8 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.151 -1.076 18802 5080 1 8 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.095 0.391 18802 5081 1 8 . 1 1 99 99 PHE H H 99 8.176 8.176 8.748 -0.572 18802 5082 1 8 . 1 1 100 100 ARG N N 100 120.211 120.211 119.189 1.022 18802 5083 1 8 . 1 1 100 100 ARG C C 100 178.159 178.159 178.441 -0.282 18802 5084 1 8 . 1 1 100 100 ARG CA C 100 58.533 58.533 60.141 -1.608 18802 5085 1 8 . 1 1 100 100 ARG CB C 100 30.588 30.588 30.224 0.364 18802 5086 1 8 . 1 1 100 100 ARG H H 100 8.377 8.377 8.592 -0.215 18802 5087 1 8 . 1 1 101 101 THR N N 101 115.416 115.416 115.720 -0.304 18802 5088 1 8 . 1 1 101 101 THR HA H 101 4.022 4.022 4.049 -0.027 18802 5089 1 8 . 1 1 101 101 THR C C 101 175.301 175.301 176.649 -1.348 18802 5090 1 8 . 1 1 101 101 THR CA C 101 65.141 65.141 67.105 -1.964 18802 5091 1 8 . 1 1 101 101 THR CB C 101 69.305 69.305 68.463 0.842 18802 5092 1 8 . 1 1 101 101 THR H H 101 7.992 7.992 7.759 0.233 18802 5093 1 8 . 1 1 102 102 ARG N N 102 122.212 122.212 120.728 1.484 18802 5094 1 8 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.887 0.420 18802 5095 1 8 . 1 1 102 102 ARG C C 102 177.644 177.644 178.353 -0.709 18802 5096 1 8 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.877 0.734 18802 5097 1 8 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.025 -0.217 18802 5098 1 8 . 1 1 102 102 ARG H H 102 8.369 8.369 8.602 -0.233 18802 5099 1 8 . 1 1 103 103 LYS N N 103 117.591 117.591 120.037 -2.446 18802 5100 1 8 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.930 0.030 18802 5101 1 8 . 1 1 103 103 LYS C C 103 178.913 178.913 178.651 0.262 18802 5102 1 8 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.465 0.585 18802 5103 1 8 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.480 0.661 18802 5104 1 8 . 1 1 103 103 LYS H H 103 7.941 7.941 8.292 -0.351 18802 5105 1 8 . 1 1 104 104 LYS N N 104 119.769 119.769 119.899 -0.130 18802 5106 1 8 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.043 0.103 18802 5107 1 8 . 1 1 104 104 LYS C C 104 179.377 179.377 178.800 0.577 18802 5108 1 8 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.678 0.301 18802 5109 1 8 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.828 0.363 18802 5110 1 8 . 1 1 104 104 LYS H H 104 7.615 7.615 7.577 0.038 18802 5111 1 8 . 1 1 105 105 LEU N N 105 120.500 120.500 119.502 0.998 18802 5112 1 8 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.941 0.176 18802 5113 1 8 . 1 1 105 105 LEU C C 105 179.481 179.481 178.944 0.537 18802 5114 1 8 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.137 0.124 18802 5115 1 8 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.633 0.371 18802 5116 1 8 . 1 1 105 105 LEU H H 105 8.057 8.057 8.001 0.056 18802 5117 1 8 . 1 1 106 106 GLU N N 106 118.803 118.803 119.248 -0.445 18802 5118 1 8 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.945 0.044 18802 5119 1 8 . 1 1 106 106 GLU C C 106 180.577 180.577 179.340 1.237 18802 5120 1 8 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.903 -0.093 18802 5121 1 8 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.286 0.723 18802 5122 1 8 . 1 1 106 106 GLU H H 106 8.652 8.652 8.412 0.240 18802 5123 1 8 . 1 1 107 107 GLU N N 107 122.396 122.396 118.985 3.411 18802 5124 1 8 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.299 -0.193 18802 5125 1 8 . 1 1 107 107 GLU C C 107 178.457 178.457 179.318 -0.861 18802 5126 1 8 . 1 1 107 107 GLU CA C 107 59.826 59.826 58.883 0.943 18802 5127 1 8 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.236 0.326 18802 5128 1 8 . 1 1 107 107 GLU H H 107 8.281 8.281 8.398 -0.117 18802 5129 1 8 . 1 1 108 108 GLU N N 108 120.976 120.976 119.592 1.384 18802 5130 1 8 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.056 0.036 18802 5131 1 8 . 1 1 108 108 GLU C C 108 179.343 179.343 179.045 0.298 18802 5132 1 8 . 1 1 108 108 GLU CA C 108 59.696 59.696 58.992 0.704 18802 5133 1 8 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.257 0.313 18802 5134 1 8 . 1 1 108 108 GLU H H 108 8.321 8.321 8.210 0.111 18802 5135 1 8 . 1 1 109 109 ARG N N 109 118.559 118.559 120.302 -1.743 18802 5136 1 8 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.930 -0.138 18802 5137 1 8 . 1 1 109 109 ARG C C 109 177.178 177.178 178.210 -1.032 18802 5138 1 8 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.874 0.609 18802 5139 1 8 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.260 -0.111 18802 5140 1 8 . 1 1 109 109 ARG H H 109 8.594 8.594 8.521 0.073 18802 5141 1 8 . 1 1 110 110 HIS N N 110 119.632 119.632 118.818 0.814 18802 5142 1 8 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.150 0.191 18802 5143 1 8 . 1 1 110 110 HIS C C 110 177.578 177.578 177.219 0.359 18802 5144 1 8 . 1 1 110 110 HIS CA C 110 60.617 60.617 58.971 1.646 18802 5145 1 8 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.045 0.464 18802 5146 1 8 . 1 1 110 110 HIS H H 110 8.465 8.465 8.537 -0.072 18802 5147 1 8 . 1 1 111 111 ASN N N 111 119.587 119.587 117.956 1.631 18802 5148 1 8 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.282 -0.004 18802 5149 1 8 . 1 1 111 111 ASN C C 111 178.630 178.630 177.731 0.899 18802 5150 1 8 . 1 1 111 111 ASN CA C 111 56.281 56.281 56.258 0.022 18802 5151 1 8 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.622 -0.927 18802 5152 1 8 . 1 1 111 111 ASN H H 111 8.323 8.323 8.340 -0.017 18802 5153 1 8 . 1 1 112 112 LEU N N 112 122.320 122.320 120.733 1.587 18802 5154 1 8 . 1 1 112 112 LEU HA H 112 4.116 4.116 4.009 0.107 18802 5155 1 8 . 1 1 112 112 LEU C C 112 178.539 178.539 178.897 -0.358 18802 5156 1 8 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.709 0.270 18802 5157 1 8 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.861 0.733 18802 5158 1 8 . 1 1 112 112 LEU H H 112 7.966 7.966 8.013 -0.047 18802 5159 1 8 . 1 1 113 113 ILE N N 113 121.495 121.495 120.338 1.157 18802 5160 1 8 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.781 -0.545 18802 5161 1 8 . 1 1 113 113 ILE C C 113 176.959 176.959 178.530 -1.571 18802 5162 1 8 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.575 1.479 18802 5163 1 8 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.065 1.538 18802 5164 1 8 . 1 1 113 113 ILE H H 113 8.472 8.472 8.605 -0.133 18802 5165 1 8 . 1 1 114 114 THR N N 114 115.066 115.066 114.426 0.640 18802 5166 1 8 . 1 1 114 114 THR HA H 114 3.718 3.718 4.028 -0.310 18802 5167 1 8 . 1 1 114 114 THR C C 114 176.559 176.559 176.949 -0.390 18802 5168 1 8 . 1 1 114 114 THR CA C 114 66.700 66.700 67.042 -0.342 18802 5169 1 8 . 1 1 114 114 THR CB C 114 68.759 68.759 68.474 0.285 18802 5170 1 8 . 1 1 114 114 THR H H 114 8.075 8.075 8.342 -0.267 18802 5171 1 8 . 1 1 115 115 GLU N N 115 123.259 123.259 121.846 1.413 18802 5172 1 8 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.081 -0.149 18802 5173 1 8 . 1 1 115 115 GLU C C 115 178.191 178.191 178.498 -0.307 18802 5174 1 8 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.428 -0.088 18802 5175 1 8 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.540 -0.141 18802 5176 1 8 . 1 1 115 115 GLU H H 115 7.368 7.368 7.599 -0.231 18802 5177 1 8 . 1 1 116 116 MET N N 116 119.844 119.844 120.065 -0.221 18802 5178 1 8 . 1 1 116 116 MET HA H 116 4.014 4.014 4.009 0.005 18802 5179 1 8 . 1 1 116 116 MET C C 116 177.888 177.888 178.042 -0.154 18802 5180 1 8 . 1 1 116 116 MET CA C 116 57.183 57.183 59.214 -2.031 18802 5181 1 8 . 1 1 116 116 MET CB C 116 32.126 32.126 32.506 -0.380 18802 5182 1 8 . 1 1 116 116 MET H H 116 8.373 8.373 8.535 -0.162 18802 5183 1 8 . 1 1 117 117 VAL N N 117 117.572 117.572 119.941 -2.369 18802 5184 1 8 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.166 -0.270 18802 5185 1 8 . 1 1 117 117 VAL C C 117 177.567 177.567 177.917 -0.350 18802 5186 1 8 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.339 -1.469 18802 5187 1 8 . 1 1 117 117 VAL CB C 117 32.002 32.002 30.937 1.065 18802 5188 1 8 . 1 1 117 117 VAL H H 117 8.279 8.279 8.697 -0.418 18802 5189 1 8 . 1 1 118 118 ALA N N 118 120.560 120.560 121.701 -1.141 18802 5190 1 8 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.184 -0.048 18802 5191 1 8 . 1 1 118 118 ALA C C 118 179.595 179.595 179.611 -0.016 18802 5192 1 8 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.733 -0.630 18802 5193 1 8 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.696 -0.446 18802 5194 1 8 . 1 1 118 118 ALA H H 118 7.074 7.074 7.417 -0.343 18802 5195 1 8 . 1 1 119 119 LEU N N 119 117.987 117.987 117.346 0.641 18802 5196 1 8 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.114 0.026 18802 5197 1 8 . 1 1 119 119 LEU C C 119 177.863 177.863 177.509 0.354 18802 5198 1 8 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.755 -0.083 18802 5199 1 8 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.708 0.526 18802 5200 1 8 . 1 1 119 119 LEU H H 119 7.525 7.525 7.994 -0.469 18802 5201 1 8 . 1 1 120 120 ASN N N 120 115.338 115.338 116.119 -0.781 18802 5202 1 8 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.034 -0.016 18802 5203 1 8 . 1 1 120 120 ASN C C 120 172.510 172.510 174.206 -1.696 18802 5204 1 8 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.043 0.058 18802 5205 1 8 . 1 1 120 120 ASN CB C 120 39.305 39.305 39.638 -0.333 18802 5206 1 8 . 1 1 120 120 ASN H H 120 8.467 8.467 8.153 0.314 18802 5207 1 8 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.492 0.164 18802 5208 1 8 . 1 1 121 121 PRO C C 121 177.020 177.020 176.807 0.213 18802 5209 1 8 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.441 -0.143 18802 5210 1 8 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.288 0.011 18802 5211 1 8 . 1 1 122 122 ASP N N 122 115.744 115.744 117.758 -2.014 18802 5212 1 8 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.700 -0.031 18802 5213 1 8 . 1 1 122 122 ASP C C 122 176.004 176.004 175.500 0.504 18802 5214 1 8 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.681 0.685 18802 5215 1 8 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.537 -0.213 18802 5216 1 8 . 1 1 122 122 ASP H H 122 7.600 7.600 7.961 -0.361 18802 5217 1 8 . 1 1 123 123 PHE N N 123 122.722 122.722 121.417 1.305 18802 5218 1 8 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.517 -0.382 18802 5219 1 8 . 1 1 123 123 PHE C C 123 173.954 173.954 174.552 -0.598 18802 5220 1 8 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.416 0.577 18802 5221 1 8 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.543 0.053 18802 5222 1 8 . 1 1 123 123 PHE H H 123 7.940 7.940 7.437 0.503 18802 5223 1 8 . 1 1 124 124 LYS N N 124 129.400 129.400 129.755 -0.355 18802 5224 1 8 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.419 0.140 18802 5225 1 8 . 1 1 124 124 LYS C C 124 172.622 172.622 174.138 -1.516 18802 5226 1 8 . 1 1 124 124 LYS CA C 124 51.815 51.815 52.520 -0.705 18802 5227 1 8 . 1 1 124 124 LYS CB C 124 32.581 32.581 32.093 0.489 18802 5228 1 8 . 1 1 124 124 LYS H H 124 7.602 7.602 8.377 -0.775 18802 5229 1 8 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.151 -0.062 18802 5230 1 8 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.372 -0.376 18802 5231 1 8 . 1 1 125 125 PRO CB C 125 31.067 31.067 31.317 -0.250 18802 5232 1 8 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.430 -0.056 18802 5233 1 8 . 1 1 126 126 PRO C C 126 177.630 177.630 177.757 -0.127 18802 5234 1 8 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.837 -0.024 18802 5235 1 8 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.210 0.111 18802 5236 1 8 . 1 1 127 127 ALA N N 127 123.830 123.830 123.103 0.727 18802 5237 1 8 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.126 -0.068 18802 5238 1 8 . 1 1 127 127 ALA C C 127 177.641 177.641 178.099 -0.458 18802 5239 1 8 . 1 1 127 127 ALA CA C 127 54.602 54.602 53.976 0.626 18802 5240 1 8 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.774 0.075 18802 5241 1 8 . 1 1 127 127 ALA H H 127 8.630 8.630 8.501 0.129 18802 5242 1 8 . 1 1 128 128 ASP N N 128 112.924 112.924 116.682 -3.758 18802 5243 1 8 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.546 -0.095 18802 5244 1 8 . 1 1 128 128 ASP C C 128 175.724 175.724 175.647 0.077 18802 5245 1 8 . 1 1 128 128 ASP CA C 128 53.604 53.604 54.340 -0.736 18802 5246 1 8 . 1 1 128 128 ASP CB C 128 40.418 40.418 41.220 -0.802 18802 5247 1 8 . 1 1 128 128 ASP H H 128 8.335 8.335 8.096 0.239 18802 5248 1 8 . 1 1 129 129 TYR N N 129 121.114 121.114 122.329 -1.215 18802 5249 1 8 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.365 -0.003 18802 5250 1 8 . 1 1 129 129 TYR C C 129 174.190 174.190 174.639 -0.449 18802 5251 1 8 . 1 1 129 129 TYR CA C 129 58.412 58.412 58.727 -0.315 18802 5252 1 8 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.388 0.671 18802 5253 1 8 . 1 1 129 129 TYR H H 129 7.600 7.600 7.548 0.052 18802 5254 1 8 . 1 1 130 130 LYS N N 130 129.875 129.875 129.082 0.793 18802 5255 1 8 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.453 -0.135 18802 5256 1 8 . 1 1 130 130 LYS C C 130 172.314 172.314 173.968 -1.654 18802 5257 1 8 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.886 0.684 18802 5258 1 8 . 1 1 130 130 LYS CB C 130 33.663 33.663 32.452 1.211 18802 5259 1 8 . 1 1 130 130 LYS H H 130 7.695 7.695 8.257 -0.562 18802 5260 1 8 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.049 0.228 18802 5261 1 8 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.270 -0.212 18802 5262 1 8 . 1 1 131 131 PRO CB C 131 30.852 30.852 31.077 -0.225 18802 5263 1 8 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.327 -0.083 18802 5264 1 8 . 1 1 132 132 PRO C C 132 176.459 176.459 176.564 -0.105 18802 5265 1 8 . 1 1 132 132 PRO CA C 132 62.874 62.874 62.741 0.133 18802 5266 1 8 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.307 -0.260 18802 5267 1 8 . 1 1 133 133 ALA N N 133 124.170 124.170 127.819 -3.649 18802 5268 1 8 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.508 -0.258 18802 5269 1 8 . 1 1 133 133 ALA C C 133 177.870 177.870 177.144 0.726 18802 5270 1 8 . 1 1 133 133 ALA CA C 133 52.508 52.508 51.140 1.368 18802 5271 1 8 . 1 1 133 133 ALA CB C 133 19.303 19.303 18.515 0.788 18802 5272 1 8 . 1 1 133 133 ALA H H 133 8.311 8.311 8.234 0.077 18802 5273 1 8 . 1 1 134 134 THR N N 134 113.807 113.807 115.878 -2.071 18802 5274 1 8 . 1 1 134 134 THR HA H 134 4.228 4.228 4.198 0.030 18802 5275 1 8 . 1 1 134 134 THR C C 134 174.282 174.282 174.285 -0.003 18802 5276 1 8 . 1 1 134 134 THR CA C 134 62.127 62.127 62.324 -0.197 18802 5277 1 8 . 1 1 134 134 THR CB C 134 69.870 69.870 68.614 1.256 18802 5278 1 8 . 1 1 134 134 THR H H 134 8.019 8.019 8.282 -0.263 18802 5279 1 8 . 1 1 135 135 ARG N N 135 124.165 124.165 121.547 2.618 18802 5280 1 8 . 1 1 135 135 ARG HA H 135 4.349 4.349 3.990 0.359 18802 5281 1 8 . 1 1 135 135 ARG C C 135 176.217 176.217 175.074 1.143 18802 5282 1 8 . 1 1 135 135 ARG CA C 135 55.993 55.993 56.340 -0.347 18802 5283 1 8 . 1 1 135 135 ARG CB C 135 30.992 30.992 29.947 1.045 18802 5284 1 8 . 1 1 135 135 ARG H H 135 8.300 8.300 8.165 0.135 18802 5285 1 8 . 1 1 136 136 VAL N N 136 122.157 122.157 124.432 -2.275 18802 5286 1 8 . 1 1 136 136 VAL HA H 136 4.070 4.070 3.872 0.198 18802 5287 1 8 . 1 1 136 136 VAL C C 136 176.180 176.180 175.486 0.694 18802 5288 1 8 . 1 1 136 136 VAL CA C 136 61.937 61.937 63.351 -1.414 18802 5289 1 8 . 1 1 136 136 VAL CB C 136 32.747 32.747 31.748 0.999 18802 5290 1 8 . 1 1 136 136 VAL H H 136 8.233 8.233 8.407 -0.174 18802 5291 1 8 . 1 1 137 137 SER N N 137 118.837 118.837 121.177 -2.340 18802 5292 1 8 . 1 1 137 137 SER HA H 137 4.416 4.416 4.238 0.178 18802 5293 1 8 . 1 1 137 137 SER C C 137 174.258 174.258 173.861 0.397 18802 5294 1 8 . 1 1 137 137 SER CA C 137 58.341 58.341 59.434 -1.093 18802 5295 1 8 . 1 1 137 137 SER CB C 137 63.900 63.900 62.127 1.773 18802 5296 1 8 . 1 1 137 137 SER H H 137 8.264 8.264 8.524 -0.260 18802 5297 1 8 . 1 1 138 138 ASP N N 138 122.871 122.871 122.470 0.401 18802 5298 1 8 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.577 -0.040 18802 5299 1 8 . 1 1 138 138 ASP C C 138 176.053 176.053 177.358 -1.305 18802 5300 1 8 . 1 1 138 138 ASP CA C 138 54.489 54.489 56.220 -1.731 18802 5301 1 8 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.359 -0.211 18802 5302 1 8 . 1 1 138 138 ASP H H 138 8.249 8.249 8.754 -0.505 18802 5303 1 8 . 1 1 139 139 LYS N N 139 120.944 120.944 118.713 2.231 18802 5304 1 8 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.318 -0.058 18802 5305 1 8 . 1 1 139 139 LYS C C 139 176.343 176.343 175.474 0.869 18802 5306 1 8 . 1 1 139 139 LYS CA C 139 56.261 56.261 56.583 -0.322 18802 5307 1 8 . 1 1 139 139 LYS CB C 139 33.077 33.077 32.786 0.291 18802 5308 1 8 . 1 1 139 139 LYS H H 139 8.084 8.084 8.245 -0.161 18802 5309 1 8 . 1 1 140 140 VAL N N 140 121.670 121.670 120.125 1.545 18802 5310 1 8 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.186 -0.174 18802 5311 1 8 . 1 1 140 140 VAL C C 140 175.842 175.842 174.999 0.843 18802 5312 1 8 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.726 0.716 18802 5313 1 8 . 1 1 140 140 VAL CB C 140 32.867 32.867 33.805 -0.938 18802 5314 1 8 . 1 1 140 140 VAL H H 140 8.025 8.025 7.522 0.503 18802 5315 1 8 . 1 1 141 141 MET N N 141 124.839 124.839 125.262 -0.423 18802 5316 1 8 . 1 1 141 141 MET HA H 141 4.453 4.453 4.698 -0.245 18802 5317 1 8 . 1 1 141 141 MET C C 141 175.562 175.562 175.542 0.020 18802 5318 1 8 . 1 1 141 141 MET CA C 141 55.349 55.349 54.377 0.972 18802 5319 1 8 . 1 1 141 141 MET CB C 141 32.993 32.993 33.342 -0.349 18802 5320 1 8 . 1 1 141 141 MET H H 141 8.364 8.364 8.355 0.009 18802 5321 1 8 . 1 1 142 142 ILE N N 142 124.515 124.515 130.419 -5.904 18802 5322 1 8 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.499 -0.071 18802 5323 1 8 . 1 1 142 142 ILE C C 142 174.331 174.331 174.320 0.011 18802 5324 1 8 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.600 -0.196 18802 5325 1 8 . 1 1 142 142 ILE CB C 142 38.755 38.755 38.445 0.310 18802 5326 1 8 . 1 1 142 142 ILE H H 142 8.093 8.093 8.461 -0.368 18802 5327 1 8 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.639 -0.289 18802 5328 1 8 . 1 1 143 143 PRO C C 143 176.623 176.623 176.524 0.099 18802 5329 1 8 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.086 1.329 18802 5330 1 8 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.408 -0.175 18802 5331 1 8 . 1 1 144 144 GLN N N 144 121.557 121.557 121.372 0.185 18802 5332 1 8 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.452 -0.146 18802 5333 1 8 . 1 1 144 144 GLN C C 144 174.751 174.751 175.544 -0.793 18802 5334 1 8 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.977 -0.306 18802 5335 1 8 . 1 1 144 144 GLN CB C 144 30.118 30.118 29.146 0.972 18802 5336 1 8 . 1 1 144 144 GLN H H 144 8.392 8.392 8.507 -0.115 18802 5337 1 9 . 1 1 26 26 ALA N N 26 124.085 124.085 122.846 1.239 18802 5338 1 9 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.793 -0.501 18802 5339 1 9 . 1 1 26 26 ALA C C 26 177.101 177.101 178.310 -1.209 18802 5340 1 9 . 1 1 26 26 ALA CA C 26 52.921 52.921 51.218 1.702 18802 5341 1 9 . 1 1 26 26 ALA CB C 26 19.426 19.426 20.370 -0.944 18802 5342 1 9 . 1 1 26 26 ALA H H 26 8.498 8.498 8.362 0.136 18802 5343 1 9 . 1 1 27 27 MET N N 27 119.630 119.630 115.671 3.959 18802 5344 1 9 . 1 1 27 27 MET HA H 27 4.391 4.391 4.118 0.273 18802 5345 1 9 . 1 1 27 27 MET C C 27 176.296 176.296 175.718 0.578 18802 5346 1 9 . 1 1 27 27 MET CA C 27 55.834 55.834 57.562 -1.728 18802 5347 1 9 . 1 1 27 27 MET CB C 27 32.663 32.663 32.043 0.620 18802 5348 1 9 . 1 1 27 27 MET H H 27 8.441 8.441 8.768 -0.327 18802 5349 1 9 . 1 1 28 28 GLU N N 28 122.376 122.376 120.011 2.365 18802 5350 1 9 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.510 -0.296 18802 5351 1 9 . 1 1 28 28 GLU C C 28 176.310 176.310 174.653 1.657 18802 5352 1 9 . 1 1 28 28 GLU CA C 28 56.819 56.819 55.556 1.263 18802 5353 1 9 . 1 1 28 28 GLU CB C 28 30.252 30.252 31.701 -1.449 18802 5354 1 9 . 1 1 28 28 GLU H H 28 8.336 8.336 7.983 0.353 18802 5355 1 9 . 1 1 29 29 GLN N N 29 122.010 122.010 123.441 -1.431 18802 5356 1 9 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.521 -0.230 18802 5357 1 9 . 1 1 29 29 GLN C C 29 175.765 175.765 175.821 -0.056 18802 5358 1 9 . 1 1 29 29 GLN CA C 29 55.839 55.839 54.946 0.893 18802 5359 1 9 . 1 1 29 29 GLN CB C 29 29.559 29.559 28.700 0.859 18802 5360 1 9 . 1 1 29 29 GLN H H 29 8.347 8.347 8.514 -0.167 18802 5361 1 9 . 1 1 30 30 LYS N N 30 123.090 123.090 128.622 -5.532 18802 5362 1 9 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.289 0.047 18802 5363 1 9 . 1 1 30 30 LYS C C 30 176.474 176.474 176.056 0.418 18802 5364 1 9 . 1 1 30 30 LYS CA C 30 56.391 56.391 57.038 -0.647 18802 5365 1 9 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.878 0.115 18802 5366 1 9 . 1 1 30 30 LYS H H 30 8.327 8.327 8.465 -0.138 18802 5367 1 9 . 1 1 31 31 THR N N 31 116.800 116.800 118.226 -1.426 18802 5368 1 9 . 1 1 31 31 THR HA H 31 4.273 4.273 4.374 -0.101 18802 5369 1 9 . 1 1 31 31 THR C C 31 174.071 174.071 174.132 -0.061 18802 5370 1 9 . 1 1 31 31 THR CA C 31 62.103 62.103 62.155 -0.052 18802 5371 1 9 . 1 1 31 31 THR CB C 31 69.899 69.899 69.577 0.322 18802 5372 1 9 . 1 1 31 31 THR H H 31 8.160 8.160 8.264 -0.104 18802 5373 1 9 . 1 1 32 32 VAL N N 32 124.108 124.108 126.439 -2.331 18802 5374 1 9 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.218 -0.151 18802 5375 1 9 . 1 1 32 32 VAL C C 32 175.573 175.573 174.908 0.665 18802 5376 1 9 . 1 1 32 32 VAL CA C 32 62.344 62.344 61.972 0.372 18802 5377 1 9 . 1 1 32 32 VAL CB C 32 32.912 32.912 32.952 -0.040 18802 5378 1 9 . 1 1 32 32 VAL H H 32 8.192 8.192 8.554 -0.362 18802 5379 1 9 . 1 1 33 33 ILE N N 33 127.371 127.371 131.329 -3.958 18802 5380 1 9 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.472 -0.048 18802 5381 1 9 . 1 1 33 33 ILE C C 33 174.335 174.335 174.197 0.138 18802 5382 1 9 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.515 0.879 18802 5383 1 9 . 1 1 33 33 ILE CB C 33 38.799 38.799 38.539 0.260 18802 5384 1 9 . 1 1 33 33 ILE H H 33 8.275 8.275 8.374 -0.099 18802 5385 1 9 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.482 -0.179 18802 5386 1 9 . 1 1 34 34 PRO C C 34 177.261 177.261 177.747 -0.486 18802 5387 1 9 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.214 0.458 18802 5388 1 9 . 1 1 34 34 PRO CB C 34 32.177 32.177 31.873 0.303 18802 5389 1 9 . 1 1 35 35 GLY N N 35 109.540 109.540 112.447 -2.907 18802 5390 1 9 . 1 1 35 35 GLY C C 35 173.906 173.906 174.318 -0.412 18802 5391 1 9 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.725 0.545 18802 5392 1 9 . 1 1 35 35 GLY H H 35 8.376 8.376 8.550 -0.174 18802 5393 1 9 . 1 1 36 36 MET N N 36 120.834 120.834 122.140 -1.306 18802 5394 1 9 . 1 1 36 36 MET HA H 36 4.780 4.780 4.709 0.071 18802 5395 1 9 . 1 1 36 36 MET C C 36 174.235 174.235 174.559 -0.324 18802 5396 1 9 . 1 1 36 36 MET CA C 36 53.258 53.258 52.954 0.304 18802 5397 1 9 . 1 1 36 36 MET CB C 36 32.734 32.734 32.650 0.084 18802 5398 1 9 . 1 1 36 36 MET H H 36 7.986 7.986 7.627 0.359 18802 5399 1 9 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.416 0.046 18802 5400 1 9 . 1 1 37 37 PRO C C 37 176.736 176.736 175.954 0.782 18802 5401 1 9 . 1 1 37 37 PRO CA C 37 63.258 63.258 63.395 -0.137 18802 5402 1 9 . 1 1 37 37 PRO CB C 37 32.200 32.200 32.193 0.007 18802 5403 1 9 . 1 1 38 38 THR N N 38 115.642 115.642 116.501 -0.859 18802 5404 1 9 . 1 1 38 38 THR HA H 38 4.226 4.226 4.550 -0.324 18802 5405 1 9 . 1 1 38 38 THR C C 38 174.164 174.164 174.075 0.089 18802 5406 1 9 . 1 1 38 38 THR CA C 38 62.462 62.462 61.410 1.052 18802 5407 1 9 . 1 1 38 38 THR CB C 38 69.874 69.874 70.071 -0.197 18802 5408 1 9 . 1 1 38 38 THR H H 38 8.189 8.189 8.255 -0.066 18802 5409 1 9 . 1 1 39 39 VAL N N 39 123.700 123.700 127.311 -3.611 18802 5410 1 9 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.437 -0.358 18802 5411 1 9 . 1 1 39 39 VAL C C 39 175.177 175.177 175.129 0.048 18802 5412 1 9 . 1 1 39 39 VAL CA C 39 61.991 61.991 60.800 1.191 18802 5413 1 9 . 1 1 39 39 VAL CB C 39 32.898 32.898 33.535 -0.637 18802 5414 1 9 . 1 1 39 39 VAL H H 39 8.036 8.036 8.583 -0.547 18802 5415 1 9 . 1 1 40 40 ILE N N 40 127.780 127.780 129.821 -2.041 18802 5416 1 9 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.000 0.177 18802 5417 1 9 . 1 1 40 40 ILE C C 40 173.894 173.894 174.356 -0.462 18802 5418 1 9 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.334 -1.423 18802 5419 1 9 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.101 1.532 18802 5420 1 9 . 1 1 40 40 ILE H H 40 8.236 8.236 8.577 -0.341 18802 5421 1 9 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.509 -0.018 18802 5422 1 9 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.332 0.292 18802 5423 1 9 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.059 0.043 18802 5424 1 9 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.261 -0.006 18802 5425 1 9 . 1 1 42 42 PRO C C 42 177.721 177.721 177.577 0.144 18802 5426 1 9 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.102 -0.302 18802 5427 1 9 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.883 0.472 18802 5428 1 9 . 1 1 43 43 GLY N N 43 107.305 107.305 108.847 -1.542 18802 5429 1 9 . 1 1 43 43 GLY C C 43 174.642 174.642 173.631 1.011 18802 5430 1 9 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.922 0.796 18802 5431 1 9 . 1 1 43 43 GLY H H 43 8.321 8.321 8.500 -0.179 18802 5432 1 9 . 1 1 44 44 LEU N N 44 120.897 120.897 121.291 -0.394 18802 5433 1 9 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.718 -0.189 18802 5434 1 9 . 1 1 44 44 LEU C C 44 178.580 178.580 176.975 1.605 18802 5435 1 9 . 1 1 44 44 LEU CA C 44 54.550 54.550 53.941 0.609 18802 5436 1 9 . 1 1 44 44 LEU CB C 44 42.579 42.579 43.243 -0.665 18802 5437 1 9 . 1 1 44 44 LEU H H 44 8.043 8.043 7.697 0.346 18802 5438 1 9 . 1 1 45 45 THR N N 45 113.195 113.195 113.251 -0.056 18802 5439 1 9 . 1 1 45 45 THR HA H 45 4.386 4.386 4.601 -0.215 18802 5440 1 9 . 1 1 45 45 THR C C 45 175.377 175.377 175.925 -0.548 18802 5441 1 9 . 1 1 45 45 THR CA C 45 61.188 61.188 60.608 0.580 18802 5442 1 9 . 1 1 45 45 THR CB C 45 71.043 71.043 71.183 -0.140 18802 5443 1 9 . 1 1 45 45 THR H H 45 8.427 8.427 8.193 0.234 18802 5444 1 9 . 1 1 46 46 ARG N N 46 121.322 121.322 122.054 -0.732 18802 5445 1 9 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.347 -0.310 18802 5446 1 9 . 1 1 46 46 ARG C C 46 179.309 179.309 178.203 1.106 18802 5447 1 9 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.143 0.241 18802 5448 1 9 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.405 0.411 18802 5449 1 9 . 1 1 46 46 ARG H H 46 8.832 8.832 8.889 -0.057 18802 5450 1 9 . 1 1 47 47 GLU N N 47 119.109 119.109 120.205 -1.096 18802 5451 1 9 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.115 -0.106 18802 5452 1 9 . 1 1 47 47 GLU C C 47 178.931 178.931 179.022 -0.091 18802 5453 1 9 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.724 0.552 18802 5454 1 9 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.526 0.765 18802 5455 1 9 . 1 1 47 47 GLU H H 47 8.754 8.754 8.641 0.113 18802 5456 1 9 . 1 1 48 48 GLN N N 48 119.556 119.556 119.864 -0.308 18802 5457 1 9 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.053 0.013 18802 5458 1 9 . 1 1 48 48 GLN C C 48 179.286 179.286 178.462 0.824 18802 5459 1 9 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.875 -0.660 18802 5460 1 9 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.780 0.887 18802 5461 1 9 . 1 1 48 48 GLN H H 48 7.711 7.711 7.933 -0.222 18802 5462 1 9 . 1 1 49 49 GLU N N 49 122.227 122.227 120.692 1.535 18802 5463 1 9 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.936 -0.063 18802 5464 1 9 . 1 1 49 49 GLU C C 49 177.879 177.879 178.993 -1.114 18802 5465 1 9 . 1 1 49 49 GLU CA C 49 59.958 59.958 60.067 -0.109 18802 5466 1 9 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.540 0.238 18802 5467 1 9 . 1 1 49 49 GLU H H 49 8.730 8.730 8.796 -0.066 18802 5468 1 9 . 1 1 50 50 ARG N N 50 119.109 119.109 118.869 0.240 18802 5469 1 9 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.081 -0.012 18802 5470 1 9 . 1 1 50 50 ARG C C 50 177.567 177.567 178.629 -1.062 18802 5471 1 9 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.202 0.024 18802 5472 1 9 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.356 -0.260 18802 5473 1 9 . 1 1 50 50 ARG H H 50 7.906 7.906 8.170 -0.264 18802 5474 1 9 . 1 1 51 51 ALA N N 51 119.411 119.411 122.864 -3.453 18802 5475 1 9 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.877 -0.073 18802 5476 1 9 . 1 1 51 51 ALA C C 51 178.740 178.740 179.006 -0.266 18802 5477 1 9 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.064 0.171 18802 5478 1 9 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.280 -0.021 18802 5479 1 9 . 1 1 51 51 ALA H H 51 7.956 7.956 8.428 -0.472 18802 5480 1 9 . 1 1 52 52 TYR N N 52 119.160 119.160 120.193 -1.033 18802 5481 1 9 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.189 -0.131 18802 5482 1 9 . 1 1 52 52 TYR C C 52 177.367 177.367 177.631 -0.264 18802 5483 1 9 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.315 0.290 18802 5484 1 9 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.644 0.065 18802 5485 1 9 . 1 1 52 52 TYR H H 52 7.854 7.854 7.921 -0.067 18802 5486 1 9 . 1 1 53 53 ILE N N 53 119.173 119.173 119.496 -0.323 18802 5487 1 9 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.374 0.228 18802 5488 1 9 . 1 1 53 53 ILE C C 53 178.711 178.711 178.023 0.688 18802 5489 1 9 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.493 -1.306 18802 5490 1 9 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.995 0.319 18802 5491 1 9 . 1 1 53 53 ILE H H 53 7.809 7.809 8.481 -0.672 18802 5492 1 9 . 1 1 54 54 VAL N N 54 121.549 121.549 119.651 1.898 18802 5493 1 9 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.526 -0.052 18802 5494 1 9 . 1 1 54 54 VAL C C 54 177.992 177.992 177.861 0.131 18802 5495 1 9 . 1 1 54 54 VAL CA C 54 66.995 66.995 66.367 0.628 18802 5496 1 9 . 1 1 54 54 VAL CB C 54 31.231 31.231 30.737 0.494 18802 5497 1 9 . 1 1 54 54 VAL H H 54 8.572 8.572 8.534 0.038 18802 5498 1 9 . 1 1 55 55 GLN N N 55 119.997 119.997 120.280 -0.283 18802 5499 1 9 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.900 -0.199 18802 5500 1 9 . 1 1 55 55 GLN C C 55 178.604 178.604 178.574 0.030 18802 5501 1 9 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.234 0.961 18802 5502 1 9 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.528 -0.386 18802 5503 1 9 . 1 1 55 55 GLN H H 55 8.183 8.183 8.044 0.139 18802 5504 1 9 . 1 1 56 56 LEU N N 56 119.605 119.605 118.567 1.038 18802 5505 1 9 . 1 1 56 56 LEU HA H 56 3.946 3.946 4.053 -0.107 18802 5506 1 9 . 1 1 56 56 LEU C C 56 180.439 180.439 179.472 0.967 18802 5507 1 9 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.471 0.764 18802 5508 1 9 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.430 0.419 18802 5509 1 9 . 1 1 56 56 LEU H H 56 7.586 7.586 7.556 0.030 18802 5510 1 9 . 1 1 57 57 GLN N N 57 120.332 120.332 118.676 1.656 18802 5511 1 9 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.977 0.132 18802 5512 1 9 . 1 1 57 57 GLN C C 57 179.166 179.166 178.656 0.510 18802 5513 1 9 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.807 0.583 18802 5514 1 9 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.724 0.766 18802 5515 1 9 . 1 1 57 57 GLN H H 57 8.046 8.046 7.399 0.647 18802 5516 1 9 . 1 1 58 58 ILE N N 58 120.945 120.945 120.804 0.141 18802 5517 1 9 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.587 -0.182 18802 5518 1 9 . 1 1 58 58 ILE C C 58 179.368 179.368 178.094 1.274 18802 5519 1 9 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.803 1.263 18802 5520 1 9 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.780 0.476 18802 5521 1 9 . 1 1 58 58 ILE H H 58 8.778 8.778 8.488 0.290 18802 5522 1 9 . 1 1 59 59 GLU N N 59 122.689 122.689 118.887 3.802 18802 5523 1 9 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.949 0.098 18802 5524 1 9 . 1 1 59 59 GLU C C 59 178.901 178.901 178.668 0.233 18802 5525 1 9 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.445 0.419 18802 5526 1 9 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.898 0.638 18802 5527 1 9 . 1 1 59 59 GLU H H 59 8.305 8.305 8.612 -0.307 18802 5528 1 9 . 1 1 60 60 ASP N N 60 121.505 121.505 121.061 0.444 18802 5529 1 9 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.343 0.094 18802 5530 1 9 . 1 1 60 60 ASP C C 60 178.312 178.312 178.625 -0.313 18802 5531 1 9 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.696 0.419 18802 5532 1 9 . 1 1 60 60 ASP CB C 60 42.248 42.248 40.913 1.335 18802 5533 1 9 . 1 1 60 60 ASP H H 60 8.142 8.142 7.576 0.566 18802 5534 1 9 . 1 1 61 61 LEU N N 61 118.666 118.666 119.665 -0.999 18802 5535 1 9 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.889 0.036 18802 5536 1 9 . 1 1 61 61 LEU C C 61 178.866 178.866 179.046 -0.180 18802 5537 1 9 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.314 -0.012 18802 5538 1 9 . 1 1 61 61 LEU CB C 61 42.610 42.610 42.076 0.534 18802 5539 1 9 . 1 1 61 61 LEU H H 61 8.425 8.425 8.384 0.041 18802 5540 1 9 . 1 1 62 62 THR N N 62 115.786 115.786 114.721 1.065 18802 5541 1 9 . 1 1 62 62 THR HA H 62 3.771 3.771 3.913 -0.142 18802 5542 1 9 . 1 1 62 62 THR C C 62 175.988 175.988 176.226 -0.238 18802 5543 1 9 . 1 1 62 62 THR CA C 62 67.649 67.649 67.167 0.482 18802 5544 1 9 . 1 1 62 62 THR CB C 62 68.848 68.848 68.558 0.290 18802 5545 1 9 . 1 1 62 62 THR H H 62 8.340 8.340 8.470 -0.130 18802 5546 1 9 . 1 1 63 63 ARG N N 63 122.111 122.111 121.670 0.441 18802 5547 1 9 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.964 0.025 18802 5548 1 9 . 1 1 63 63 ARG C C 63 179.715 179.715 177.647 2.068 18802 5549 1 9 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.741 0.345 18802 5550 1 9 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.117 -0.306 18802 5551 1 9 . 1 1 63 63 ARG H H 63 8.024 8.024 8.094 -0.070 18802 5552 1 9 . 1 1 64 64 LYS N N 64 120.824 120.824 119.963 0.861 18802 5553 1 9 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.201 -0.347 18802 5554 1 9 . 1 1 64 64 LYS C C 64 178.707 178.707 179.313 -0.606 18802 5555 1 9 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.341 1.214 18802 5556 1 9 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.348 0.830 18802 5557 1 9 . 1 1 64 64 LYS H H 64 8.130 8.130 7.542 0.588 18802 5558 1 9 . 1 1 65 65 LEU N N 65 118.497 118.497 115.631 2.866 18802 5559 1 9 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.190 -0.221 18802 5560 1 9 . 1 1 65 65 LEU C C 65 179.023 179.023 179.045 -0.022 18802 5561 1 9 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.659 -0.378 18802 5562 1 9 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.556 0.834 18802 5563 1 9 . 1 1 65 65 LEU H H 65 8.108 8.108 8.094 0.014 18802 5564 1 9 . 1 1 66 66 ARG N N 66 119.000 119.000 118.881 0.119 18802 5565 1 9 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.102 0.112 18802 5566 1 9 . 1 1 66 66 ARG C C 66 178.064 178.064 178.218 -0.154 18802 5567 1 9 . 1 1 66 66 ARG CA C 66 58.224 58.224 59.087 -0.863 18802 5568 1 9 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.587 0.036 18802 5569 1 9 . 1 1 66 66 ARG H H 66 8.102 8.102 8.410 -0.308 18802 5570 1 9 . 1 1 67 67 THR N N 67 109.849 109.849 110.000 -0.151 18802 5571 1 9 . 1 1 67 67 THR HA H 67 4.313 4.313 4.449 -0.136 18802 5572 1 9 . 1 1 67 67 THR C C 67 175.834 175.834 175.053 0.781 18802 5573 1 9 . 1 1 67 67 THR CA C 67 62.681 62.681 61.865 0.816 18802 5574 1 9 . 1 1 67 67 THR CB C 67 70.768 70.768 70.323 0.445 18802 5575 1 9 . 1 1 67 67 THR H H 67 7.956 7.956 7.872 0.084 18802 5576 1 9 . 1 1 68 68 GLY N N 68 110.673 110.673 110.671 0.002 18802 5577 1 9 . 1 1 68 68 GLY C C 68 173.968 173.968 173.316 0.652 18802 5578 1 9 . 1 1 68 68 GLY CA C 68 46.030 46.030 44.813 1.217 18802 5579 1 9 . 1 1 68 68 GLY H H 68 8.016 8.016 7.814 0.202 18802 5580 1 9 . 1 1 69 69 ASP N N 69 121.490 121.490 120.771 0.719 18802 5581 1 9 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.817 -0.162 18802 5582 1 9 . 1 1 69 69 ASP C C 69 175.983 175.983 176.403 -0.420 18802 5583 1 9 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.087 0.767 18802 5584 1 9 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.781 -0.135 18802 5585 1 9 . 1 1 69 69 ASP H H 69 8.048 8.048 7.826 0.222 18802 5586 1 9 . 1 1 70 70 LEU N N 70 120.838 120.838 126.632 -5.794 18802 5587 1 9 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.475 -0.336 18802 5588 1 9 . 1 1 70 70 LEU C C 70 177.530 177.530 177.658 -0.128 18802 5589 1 9 . 1 1 70 70 LEU CA C 70 55.280 55.280 54.546 0.734 18802 5590 1 9 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.612 -0.476 18802 5591 1 9 . 1 1 70 70 LEU H H 70 7.988 7.988 7.823 0.165 18802 5592 1 9 . 1 1 71 71 GLY N N 71 108.059 108.059 106.754 1.305 18802 5593 1 9 . 1 1 71 71 GLY C C 71 173.936 173.936 174.586 -0.650 18802 5594 1 9 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.299 0.259 18802 5595 1 9 . 1 1 71 71 GLY H H 71 8.341 8.341 8.284 0.057 18802 5596 1 9 . 1 1 72 72 ILE N N 72 121.037 121.037 122.009 -0.972 18802 5597 1 9 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.431 -0.037 18802 5598 1 9 . 1 1 72 72 ILE C C 72 174.227 174.227 174.923 -0.696 18802 5599 1 9 . 1 1 72 72 ILE CA C 72 58.539 58.539 57.249 1.290 18802 5600 1 9 . 1 1 72 72 ILE CB C 72 38.810 38.810 39.113 -0.303 18802 5601 1 9 . 1 1 72 72 ILE H H 72 7.793 7.793 7.889 -0.096 18802 5602 1 9 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.678 -0.056 18802 5603 1 9 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.759 -0.119 18802 5604 1 9 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.003 0.101 18802 5605 1 9 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.358 0.014 18802 5606 1 9 . 1 1 74 74 PRO C C 74 176.423 176.423 176.332 0.091 18802 5607 1 9 . 1 1 74 74 PRO CA C 74 63.041 63.041 63.251 -0.209 18802 5608 1 9 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.291 -0.261 18802 5609 1 9 . 1 1 75 75 ASN N N 75 119.550 119.550 120.478 -0.928 18802 5610 1 9 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.852 0.077 18802 5611 1 9 . 1 1 75 75 ASN C C 75 174.066 174.066 175.794 -1.728 18802 5612 1 9 . 1 1 75 75 ASN CA C 75 51.151 51.151 49.847 1.304 18802 5613 1 9 . 1 1 75 75 ASN CB C 75 38.924 38.924 38.840 0.084 18802 5614 1 9 . 1 1 75 75 ASN H H 75 8.422 8.422 8.229 0.193 18802 5615 1 9 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.201 0.092 18802 5616 1 9 . 1 1 76 76 PRO C C 76 177.322 177.322 177.488 -0.166 18802 5617 1 9 . 1 1 76 76 PRO CA C 76 64.384 64.384 65.182 -0.798 18802 5618 1 9 . 1 1 76 76 PRO CB C 76 32.236 32.236 32.023 0.213 18802 5619 1 9 . 1 1 77 77 GLU N N 77 118.523 118.523 114.423 4.100 18802 5620 1 9 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.332 -0.156 18802 5621 1 9 . 1 1 77 77 GLU C C 77 176.403 176.403 176.523 -0.120 18802 5622 1 9 . 1 1 77 77 GLU CA C 77 56.977 56.977 55.557 1.420 18802 5623 1 9 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.795 1.065 18802 5624 1 9 . 1 1 77 77 GLU H H 77 8.426 8.426 8.339 0.087 18802 5625 1 9 . 1 1 78 78 ASP N N 78 120.581 120.581 117.902 2.679 18802 5626 1 9 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.696 -0.153 18802 5627 1 9 . 1 1 78 78 ASP C C 78 176.085 176.085 176.962 -0.877 18802 5628 1 9 . 1 1 78 78 ASP CA C 78 54.544 54.544 54.412 0.132 18802 5629 1 9 . 1 1 78 78 ASP CB C 78 41.239 41.239 41.580 -0.341 18802 5630 1 9 . 1 1 78 78 ASP H H 78 7.941 7.941 7.768 0.173 18802 5631 1 9 . 1 1 79 79 ARG N N 79 121.043 121.043 118.477 2.566 18802 5632 1 9 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.342 -0.017 18802 5633 1 9 . 1 1 79 79 ARG C C 79 176.123 176.123 176.974 -0.851 18802 5634 1 9 . 1 1 79 79 ARG CA C 79 55.927 55.927 56.222 -0.295 18802 5635 1 9 . 1 1 79 79 ARG CB C 79 30.650 30.650 30.176 0.474 18802 5636 1 9 . 1 1 79 79 ARG H H 79 8.066 8.066 7.355 0.711 18802 5637 1 9 . 1 1 80 80 SER N N 80 118.338 118.338 117.101 1.237 18802 5638 1 9 . 1 1 80 80 SER HA H 80 4.672 4.672 4.608 0.064 18802 5639 1 9 . 1 1 80 80 SER C C 80 172.577 172.577 173.244 -0.667 18802 5640 1 9 . 1 1 80 80 SER CA C 80 56.564 56.564 57.644 -1.079 18802 5641 1 9 . 1 1 80 80 SER CB C 80 63.415 63.415 63.162 0.253 18802 5642 1 9 . 1 1 80 80 SER H H 80 8.281 8.281 7.671 0.610 18802 5643 1 9 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.292 0.128 18802 5644 1 9 . 1 1 81 81 PRO C C 81 176.727 176.727 176.305 0.422 18802 5645 1 9 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.603 -0.340 18802 5646 1 9 . 1 1 81 81 PRO CB C 81 32.052 32.052 31.784 0.268 18802 5647 1 9 . 1 1 82 82 SER N N 82 117.341 117.341 120.371 -3.030 18802 5648 1 9 . 1 1 82 82 SER HA H 82 4.693 4.693 4.743 -0.050 18802 5649 1 9 . 1 1 82 82 SER C C 82 172.803 172.803 173.047 -0.244 18802 5650 1 9 . 1 1 82 82 SER CA C 82 56.288 56.288 56.112 0.176 18802 5651 1 9 . 1 1 82 82 SER CB C 82 63.500 63.500 63.577 -0.077 18802 5652 1 9 . 1 1 82 82 SER H H 82 8.280 8.280 8.107 0.173 18802 5653 1 9 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.447 -0.136 18802 5654 1 9 . 1 1 83 83 PRO C C 83 176.273 176.273 175.809 0.464 18802 5655 1 9 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.896 0.219 18802 5656 1 9 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.430 -0.331 18802 5657 1 9 . 1 1 84 84 GLU N N 84 122.213 122.213 122.601 -0.388 18802 5658 1 9 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.407 0.086 18802 5659 1 9 . 1 1 84 84 GLU C C 84 174.546 174.546 175.490 -0.944 18802 5660 1 9 . 1 1 84 84 GLU CA C 84 54.529 54.529 53.942 0.587 18802 5661 1 9 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.564 0.374 18802 5662 1 9 . 1 1 84 84 GLU H H 84 8.230 8.230 8.557 -0.327 18802 5663 1 9 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.361 0.054 18802 5664 1 9 . 1 1 85 85 PRO C C 85 176.024 176.024 176.270 -0.246 18802 5665 1 9 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.833 0.409 18802 5666 1 9 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.331 -0.142 18802 5667 1 9 . 1 1 86 86 ILE N N 86 120.281 120.281 121.611 -1.330 18802 5668 1 9 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.333 -0.271 18802 5669 1 9 . 1 1 86 86 ILE C C 86 175.419 175.419 175.448 -0.029 18802 5670 1 9 . 1 1 86 86 ILE CA C 86 61.029 61.029 61.006 0.023 18802 5671 1 9 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.630 -0.372 18802 5672 1 9 . 1 1 86 86 ILE H H 86 7.980 7.980 7.934 0.046 18802 5673 1 9 . 1 1 87 87 TYR N N 87 123.089 123.089 123.823 -0.734 18802 5674 1 9 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.711 0.106 18802 5675 1 9 . 1 1 87 87 TYR C C 87 175.920 175.920 176.133 -0.213 18802 5676 1 9 . 1 1 87 87 TYR CA C 87 57.197 57.197 57.752 -0.555 18802 5677 1 9 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.178 1.000 18802 5678 1 9 . 1 1 87 87 TYR H H 87 8.194 8.194 8.642 -0.448 18802 5679 1 9 . 1 1 88 88 ASN N N 88 120.117 120.117 120.566 -0.449 18802 5680 1 9 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.852 -0.107 18802 5681 1 9 . 1 1 88 88 ASN C C 88 176.275 176.275 176.978 -0.703 18802 5682 1 9 . 1 1 88 88 ASN CA C 88 52.286 52.286 52.644 -0.358 18802 5683 1 9 . 1 1 88 88 ASN CB C 88 39.082 39.082 39.323 -0.241 18802 5684 1 9 . 1 1 88 88 ASN H H 88 8.386 8.386 8.867 -0.481 18802 5685 1 9 . 1 1 89 89 SER N N 89 115.826 115.826 115.622 0.204 18802 5686 1 9 . 1 1 89 89 SER HA H 89 4.248 4.248 4.296 -0.048 18802 5687 1 9 . 1 1 89 89 SER C C 89 175.066 175.066 174.936 0.130 18802 5688 1 9 . 1 1 89 89 SER CA C 89 60.012 60.012 60.928 -0.916 18802 5689 1 9 . 1 1 89 89 SER CB C 89 63.400 63.400 62.940 0.460 18802 5690 1 9 . 1 1 89 89 SER H H 89 8.371 8.371 8.825 -0.454 18802 5691 1 9 . 1 1 90 90 GLU N N 90 121.062 121.062 119.289 1.773 18802 5692 1 9 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.346 -0.068 18802 5693 1 9 . 1 1 90 90 GLU C C 90 176.936 176.936 177.139 -0.203 18802 5694 1 9 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.332 0.449 18802 5695 1 9 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.326 0.737 18802 5696 1 9 . 1 1 90 90 GLU H H 90 8.018 8.018 8.038 -0.020 18802 5697 1 9 . 1 1 91 91 GLY N N 91 108.499 108.499 108.633 -0.134 18802 5698 1 9 . 1 1 91 91 GLY C C 91 174.115 174.115 173.660 0.455 18802 5699 1 9 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.048 0.696 18802 5700 1 9 . 1 1 91 91 GLY H H 91 8.199 8.199 7.927 0.272 18802 5701 1 9 . 1 1 92 92 LYS N N 92 120.638 120.638 119.901 0.737 18802 5702 1 9 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.443 -0.134 18802 5703 1 9 . 1 1 92 92 LYS C C 92 176.453 176.453 175.289 1.164 18802 5704 1 9 . 1 1 92 92 LYS CA C 92 55.856 55.856 54.785 1.071 18802 5705 1 9 . 1 1 92 92 LYS CB C 92 33.109 33.109 33.816 -0.707 18802 5706 1 9 . 1 1 92 92 LYS H H 92 7.956 7.956 7.827 0.129 18802 5707 1 9 . 1 1 93 93 ARG N N 93 122.999 122.999 124.333 -1.334 18802 5708 1 9 . 1 1 93 93 ARG HA H 93 4.191 4.191 3.886 0.305 18802 5709 1 9 . 1 1 93 93 ARG C C 93 176.325 176.325 175.978 0.347 18802 5710 1 9 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.811 0.571 18802 5711 1 9 . 1 1 93 93 ARG CB C 93 30.656 30.656 30.123 0.533 18802 5712 1 9 . 1 1 93 93 ARG H H 93 8.403 8.403 8.414 -0.011 18802 5713 1 9 . 1 1 94 94 LEU N N 94 124.100 124.100 125.386 -1.286 18802 5714 1 9 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.602 -0.339 18802 5715 1 9 . 1 1 94 94 LEU C C 94 176.993 176.993 175.483 1.510 18802 5716 1 9 . 1 1 94 94 LEU CA C 94 55.034 55.034 52.568 2.466 18802 5717 1 9 . 1 1 94 94 LEU CB C 94 42.941 42.941 43.163 -0.222 18802 5718 1 9 . 1 1 94 94 LEU H H 94 8.283 8.283 7.910 0.373 18802 5719 1 9 . 1 1 95 95 ASN N N 95 119.593 119.593 117.594 1.999 18802 5720 1 9 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.876 -0.129 18802 5721 1 9 . 1 1 95 95 ASN C C 95 175.598 175.598 174.989 0.609 18802 5722 1 9 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.051 -0.371 18802 5723 1 9 . 1 1 95 95 ASN CB C 95 38.723 38.723 39.631 -0.908 18802 5724 1 9 . 1 1 95 95 ASN H H 95 8.460 8.460 8.108 0.352 18802 5725 1 9 . 1 1 96 96 THR N N 96 114.100 114.100 115.728 -1.628 18802 5726 1 9 . 1 1 96 96 THR HA H 96 4.226 4.226 4.337 -0.111 18802 5727 1 9 . 1 1 96 96 THR C C 96 175.186 175.186 175.605 -0.419 18802 5728 1 9 . 1 1 96 96 THR CA C 96 62.203 62.203 64.709 -2.506 18802 5729 1 9 . 1 1 96 96 THR CB C 96 69.880 69.880 69.755 0.125 18802 5730 1 9 . 1 1 96 96 THR H H 96 8.031 8.031 8.690 -0.659 18802 5731 1 9 . 1 1 97 97 ARG N N 97 122.587 122.587 122.185 0.402 18802 5732 1 9 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.085 0.028 18802 5733 1 9 . 1 1 97 97 ARG C C 97 177.938 177.938 178.252 -0.314 18802 5734 1 9 . 1 1 97 97 ARG CA C 97 58.412 58.412 60.899 -2.487 18802 5735 1 9 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.895 0.402 18802 5736 1 9 . 1 1 97 97 ARG H H 97 8.502 8.502 8.647 -0.145 18802 5737 1 9 . 1 1 98 98 GLU N N 98 121.548 121.548 119.598 1.950 18802 5738 1 9 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.143 -0.126 18802 5739 1 9 . 1 1 98 98 GLU C C 98 177.113 177.113 178.753 -1.640 18802 5740 1 9 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.769 -1.089 18802 5741 1 9 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.893 0.773 18802 5742 1 9 . 1 1 98 98 GLU H H 98 8.517 8.517 8.790 -0.273 18802 5743 1 9 . 1 1 99 99 PHE N N 99 121.388 121.388 119.618 1.770 18802 5744 1 9 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.226 0.096 18802 5745 1 9 . 1 1 99 99 PHE C C 99 177.070 177.070 177.215 -0.145 18802 5746 1 9 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.502 -1.427 18802 5747 1 9 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.166 0.320 18802 5748 1 9 . 1 1 99 99 PHE H H 99 8.176 8.176 8.288 -0.112 18802 5749 1 9 . 1 1 100 100 ARG N N 100 120.211 120.211 119.629 0.582 18802 5750 1 9 . 1 1 100 100 ARG C C 100 178.159 178.159 178.687 -0.528 18802 5751 1 9 . 1 1 100 100 ARG CA C 100 58.533 58.533 59.940 -1.407 18802 5752 1 9 . 1 1 100 100 ARG CB C 100 30.588 30.588 30.218 0.370 18802 5753 1 9 . 1 1 100 100 ARG H H 100 8.377 8.377 8.237 0.140 18802 5754 1 9 . 1 1 101 101 THR N N 101 115.416 115.416 116.818 -1.402 18802 5755 1 9 . 1 1 101 101 THR HA H 101 4.022 4.022 3.945 0.077 18802 5756 1 9 . 1 1 101 101 THR C C 101 175.301 175.301 176.218 -0.917 18802 5757 1 9 . 1 1 101 101 THR CA C 101 65.141 65.141 66.694 -1.553 18802 5758 1 9 . 1 1 101 101 THR CB C 101 69.305 69.305 68.663 0.642 18802 5759 1 9 . 1 1 101 101 THR H H 101 7.992 7.992 8.145 -0.153 18802 5760 1 9 . 1 1 102 102 ARG N N 102 122.212 122.212 121.882 0.330 18802 5761 1 9 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.894 0.413 18802 5762 1 9 . 1 1 102 102 ARG C C 102 177.644 177.644 178.076 -0.432 18802 5763 1 9 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.520 1.091 18802 5764 1 9 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.227 -0.419 18802 5765 1 9 . 1 1 102 102 ARG H H 102 8.369 8.369 8.432 -0.063 18802 5766 1 9 . 1 1 103 103 LYS N N 103 117.591 117.591 118.715 -1.124 18802 5767 1 9 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.888 0.072 18802 5768 1 9 . 1 1 103 103 LYS C C 103 178.913 178.913 178.788 0.125 18802 5769 1 9 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.603 0.447 18802 5770 1 9 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.657 0.484 18802 5771 1 9 . 1 1 103 103 LYS H H 103 7.941 7.941 8.249 -0.308 18802 5772 1 9 . 1 1 104 104 LYS N N 104 119.769 119.769 120.063 -0.294 18802 5773 1 9 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.060 0.086 18802 5774 1 9 . 1 1 104 104 LYS C C 104 179.377 179.377 178.698 0.679 18802 5775 1 9 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.861 0.118 18802 5776 1 9 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.570 0.621 18802 5777 1 9 . 1 1 104 104 LYS H H 104 7.615 7.615 7.568 0.047 18802 5778 1 9 . 1 1 105 105 LEU N N 105 120.500 120.500 118.888 1.612 18802 5779 1 9 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.934 0.183 18802 5780 1 9 . 1 1 105 105 LEU C C 105 179.481 179.481 179.096 0.385 18802 5781 1 9 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.108 0.152 18802 5782 1 9 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.432 0.572 18802 5783 1 9 . 1 1 105 105 LEU H H 105 8.057 8.057 7.678 0.379 18802 5784 1 9 . 1 1 106 106 GLU N N 106 118.803 118.803 119.197 -0.394 18802 5785 1 9 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.923 0.066 18802 5786 1 9 . 1 1 106 106 GLU C C 106 180.577 180.577 179.293 1.284 18802 5787 1 9 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.864 -0.054 18802 5788 1 9 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.359 0.650 18802 5789 1 9 . 1 1 106 106 GLU H H 106 8.652 8.652 8.211 0.441 18802 5790 1 9 . 1 1 107 107 GLU N N 107 122.396 122.396 119.290 3.106 18802 5791 1 9 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.137 -0.031 18802 5792 1 9 . 1 1 107 107 GLU C C 107 178.457 178.457 179.342 -0.885 18802 5793 1 9 . 1 1 107 107 GLU CA C 107 59.826 59.826 59.225 0.601 18802 5794 1 9 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.244 0.318 18802 5795 1 9 . 1 1 107 107 GLU H H 107 8.281 8.281 8.642 -0.361 18802 5796 1 9 . 1 1 108 108 GLU N N 108 120.976 120.976 119.026 1.950 18802 5797 1 9 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.041 0.051 18802 5798 1 9 . 1 1 108 108 GLU C C 108 179.343 179.343 179.129 0.214 18802 5799 1 9 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.161 0.535 18802 5800 1 9 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.250 0.320 18802 5801 1 9 . 1 1 108 108 GLU H H 108 8.321 8.321 8.504 -0.183 18802 5802 1 9 . 1 1 109 109 ARG N N 109 118.559 118.559 120.007 -1.448 18802 5803 1 9 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.956 -0.164 18802 5804 1 9 . 1 1 109 109 ARG C C 109 177.178 177.178 178.259 -1.081 18802 5805 1 9 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.846 0.637 18802 5806 1 9 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.262 -0.113 18802 5807 1 9 . 1 1 109 109 ARG H H 109 8.594 8.594 8.164 0.430 18802 5808 1 9 . 1 1 110 110 HIS N N 110 119.632 119.632 118.714 0.918 18802 5809 1 9 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.361 -0.020 18802 5810 1 9 . 1 1 110 110 HIS C C 110 177.578 177.578 177.762 -0.184 18802 5811 1 9 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.561 1.056 18802 5812 1 9 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.148 0.362 18802 5813 1 9 . 1 1 110 110 HIS H H 110 8.465 8.465 8.547 -0.082 18802 5814 1 9 . 1 1 111 111 ASN N N 111 119.587 119.587 118.306 1.281 18802 5815 1 9 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.470 -0.192 18802 5816 1 9 . 1 1 111 111 ASN C C 111 178.630 178.630 177.565 1.065 18802 5817 1 9 . 1 1 111 111 ASN CA C 111 56.281 56.281 56.100 0.181 18802 5818 1 9 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.305 -0.610 18802 5819 1 9 . 1 1 111 111 ASN H H 111 8.323 8.323 8.542 -0.219 18802 5820 1 9 . 1 1 112 112 LEU N N 112 122.320 122.320 120.667 1.653 18802 5821 1 9 . 1 1 112 112 LEU HA H 112 4.116 4.116 4.000 0.116 18802 5822 1 9 . 1 1 112 112 LEU C C 112 178.539 178.539 178.911 -0.372 18802 5823 1 9 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.890 0.089 18802 5824 1 9 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.786 0.808 18802 5825 1 9 . 1 1 112 112 LEU H H 112 7.966 7.966 7.900 0.066 18802 5826 1 9 . 1 1 113 113 ILE N N 113 121.495 121.495 120.068 1.427 18802 5827 1 9 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.732 -0.496 18802 5828 1 9 . 1 1 113 113 ILE C C 113 176.959 176.959 178.518 -1.559 18802 5829 1 9 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.491 1.563 18802 5830 1 9 . 1 1 113 113 ILE CB C 113 37.603 37.603 35.794 1.809 18802 5831 1 9 . 1 1 113 113 ILE H H 113 8.472 8.472 8.682 -0.210 18802 5832 1 9 . 1 1 114 114 THR N N 114 115.066 115.066 115.870 -0.804 18802 5833 1 9 . 1 1 114 114 THR HA H 114 3.718 3.718 4.077 -0.359 18802 5834 1 9 . 1 1 114 114 THR C C 114 176.559 176.559 177.077 -0.518 18802 5835 1 9 . 1 1 114 114 THR CA C 114 66.700 66.700 67.120 -0.420 18802 5836 1 9 . 1 1 114 114 THR CB C 114 68.759 68.759 68.342 0.417 18802 5837 1 9 . 1 1 114 114 THR H H 114 8.075 8.075 8.412 -0.337 18802 5838 1 9 . 1 1 115 115 GLU N N 115 123.259 123.259 122.167 1.092 18802 5839 1 9 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.146 -0.214 18802 5840 1 9 . 1 1 115 115 GLU C C 115 178.191 178.191 178.587 -0.396 18802 5841 1 9 . 1 1 115 115 GLU CA C 115 59.340 59.340 58.970 0.370 18802 5842 1 9 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.240 0.159 18802 5843 1 9 . 1 1 115 115 GLU H H 115 7.368 7.368 7.888 -0.520 18802 5844 1 9 . 1 1 116 116 MET N N 116 119.844 119.844 119.960 -0.116 18802 5845 1 9 . 1 1 116 116 MET HA H 116 4.014 4.014 3.969 0.045 18802 5846 1 9 . 1 1 116 116 MET C C 116 177.888 177.888 177.992 -0.104 18802 5847 1 9 . 1 1 116 116 MET CA C 116 57.183 57.183 59.279 -2.096 18802 5848 1 9 . 1 1 116 116 MET CB C 116 32.126 32.126 32.301 -0.175 18802 5849 1 9 . 1 1 116 116 MET H H 116 8.373 8.373 8.439 -0.066 18802 5850 1 9 . 1 1 117 117 VAL N N 117 117.572 117.572 119.889 -2.317 18802 5851 1 9 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.184 -0.288 18802 5852 1 9 . 1 1 117 117 VAL C C 117 177.567 177.567 177.980 -0.413 18802 5853 1 9 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.178 -1.308 18802 5854 1 9 . 1 1 117 117 VAL CB C 117 32.002 32.002 30.893 1.109 18802 5855 1 9 . 1 1 117 117 VAL H H 117 8.279 8.279 8.695 -0.416 18802 5856 1 9 . 1 1 118 118 ALA N N 118 120.560 120.560 121.971 -1.411 18802 5857 1 9 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.171 -0.035 18802 5858 1 9 . 1 1 118 118 ALA C C 118 179.595 179.595 179.600 -0.005 18802 5859 1 9 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.808 -0.705 18802 5860 1 9 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.684 -0.434 18802 5861 1 9 . 1 1 118 118 ALA H H 118 7.074 7.074 7.392 -0.318 18802 5862 1 9 . 1 1 119 119 LEU N N 119 117.987 117.987 117.597 0.390 18802 5863 1 9 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.089 0.051 18802 5864 1 9 . 1 1 119 119 LEU C C 119 177.863 177.863 177.215 0.648 18802 5865 1 9 . 1 1 119 119 LEU CA C 119 56.672 56.672 57.020 -0.348 18802 5866 1 9 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.702 0.532 18802 5867 1 9 . 1 1 119 119 LEU H H 119 7.525 7.525 8.059 -0.533 18802 5868 1 9 . 1 1 120 120 ASN N N 120 115.338 115.338 115.875 -0.537 18802 5869 1 9 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.152 -0.134 18802 5870 1 9 . 1 1 120 120 ASN C C 120 172.510 172.510 174.099 -1.589 18802 5871 1 9 . 1 1 120 120 ASN CA C 120 50.101 50.101 49.952 0.149 18802 5872 1 9 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.502 -1.197 18802 5873 1 9 . 1 1 120 120 ASN H H 120 8.467 8.467 8.072 0.395 18802 5874 1 9 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.630 0.026 18802 5875 1 9 . 1 1 121 121 PRO C C 121 177.020 177.020 176.806 0.214 18802 5876 1 9 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.363 -0.065 18802 5877 1 9 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.248 0.051 18802 5878 1 9 . 1 1 122 122 ASP N N 122 115.744 115.744 117.568 -1.824 18802 5879 1 9 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.639 0.030 18802 5880 1 9 . 1 1 122 122 ASP C C 122 176.004 176.004 175.921 0.083 18802 5881 1 9 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.594 0.772 18802 5882 1 9 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.662 -0.338 18802 5883 1 9 . 1 1 122 122 ASP H H 122 7.600 7.600 7.933 -0.333 18802 5884 1 9 . 1 1 123 123 PHE N N 123 122.722 122.722 122.065 0.657 18802 5885 1 9 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.368 -0.233 18802 5886 1 9 . 1 1 123 123 PHE C C 123 173.954 173.954 174.529 -0.575 18802 5887 1 9 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.490 0.503 18802 5888 1 9 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.399 0.197 18802 5889 1 9 . 1 1 123 123 PHE H H 123 7.940 7.940 7.513 0.427 18802 5890 1 9 . 1 1 124 124 LYS N N 124 129.400 129.400 129.976 -0.576 18802 5891 1 9 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.370 0.189 18802 5892 1 9 . 1 1 124 124 LYS C C 124 172.622 172.622 173.991 -1.369 18802 5893 1 9 . 1 1 124 124 LYS CA C 124 51.815 51.815 52.986 -1.171 18802 5894 1 9 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.509 1.072 18802 5895 1 9 . 1 1 124 124 LYS H H 124 7.602 7.602 8.255 -0.653 18802 5896 1 9 . 1 1 125 125 PRO HA H 125 4.089 4.089 3.828 0.261 18802 5897 1 9 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.377 -0.381 18802 5898 1 9 . 1 1 125 125 PRO CB C 125 31.067 31.067 31.151 -0.085 18802 5899 1 9 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.381 -0.007 18802 5900 1 9 . 1 1 126 126 PRO C C 126 177.630 177.630 177.685 -0.055 18802 5901 1 9 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.608 0.205 18802 5902 1 9 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.350 -0.029 18802 5903 1 9 . 1 1 127 127 ALA N N 127 123.830 123.830 123.406 0.424 18802 5904 1 9 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.125 -0.067 18802 5905 1 9 . 1 1 127 127 ALA C C 127 177.641 177.641 178.017 -0.376 18802 5906 1 9 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.282 0.320 18802 5907 1 9 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.868 -0.019 18802 5908 1 9 . 1 1 127 127 ALA H H 127 8.630 8.630 8.613 0.017 18802 5909 1 9 . 1 1 128 128 ASP N N 128 112.924 112.924 114.986 -2.062 18802 5910 1 9 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.583 -0.132 18802 5911 1 9 . 1 1 128 128 ASP C C 128 175.724 175.724 175.448 0.276 18802 5912 1 9 . 1 1 128 128 ASP CA C 128 53.604 53.604 55.123 -1.519 18802 5913 1 9 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.624 -0.206 18802 5914 1 9 . 1 1 128 128 ASP H H 128 8.335 8.335 8.320 0.015 18802 5915 1 9 . 1 1 129 129 TYR N N 129 121.114 121.114 121.196 -0.082 18802 5916 1 9 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.443 -0.081 18802 5917 1 9 . 1 1 129 129 TYR C C 129 174.190 174.190 174.248 -0.058 18802 5918 1 9 . 1 1 129 129 TYR CA C 129 58.412 58.412 58.430 -0.018 18802 5919 1 9 . 1 1 129 129 TYR CB C 129 39.059 39.059 39.423 -0.364 18802 5920 1 9 . 1 1 129 129 TYR H H 129 7.600 7.600 7.491 0.109 18802 5921 1 9 . 1 1 130 130 LYS N N 130 129.875 129.875 128.736 1.139 18802 5922 1 9 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.421 -0.103 18802 5923 1 9 . 1 1 130 130 LYS C C 130 172.314 172.314 173.571 -1.257 18802 5924 1 9 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.991 0.579 18802 5925 1 9 . 1 1 130 130 LYS CB C 130 33.663 33.663 32.530 1.133 18802 5926 1 9 . 1 1 130 130 LYS H H 130 7.695 7.695 8.158 -0.463 18802 5927 1 9 . 1 1 131 131 PRO HA H 131 4.277 4.277 3.901 0.376 18802 5928 1 9 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.120 -0.062 18802 5929 1 9 . 1 1 131 131 PRO CB C 131 30.852 30.852 31.110 -0.259 18802 5930 1 9 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.559 -0.315 18802 5931 1 9 . 1 1 132 132 PRO C C 132 176.459 176.459 176.277 0.182 18802 5932 1 9 . 1 1 132 132 PRO CA C 132 62.874 62.874 62.557 0.317 18802 5933 1 9 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.247 -0.200 18802 5934 1 9 . 1 1 133 133 ALA N N 133 124.170 124.170 124.199 -0.029 18802 5935 1 9 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.341 -0.091 18802 5936 1 9 . 1 1 133 133 ALA C C 133 177.870 177.870 177.065 0.805 18802 5937 1 9 . 1 1 133 133 ALA CA C 133 52.508 52.508 52.096 0.412 18802 5938 1 9 . 1 1 133 133 ALA CB C 133 19.303 19.303 19.113 0.190 18802 5939 1 9 . 1 1 133 133 ALA H H 133 8.311 8.311 8.312 -0.001 18802 5940 1 9 . 1 1 134 134 THR N N 134 113.807 113.807 109.747 4.060 18802 5941 1 9 . 1 1 134 134 THR HA H 134 4.228 4.228 4.053 0.175 18802 5942 1 9 . 1 1 134 134 THR C C 134 174.282 174.282 173.766 0.516 18802 5943 1 9 . 1 1 134 134 THR CA C 134 62.127 62.127 62.409 -0.282 18802 5944 1 9 . 1 1 134 134 THR CB C 134 69.870 69.870 68.397 1.473 18802 5945 1 9 . 1 1 134 134 THR H H 134 8.019 8.019 8.062 -0.043 18802 5946 1 9 . 1 1 135 135 ARG N N 135 124.165 124.165 121.871 2.294 18802 5947 1 9 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.236 0.113 18802 5948 1 9 . 1 1 135 135 ARG C C 135 176.217 176.217 176.207 0.010 18802 5949 1 9 . 1 1 135 135 ARG CA C 135 55.993 55.993 55.781 0.212 18802 5950 1 9 . 1 1 135 135 ARG CB C 135 30.992 30.992 29.975 1.017 18802 5951 1 9 . 1 1 135 135 ARG H H 135 8.300 8.300 8.090 0.210 18802 5952 1 9 . 1 1 136 136 VAL N N 136 122.157 122.157 126.968 -4.811 18802 5953 1 9 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.072 -0.002 18802 5954 1 9 . 1 1 136 136 VAL C C 136 176.180 176.180 175.896 0.284 18802 5955 1 9 . 1 1 136 136 VAL CA C 136 61.937 61.937 62.909 -0.972 18802 5956 1 9 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.288 0.459 18802 5957 1 9 . 1 1 136 136 VAL H H 136 8.233 8.233 8.400 -0.167 18802 5958 1 9 . 1 1 137 137 SER N N 137 118.837 118.837 120.845 -2.008 18802 5959 1 9 . 1 1 137 137 SER HA H 137 4.416 4.416 4.617 -0.201 18802 5960 1 9 . 1 1 137 137 SER C C 137 174.258 174.258 174.134 0.124 18802 5961 1 9 . 1 1 137 137 SER CA C 137 58.341 58.341 57.349 0.992 18802 5962 1 9 . 1 1 137 137 SER CB C 137 63.900 63.900 64.874 -0.974 18802 5963 1 9 . 1 1 137 137 SER H H 137 8.264 8.264 8.346 -0.082 18802 5964 1 9 . 1 1 138 138 ASP N N 138 122.871 122.871 124.161 -1.290 18802 5965 1 9 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.570 -0.033 18802 5966 1 9 . 1 1 138 138 ASP C C 138 176.053 176.053 175.973 0.080 18802 5967 1 9 . 1 1 138 138 ASP CA C 138 54.489 54.489 55.197 -0.708 18802 5968 1 9 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.176 -0.028 18802 5969 1 9 . 1 1 138 138 ASP H H 138 8.249 8.249 8.662 -0.413 18802 5970 1 9 . 1 1 139 139 LYS N N 139 120.944 120.944 116.033 4.911 18802 5971 1 9 . 1 1 139 139 LYS HA H 139 4.260 4.260 3.912 0.348 18802 5972 1 9 . 1 1 139 139 LYS C C 139 176.343 176.343 175.282 1.061 18802 5973 1 9 . 1 1 139 139 LYS CA C 139 56.261 56.261 56.852 -0.591 18802 5974 1 9 . 1 1 139 139 LYS CB C 139 33.077 33.077 31.874 1.203 18802 5975 1 9 . 1 1 139 139 LYS H H 139 8.084 8.084 8.001 0.083 18802 5976 1 9 . 1 1 140 140 VAL N N 140 121.670 121.670 119.919 1.751 18802 5977 1 9 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.262 -0.250 18802 5978 1 9 . 1 1 140 140 VAL C C 140 175.842 175.842 174.882 0.960 18802 5979 1 9 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.093 1.349 18802 5980 1 9 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.549 0.318 18802 5981 1 9 . 1 1 140 140 VAL H H 140 8.025 8.025 8.187 -0.162 18802 5982 1 9 . 1 1 141 141 MET N N 141 124.839 124.839 126.133 -1.294 18802 5983 1 9 . 1 1 141 141 MET HA H 141 4.453 4.453 4.541 -0.088 18802 5984 1 9 . 1 1 141 141 MET C C 141 175.562 175.562 175.849 -0.287 18802 5985 1 9 . 1 1 141 141 MET CA C 141 55.349 55.349 54.769 0.580 18802 5986 1 9 . 1 1 141 141 MET CB C 141 32.993 32.993 32.780 0.213 18802 5987 1 9 . 1 1 141 141 MET H H 141 8.364 8.364 8.489 -0.125 18802 5988 1 9 . 1 1 142 142 ILE N N 142 124.515 124.515 128.393 -3.878 18802 5989 1 9 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.253 0.175 18802 5990 1 9 . 1 1 142 142 ILE C C 142 174.331 174.331 174.799 -0.468 18802 5991 1 9 . 1 1 142 142 ILE CA C 142 58.404 58.404 59.568 -1.164 18802 5992 1 9 . 1 1 142 142 ILE CB C 142 38.755 38.755 37.639 1.116 18802 5993 1 9 . 1 1 142 142 ILE H H 142 8.093 8.093 8.374 -0.281 18802 5994 1 9 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.543 -0.193 18802 5995 1 9 . 1 1 143 143 PRO C C 143 176.623 176.623 175.579 1.044 18802 5996 1 9 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.349 1.066 18802 5997 1 9 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.551 -0.318 18802 5998 1 9 . 1 1 144 144 GLN N N 144 121.557 121.557 121.211 0.346 18802 5999 1 9 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.561 -0.255 18802 6000 1 9 . 1 1 144 144 GLN C C 144 174.751 174.751 175.231 -0.480 18802 6001 1 9 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.285 0.386 18802 6002 1 9 . 1 1 144 144 GLN CB C 144 30.118 30.118 30.446 -0.328 18802 6003 1 9 . 1 1 144 144 GLN H H 144 8.392 8.392 8.458 -0.066 18802 6004 1 10 . 1 1 26 26 ALA N N 26 124.085 124.085 121.741 2.344 18802 6005 1 10 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.659 -0.367 18802 6006 1 10 . 1 1 26 26 ALA C C 26 177.101 177.101 177.396 -0.295 18802 6007 1 10 . 1 1 26 26 ALA CA C 26 52.921 52.921 51.635 1.286 18802 6008 1 10 . 1 1 26 26 ALA CB C 26 19.426 19.426 19.863 -0.437 18802 6009 1 10 . 1 1 26 26 ALA H H 26 8.498 8.498 8.498 0.000 18802 6010 1 10 . 1 1 27 27 MET N N 27 119.630 119.630 118.276 1.354 18802 6011 1 10 . 1 1 27 27 MET HA H 27 4.391 4.391 4.415 -0.024 18802 6012 1 10 . 1 1 27 27 MET C C 27 176.296 176.296 175.808 0.488 18802 6013 1 10 . 1 1 27 27 MET CA C 27 55.834 55.834 55.816 0.018 18802 6014 1 10 . 1 1 27 27 MET CB C 27 32.663 32.663 33.126 -0.463 18802 6015 1 10 . 1 1 27 27 MET H H 27 8.441 8.441 8.327 0.114 18802 6016 1 10 . 1 1 28 28 GLU N N 28 122.376 122.376 117.276 5.100 18802 6017 1 10 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.121 0.093 18802 6018 1 10 . 1 1 28 28 GLU C C 28 176.310 176.310 175.406 0.904 18802 6019 1 10 . 1 1 28 28 GLU CA C 28 56.819 56.819 57.042 -0.223 18802 6020 1 10 . 1 1 28 28 GLU CB C 28 30.252 30.252 27.025 3.227 18802 6021 1 10 . 1 1 28 28 GLU H H 28 8.336 8.336 8.499 -0.163 18802 6022 1 10 . 1 1 29 29 GLN N N 29 122.010 122.010 118.551 3.459 18802 6023 1 10 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.169 0.122 18802 6024 1 10 . 1 1 29 29 GLN C C 29 175.765 175.765 175.896 -0.131 18802 6025 1 10 . 1 1 29 29 GLN CA C 29 55.839 55.839 56.062 -0.223 18802 6026 1 10 . 1 1 29 29 GLN CB C 29 29.559 29.559 28.763 0.796 18802 6027 1 10 . 1 1 29 29 GLN H H 29 8.347 8.347 8.109 0.238 18802 6028 1 10 . 1 1 30 30 LYS N N 30 123.090 123.090 126.328 -3.238 18802 6029 1 10 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.469 -0.133 18802 6030 1 10 . 1 1 30 30 LYS C C 30 176.474 176.474 176.486 -0.012 18802 6031 1 10 . 1 1 30 30 LYS CA C 30 56.391 56.391 54.861 1.530 18802 6032 1 10 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.867 0.126 18802 6033 1 10 . 1 1 30 30 LYS H H 30 8.327 8.327 8.488 -0.161 18802 6034 1 10 . 1 1 31 31 THR N N 31 116.800 116.800 119.467 -2.667 18802 6035 1 10 . 1 1 31 31 THR HA H 31 4.273 4.273 4.249 0.024 18802 6036 1 10 . 1 1 31 31 THR C C 31 174.071 174.071 174.514 -0.443 18802 6037 1 10 . 1 1 31 31 THR CA C 31 62.103 62.103 62.862 -0.759 18802 6038 1 10 . 1 1 31 31 THR CB C 31 69.899 69.899 69.108 0.792 18802 6039 1 10 . 1 1 31 31 THR H H 31 8.160 8.160 8.441 -0.281 18802 6040 1 10 . 1 1 32 32 VAL N N 32 124.108 124.108 125.993 -1.885 18802 6041 1 10 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.356 -0.290 18802 6042 1 10 . 1 1 32 32 VAL C C 32 175.573 175.573 174.602 0.971 18802 6043 1 10 . 1 1 32 32 VAL CA C 32 62.344 62.344 61.314 1.030 18802 6044 1 10 . 1 1 32 32 VAL CB C 32 32.912 32.912 33.610 -0.698 18802 6045 1 10 . 1 1 32 32 VAL H H 32 8.192 8.192 8.560 -0.368 18802 6046 1 10 . 1 1 33 33 ILE N N 33 127.371 127.371 129.582 -2.211 18802 6047 1 10 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.547 -0.123 18802 6048 1 10 . 1 1 33 33 ILE C C 33 174.335 174.335 174.040 0.295 18802 6049 1 10 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.499 0.895 18802 6050 1 10 . 1 1 33 33 ILE CB C 33 38.799 38.799 38.148 0.651 18802 6051 1 10 . 1 1 33 33 ILE H H 33 8.275 8.275 8.593 -0.318 18802 6052 1 10 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.427 -0.124 18802 6053 1 10 . 1 1 34 34 PRO C C 34 177.261 177.261 178.097 -0.836 18802 6054 1 10 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.272 0.400 18802 6055 1 10 . 1 1 34 34 PRO CB C 34 32.177 32.177 31.996 0.181 18802 6056 1 10 . 1 1 35 35 GLY N N 35 109.540 109.540 110.628 -1.088 18802 6057 1 10 . 1 1 35 35 GLY C C 35 173.906 173.906 174.499 -0.593 18802 6058 1 10 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.864 0.406 18802 6059 1 10 . 1 1 35 35 GLY H H 35 8.376 8.376 8.566 -0.190 18802 6060 1 10 . 1 1 36 36 MET N N 36 120.834 120.834 121.633 -0.799 18802 6061 1 10 . 1 1 36 36 MET HA H 36 4.780 4.780 4.796 -0.016 18802 6062 1 10 . 1 1 36 36 MET C C 36 174.235 174.235 174.466 -0.231 18802 6063 1 10 . 1 1 36 36 MET CA C 36 53.258 53.258 53.236 0.022 18802 6064 1 10 . 1 1 36 36 MET CB C 36 32.734 32.734 32.621 0.113 18802 6065 1 10 . 1 1 36 36 MET H H 36 7.986 7.986 7.572 0.414 18802 6066 1 10 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.373 0.089 18802 6067 1 10 . 1 1 37 37 PRO C C 37 176.736 176.736 176.116 0.620 18802 6068 1 10 . 1 1 37 37 PRO CA C 37 63.258 63.258 63.094 0.164 18802 6069 1 10 . 1 1 37 37 PRO CB C 37 32.200 32.200 31.683 0.516 18802 6070 1 10 . 1 1 38 38 THR N N 38 115.642 115.642 120.537 -4.895 18802 6071 1 10 . 1 1 38 38 THR HA H 38 4.226 4.226 4.593 -0.367 18802 6072 1 10 . 1 1 38 38 THR C C 38 174.164 174.164 174.538 -0.374 18802 6073 1 10 . 1 1 38 38 THR CA C 38 62.462 62.462 61.779 0.683 18802 6074 1 10 . 1 1 38 38 THR CB C 38 69.874 69.874 70.023 -0.149 18802 6075 1 10 . 1 1 38 38 THR H H 38 8.189 8.189 8.221 -0.032 18802 6076 1 10 . 1 1 39 39 VAL N N 39 123.700 123.700 121.264 2.436 18802 6077 1 10 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.543 -0.464 18802 6078 1 10 . 1 1 39 39 VAL C C 39 175.177 175.177 175.082 0.095 18802 6079 1 10 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.400 0.591 18802 6080 1 10 . 1 1 39 39 VAL CB C 39 32.898 32.898 33.477 -0.579 18802 6081 1 10 . 1 1 39 39 VAL H H 39 8.036 8.036 8.464 -0.428 18802 6082 1 10 . 1 1 40 40 ILE N N 40 127.780 127.780 125.866 1.914 18802 6083 1 10 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.247 -0.070 18802 6084 1 10 . 1 1 40 40 ILE C C 40 173.894 173.894 174.585 -0.691 18802 6085 1 10 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.000 -1.089 18802 6086 1 10 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.795 0.838 18802 6087 1 10 . 1 1 40 40 ILE H H 40 8.236 8.236 8.213 0.023 18802 6088 1 10 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.532 -0.041 18802 6089 1 10 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.368 0.256 18802 6090 1 10 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.103 -0.001 18802 6091 1 10 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.361 -0.106 18802 6092 1 10 . 1 1 42 42 PRO C C 42 177.721 177.721 177.969 -0.248 18802 6093 1 10 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.143 -0.343 18802 6094 1 10 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.839 0.516 18802 6095 1 10 . 1 1 43 43 GLY N N 43 107.305 107.305 108.929 -1.624 18802 6096 1 10 . 1 1 43 43 GLY C C 43 174.642 174.642 173.943 0.699 18802 6097 1 10 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.785 0.933 18802 6098 1 10 . 1 1 43 43 GLY H H 43 8.321 8.321 8.593 -0.272 18802 6099 1 10 . 1 1 44 44 LEU N N 44 120.897 120.897 121.015 -0.118 18802 6100 1 10 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.599 -0.070 18802 6101 1 10 . 1 1 44 44 LEU C C 44 178.580 178.580 176.846 1.734 18802 6102 1 10 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.148 0.402 18802 6103 1 10 . 1 1 44 44 LEU CB C 44 42.579 42.579 43.223 -0.644 18802 6104 1 10 . 1 1 44 44 LEU H H 44 8.043 8.043 7.822 0.221 18802 6105 1 10 . 1 1 45 45 THR N N 45 113.195 113.195 112.480 0.715 18802 6106 1 10 . 1 1 45 45 THR HA H 45 4.386 4.386 4.593 -0.207 18802 6107 1 10 . 1 1 45 45 THR C C 45 175.377 175.377 175.708 -0.331 18802 6108 1 10 . 1 1 45 45 THR CA C 45 61.188 61.188 60.397 0.791 18802 6109 1 10 . 1 1 45 45 THR CB C 45 71.043 71.043 70.684 0.359 18802 6110 1 10 . 1 1 45 45 THR H H 45 8.427 8.427 8.056 0.371 18802 6111 1 10 . 1 1 46 46 ARG N N 46 121.322 121.322 121.570 -0.248 18802 6112 1 10 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.069 -0.031 18802 6113 1 10 . 1 1 46 46 ARG C C 46 179.309 179.309 178.415 0.894 18802 6114 1 10 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.192 0.192 18802 6115 1 10 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.384 0.432 18802 6116 1 10 . 1 1 46 46 ARG H H 46 8.832 8.832 8.893 -0.061 18802 6117 1 10 . 1 1 47 47 GLU N N 47 119.109 119.109 119.963 -0.854 18802 6118 1 10 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.093 -0.084 18802 6119 1 10 . 1 1 47 47 GLU C C 47 178.931 178.931 179.055 -0.124 18802 6120 1 10 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.655 0.621 18802 6121 1 10 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.619 0.672 18802 6122 1 10 . 1 1 47 47 GLU H H 47 8.754 8.754 8.069 0.685 18802 6123 1 10 . 1 1 48 48 GLN N N 48 119.556 119.556 120.001 -0.445 18802 6124 1 10 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.067 -0.001 18802 6125 1 10 . 1 1 48 48 GLN C C 48 179.286 179.286 178.263 1.023 18802 6126 1 10 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.600 -0.385 18802 6127 1 10 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.372 1.295 18802 6128 1 10 . 1 1 48 48 GLN H H 48 7.711 7.711 8.265 -0.554 18802 6129 1 10 . 1 1 49 49 GLU N N 49 122.227 122.227 120.846 1.381 18802 6130 1 10 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.961 -0.088 18802 6131 1 10 . 1 1 49 49 GLU C C 49 177.879 177.879 179.098 -1.219 18802 6132 1 10 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.995 -0.037 18802 6133 1 10 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.507 0.271 18802 6134 1 10 . 1 1 49 49 GLU H H 49 8.730 8.730 8.764 -0.034 18802 6135 1 10 . 1 1 50 50 ARG N N 50 119.109 119.109 118.796 0.313 18802 6136 1 10 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.075 -0.007 18802 6137 1 10 . 1 1 50 50 ARG C C 50 177.567 177.567 178.628 -1.061 18802 6138 1 10 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.101 0.125 18802 6139 1 10 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.270 -0.174 18802 6140 1 10 . 1 1 50 50 ARG H H 50 7.906 7.906 8.060 -0.154 18802 6141 1 10 . 1 1 51 51 ALA N N 51 119.411 119.411 123.073 -3.662 18802 6142 1 10 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.887 -0.083 18802 6143 1 10 . 1 1 51 51 ALA C C 51 178.740 178.740 179.096 -0.356 18802 6144 1 10 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.055 0.180 18802 6145 1 10 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.327 -0.068 18802 6146 1 10 . 1 1 51 51 ALA H H 51 7.956 7.956 8.460 -0.504 18802 6147 1 10 . 1 1 52 52 TYR N N 52 119.160 119.160 119.773 -0.613 18802 6148 1 10 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.144 -0.086 18802 6149 1 10 . 1 1 52 52 TYR C C 52 177.367 177.367 177.596 -0.229 18802 6150 1 10 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.250 0.355 18802 6151 1 10 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.548 0.161 18802 6152 1 10 . 1 1 52 52 TYR H H 52 7.854 7.854 8.249 -0.395 18802 6153 1 10 . 1 1 53 53 ILE N N 53 119.173 119.173 119.504 -0.331 18802 6154 1 10 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.267 0.335 18802 6155 1 10 . 1 1 53 53 ILE C C 53 178.711 178.711 177.963 0.748 18802 6156 1 10 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.435 -1.247 18802 6157 1 10 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.903 0.411 18802 6158 1 10 . 1 1 53 53 ILE H H 53 7.809 7.809 8.251 -0.442 18802 6159 1 10 . 1 1 54 54 VAL N N 54 121.549 121.549 119.725 1.824 18802 6160 1 10 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.487 -0.013 18802 6161 1 10 . 1 1 54 54 VAL C C 54 177.992 177.992 177.480 0.512 18802 6162 1 10 . 1 1 54 54 VAL CA C 54 66.995 66.995 66.828 0.167 18802 6163 1 10 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.194 0.037 18802 6164 1 10 . 1 1 54 54 VAL H H 54 8.572 8.572 8.502 0.070 18802 6165 1 10 . 1 1 55 55 GLN N N 55 119.997 119.997 120.154 -0.157 18802 6166 1 10 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.864 -0.163 18802 6167 1 10 . 1 1 55 55 GLN C C 55 178.604 178.604 178.428 0.176 18802 6168 1 10 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.407 0.787 18802 6169 1 10 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.505 -0.362 18802 6170 1 10 . 1 1 55 55 GLN H H 55 8.183 8.183 7.826 0.357 18802 6171 1 10 . 1 1 56 56 LEU N N 56 119.605 119.605 118.657 0.948 18802 6172 1 10 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.865 0.081 18802 6173 1 10 . 1 1 56 56 LEU C C 56 180.439 180.439 179.364 1.075 18802 6174 1 10 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.540 0.695 18802 6175 1 10 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.441 0.408 18802 6176 1 10 . 1 1 56 56 LEU H H 56 7.586 7.586 7.669 -0.083 18802 6177 1 10 . 1 1 57 57 GLN N N 57 120.332 120.332 118.621 1.711 18802 6178 1 10 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.980 0.129 18802 6179 1 10 . 1 1 57 57 GLN C C 57 179.166 179.166 178.713 0.453 18802 6180 1 10 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.784 0.606 18802 6181 1 10 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.666 0.824 18802 6182 1 10 . 1 1 57 57 GLN H H 57 8.046 8.046 7.401 0.645 18802 6183 1 10 . 1 1 58 58 ILE N N 58 120.945 120.945 120.773 0.172 18802 6184 1 10 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.606 -0.201 18802 6185 1 10 . 1 1 58 58 ILE C C 58 179.368 179.368 177.986 1.382 18802 6186 1 10 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.910 1.156 18802 6187 1 10 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.806 0.450 18802 6188 1 10 . 1 1 58 58 ILE H H 58 8.778 8.778 8.420 0.358 18802 6189 1 10 . 1 1 59 59 GLU N N 59 122.689 122.689 119.216 3.473 18802 6190 1 10 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.954 0.093 18802 6191 1 10 . 1 1 59 59 GLU C C 59 178.901 178.901 178.644 0.257 18802 6192 1 10 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.566 0.298 18802 6193 1 10 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.983 0.553 18802 6194 1 10 . 1 1 59 59 GLU H H 59 8.305 8.305 8.468 -0.163 18802 6195 1 10 . 1 1 60 60 ASP N N 60 121.505 121.505 121.431 0.074 18802 6196 1 10 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.375 0.062 18802 6197 1 10 . 1 1 60 60 ASP C C 60 178.312 178.312 178.665 -0.353 18802 6198 1 10 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.214 0.901 18802 6199 1 10 . 1 1 60 60 ASP CB C 60 42.248 42.248 41.059 1.189 18802 6200 1 10 . 1 1 60 60 ASP H H 60 8.142 8.142 7.798 0.344 18802 6201 1 10 . 1 1 61 61 LEU N N 61 118.666 118.666 119.767 -1.101 18802 6202 1 10 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.893 0.032 18802 6203 1 10 . 1 1 61 61 LEU C C 61 178.866 178.866 179.006 -0.140 18802 6204 1 10 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.168 0.134 18802 6205 1 10 . 1 1 61 61 LEU CB C 61 42.610 42.610 41.912 0.698 18802 6206 1 10 . 1 1 61 61 LEU H H 61 8.425 8.425 8.527 -0.102 18802 6207 1 10 . 1 1 62 62 THR N N 62 115.786 115.786 114.433 1.353 18802 6208 1 10 . 1 1 62 62 THR HA H 62 3.771 3.771 4.027 -0.256 18802 6209 1 10 . 1 1 62 62 THR C C 62 175.988 175.988 176.541 -0.553 18802 6210 1 10 . 1 1 62 62 THR CA C 62 67.649 67.649 66.550 1.099 18802 6211 1 10 . 1 1 62 62 THR CB C 62 68.848 68.848 68.296 0.552 18802 6212 1 10 . 1 1 62 62 THR H H 62 8.340 8.340 8.393 -0.053 18802 6213 1 10 . 1 1 63 63 ARG N N 63 122.111 122.111 121.999 0.112 18802 6214 1 10 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.957 0.032 18802 6215 1 10 . 1 1 63 63 ARG C C 63 179.715 179.715 177.909 1.806 18802 6216 1 10 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.913 0.173 18802 6217 1 10 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.204 -0.393 18802 6218 1 10 . 1 1 63 63 ARG H H 63 8.024 8.024 8.600 -0.576 18802 6219 1 10 . 1 1 64 64 LYS N N 64 120.824 120.824 120.193 0.631 18802 6220 1 10 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.177 -0.323 18802 6221 1 10 . 1 1 64 64 LYS C C 64 178.707 178.707 179.179 -0.472 18802 6222 1 10 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.426 1.129 18802 6223 1 10 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.365 0.813 18802 6224 1 10 . 1 1 64 64 LYS H H 64 8.130 8.130 7.638 0.492 18802 6225 1 10 . 1 1 65 65 LEU N N 65 118.497 118.497 115.250 3.247 18802 6226 1 10 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.220 -0.251 18802 6227 1 10 . 1 1 65 65 LEU C C 65 179.023 179.023 179.053 -0.030 18802 6228 1 10 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.585 -0.304 18802 6229 1 10 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.547 0.843 18802 6230 1 10 . 1 1 65 65 LEU H H 65 8.108 8.108 7.920 0.188 18802 6231 1 10 . 1 1 66 66 ARG N N 66 119.000 119.000 119.124 -0.124 18802 6232 1 10 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.192 0.022 18802 6233 1 10 . 1 1 66 66 ARG C C 66 178.064 178.064 178.667 -0.603 18802 6234 1 10 . 1 1 66 66 ARG CA C 66 58.224 58.224 59.251 -1.027 18802 6235 1 10 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.783 -0.160 18802 6236 1 10 . 1 1 66 66 ARG H H 66 8.102 8.102 8.434 -0.332 18802 6237 1 10 . 1 1 67 67 THR N N 67 109.849 109.849 107.479 2.370 18802 6238 1 10 . 1 1 67 67 THR HA H 67 4.313 4.313 4.360 -0.047 18802 6239 1 10 . 1 1 67 67 THR C C 67 175.834 175.834 176.149 -0.315 18802 6240 1 10 . 1 1 67 67 THR CA C 67 62.681 62.681 62.723 -0.042 18802 6241 1 10 . 1 1 67 67 THR CB C 67 70.768 70.768 70.259 0.509 18802 6242 1 10 . 1 1 67 67 THR H H 67 7.956 7.956 8.048 -0.092 18802 6243 1 10 . 1 1 68 68 GLY N N 68 110.673 110.673 111.399 -0.726 18802 6244 1 10 . 1 1 68 68 GLY C C 68 173.968 173.968 173.391 0.577 18802 6245 1 10 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.095 0.935 18802 6246 1 10 . 1 1 68 68 GLY H H 68 8.016 8.016 8.123 -0.107 18802 6247 1 10 . 1 1 69 69 ASP N N 69 121.490 121.490 120.713 0.777 18802 6248 1 10 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.812 -0.157 18802 6249 1 10 . 1 1 69 69 ASP C C 69 175.983 175.983 176.221 -0.238 18802 6250 1 10 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.362 0.493 18802 6251 1 10 . 1 1 69 69 ASP CB C 69 40.646 40.646 41.049 -0.403 18802 6252 1 10 . 1 1 69 69 ASP H H 69 8.048 8.048 7.750 0.298 18802 6253 1 10 . 1 1 70 70 LEU N N 70 120.838 120.838 125.178 -4.340 18802 6254 1 10 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.459 -0.320 18802 6255 1 10 . 1 1 70 70 LEU C C 70 177.530 177.530 177.644 -0.114 18802 6256 1 10 . 1 1 70 70 LEU CA C 70 55.280 55.280 55.241 0.039 18802 6257 1 10 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.398 -0.262 18802 6258 1 10 . 1 1 70 70 LEU H H 70 7.988 7.988 8.126 -0.138 18802 6259 1 10 . 1 1 71 71 GLY N N 71 108.059 108.059 107.138 0.921 18802 6260 1 10 . 1 1 71 71 GLY C C 71 173.936 173.936 174.774 -0.838 18802 6261 1 10 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.555 0.003 18802 6262 1 10 . 1 1 71 71 GLY H H 71 8.341 8.341 8.218 0.123 18802 6263 1 10 . 1 1 72 72 ILE N N 72 121.037 121.037 121.387 -0.350 18802 6264 1 10 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.405 -0.011 18802 6265 1 10 . 1 1 72 72 ILE C C 72 174.227 174.227 174.260 -0.033 18802 6266 1 10 . 1 1 72 72 ILE CA C 72 58.539 58.539 58.121 0.418 18802 6267 1 10 . 1 1 72 72 ILE CB C 72 38.810 38.810 38.613 0.197 18802 6268 1 10 . 1 1 72 72 ILE H H 72 7.793 7.793 7.855 -0.062 18802 6269 1 10 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.853 -0.231 18802 6270 1 10 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.766 -0.126 18802 6271 1 10 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.214 -0.110 18802 6272 1 10 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.541 -0.169 18802 6273 1 10 . 1 1 74 74 PRO C C 74 176.423 176.423 175.812 0.611 18802 6274 1 10 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.679 0.362 18802 6275 1 10 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.546 -0.516 18802 6276 1 10 . 1 1 75 75 ASN N N 75 119.550 119.550 120.538 -0.988 18802 6277 1 10 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.803 0.126 18802 6278 1 10 . 1 1 75 75 ASN C C 75 174.066 174.066 175.425 -1.359 18802 6279 1 10 . 1 1 75 75 ASN CA C 75 51.151 51.151 51.672 -0.521 18802 6280 1 10 . 1 1 75 75 ASN CB C 75 38.924 38.924 38.608 0.316 18802 6281 1 10 . 1 1 75 75 ASN H H 75 8.422 8.422 8.613 -0.191 18802 6282 1 10 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.258 0.035 18802 6283 1 10 . 1 1 76 76 PRO C C 76 177.322 177.322 177.271 0.051 18802 6284 1 10 . 1 1 76 76 PRO CA C 76 64.384 64.384 64.654 -0.270 18802 6285 1 10 . 1 1 76 76 PRO CB C 76 32.236 32.236 32.024 0.212 18802 6286 1 10 . 1 1 77 77 GLU N N 77 118.523 118.523 115.835 2.688 18802 6287 1 10 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.232 -0.056 18802 6288 1 10 . 1 1 77 77 GLU C C 77 176.403 176.403 177.418 -1.015 18802 6289 1 10 . 1 1 77 77 GLU CA C 77 56.977 56.977 57.552 -0.575 18802 6290 1 10 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.487 1.373 18802 6291 1 10 . 1 1 77 77 GLU H H 77 8.426 8.426 8.582 -0.156 18802 6292 1 10 . 1 1 78 78 ASP N N 78 120.581 120.581 119.231 1.350 18802 6293 1 10 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.530 0.013 18802 6294 1 10 . 1 1 78 78 ASP C C 78 176.085 176.085 177.046 -0.961 18802 6295 1 10 . 1 1 78 78 ASP CA C 78 54.544 54.544 55.923 -1.379 18802 6296 1 10 . 1 1 78 78 ASP CB C 78 41.239 41.239 41.720 -0.481 18802 6297 1 10 . 1 1 78 78 ASP H H 78 7.941 7.941 7.803 0.138 18802 6298 1 10 . 1 1 79 79 ARG N N 79 121.043 121.043 115.277 5.766 18802 6299 1 10 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.016 0.309 18802 6300 1 10 . 1 1 79 79 ARG C C 79 176.123 176.123 176.330 -0.207 18802 6301 1 10 . 1 1 79 79 ARG CA C 79 55.927 55.927 58.379 -2.452 18802 6302 1 10 . 1 1 79 79 ARG CB C 79 30.650 30.650 28.667 1.983 18802 6303 1 10 . 1 1 79 79 ARG H H 79 8.066 8.066 7.526 0.540 18802 6304 1 10 . 1 1 80 80 SER N N 80 118.338 118.338 117.196 1.142 18802 6305 1 10 . 1 1 80 80 SER HA H 80 4.672 4.672 4.873 -0.201 18802 6306 1 10 . 1 1 80 80 SER C C 80 172.577 172.577 172.406 0.171 18802 6307 1 10 . 1 1 80 80 SER CA C 80 56.564 56.564 55.987 0.577 18802 6308 1 10 . 1 1 80 80 SER CB C 80 63.415 63.415 64.701 -1.286 18802 6309 1 10 . 1 1 80 80 SER H H 80 8.281 8.281 8.089 0.192 18802 6310 1 10 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.452 -0.032 18802 6311 1 10 . 1 1 81 81 PRO C C 81 176.727 176.727 176.363 0.364 18802 6312 1 10 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.300 -0.037 18802 6313 1 10 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.271 -0.219 18802 6314 1 10 . 1 1 82 82 SER N N 82 117.341 117.341 117.498 -0.157 18802 6315 1 10 . 1 1 82 82 SER HA H 82 4.693 4.693 4.484 0.209 18802 6316 1 10 . 1 1 82 82 SER C C 82 172.803 172.803 173.464 -0.661 18802 6317 1 10 . 1 1 82 82 SER CA C 82 56.288 56.288 57.727 -1.439 18802 6318 1 10 . 1 1 82 82 SER CB C 82 63.500 63.500 63.037 0.463 18802 6319 1 10 . 1 1 82 82 SER H H 82 8.280 8.280 8.206 0.074 18802 6320 1 10 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.300 0.011 18802 6321 1 10 . 1 1 83 83 PRO C C 83 176.273 176.273 176.717 -0.444 18802 6322 1 10 . 1 1 83 83 PRO CA C 83 63.115 63.115 63.335 -0.220 18802 6323 1 10 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.188 -0.089 18802 6324 1 10 . 1 1 84 84 GLU N N 84 122.213 122.213 125.213 -3.000 18802 6325 1 10 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.234 0.259 18802 6326 1 10 . 1 1 84 84 GLU C C 84 174.546 174.546 174.897 -0.351 18802 6327 1 10 . 1 1 84 84 GLU CA C 84 54.529 54.529 55.010 -0.481 18802 6328 1 10 . 1 1 84 84 GLU CB C 84 29.938 29.938 30.171 -0.233 18802 6329 1 10 . 1 1 84 84 GLU H H 84 8.230 8.230 8.544 -0.314 18802 6330 1 10 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.427 -0.012 18802 6331 1 10 . 1 1 85 85 PRO C C 85 176.024 176.024 175.870 0.154 18802 6332 1 10 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.681 0.561 18802 6333 1 10 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.158 0.031 18802 6334 1 10 . 1 1 86 86 ILE N N 86 120.281 120.281 120.325 -0.044 18802 6335 1 10 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.217 -0.155 18802 6336 1 10 . 1 1 86 86 ILE C C 86 175.419 175.419 176.229 -0.810 18802 6337 1 10 . 1 1 86 86 ILE CA C 86 61.029 61.029 60.702 0.327 18802 6338 1 10 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.139 0.119 18802 6339 1 10 . 1 1 86 86 ILE H H 86 7.980 7.980 7.992 -0.012 18802 6340 1 10 . 1 1 87 87 TYR N N 87 123.089 123.089 125.454 -2.365 18802 6341 1 10 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.567 0.250 18802 6342 1 10 . 1 1 87 87 TYR C C 87 175.920 175.920 176.164 -0.244 18802 6343 1 10 . 1 1 87 87 TYR CA C 87 57.197 57.197 58.572 -1.375 18802 6344 1 10 . 1 1 87 87 TYR CB C 87 40.178 40.178 38.891 1.288 18802 6345 1 10 . 1 1 87 87 TYR H H 87 8.194 8.194 8.490 -0.296 18802 6346 1 10 . 1 1 88 88 ASN N N 88 120.117 120.117 121.363 -1.246 18802 6347 1 10 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.745 -0.000 18802 6348 1 10 . 1 1 88 88 ASN C C 88 176.275 176.275 176.717 -0.442 18802 6349 1 10 . 1 1 88 88 ASN CA C 88 52.286 52.286 53.516 -1.230 18802 6350 1 10 . 1 1 88 88 ASN CB C 88 39.082 39.082 39.051 0.031 18802 6351 1 10 . 1 1 88 88 ASN H H 88 8.386 8.386 8.824 -0.438 18802 6352 1 10 . 1 1 89 89 SER N N 89 115.826 115.826 115.945 -0.119 18802 6353 1 10 . 1 1 89 89 SER HA H 89 4.248 4.248 4.263 -0.015 18802 6354 1 10 . 1 1 89 89 SER C C 89 175.066 175.066 174.589 0.477 18802 6355 1 10 . 1 1 89 89 SER CA C 89 60.012 60.012 60.776 -0.764 18802 6356 1 10 . 1 1 89 89 SER CB C 89 63.400 63.400 63.023 0.377 18802 6357 1 10 . 1 1 89 89 SER H H 89 8.371 8.371 8.780 -0.409 18802 6358 1 10 . 1 1 90 90 GLU N N 90 121.062 121.062 119.576 1.486 18802 6359 1 10 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.337 -0.059 18802 6360 1 10 . 1 1 90 90 GLU C C 90 176.936 176.936 176.920 0.016 18802 6361 1 10 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.041 0.740 18802 6362 1 10 . 1 1 90 90 GLU CB C 90 30.063 30.063 28.904 1.159 18802 6363 1 10 . 1 1 90 90 GLU H H 90 8.018 8.018 8.000 0.018 18802 6364 1 10 . 1 1 91 91 GLY N N 91 108.499 108.499 109.430 -0.931 18802 6365 1 10 . 1 1 91 91 GLY C C 91 174.115 174.115 173.441 0.674 18802 6366 1 10 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.163 0.581 18802 6367 1 10 . 1 1 91 91 GLY H H 91 8.199 8.199 8.165 0.034 18802 6368 1 10 . 1 1 92 92 LYS N N 92 120.638 120.638 120.385 0.253 18802 6369 1 10 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.530 -0.221 18802 6370 1 10 . 1 1 92 92 LYS C C 92 176.453 176.453 174.805 1.648 18802 6371 1 10 . 1 1 92 92 LYS CA C 92 55.856 55.856 54.706 1.150 18802 6372 1 10 . 1 1 92 92 LYS CB C 92 33.109 33.109 34.648 -1.539 18802 6373 1 10 . 1 1 92 92 LYS H H 92 7.956 7.956 7.527 0.429 18802 6374 1 10 . 1 1 93 93 ARG N N 93 122.999 122.999 127.670 -4.671 18802 6375 1 10 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.138 0.053 18802 6376 1 10 . 1 1 93 93 ARG C C 93 176.325 176.325 175.167 1.158 18802 6377 1 10 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.438 0.944 18802 6378 1 10 . 1 1 93 93 ARG CB C 93 30.656 30.656 30.803 -0.147 18802 6379 1 10 . 1 1 93 93 ARG H H 93 8.403 8.403 8.616 -0.213 18802 6380 1 10 . 1 1 94 94 LEU N N 94 124.100 124.100 123.153 0.947 18802 6381 1 10 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.583 -0.320 18802 6382 1 10 . 1 1 94 94 LEU C C 94 176.993 176.993 175.741 1.252 18802 6383 1 10 . 1 1 94 94 LEU CA C 94 55.034 55.034 53.417 1.617 18802 6384 1 10 . 1 1 94 94 LEU CB C 94 42.941 42.941 43.304 -0.363 18802 6385 1 10 . 1 1 94 94 LEU H H 94 8.283 8.283 8.089 0.194 18802 6386 1 10 . 1 1 95 95 ASN N N 95 119.593 119.593 117.334 2.259 18802 6387 1 10 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.682 0.065 18802 6388 1 10 . 1 1 95 95 ASN C C 95 175.598 175.598 174.655 0.943 18802 6389 1 10 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.794 -1.114 18802 6390 1 10 . 1 1 95 95 ASN CB C 95 38.723 38.723 38.896 -0.173 18802 6391 1 10 . 1 1 95 95 ASN H H 95 8.460 8.460 8.198 0.262 18802 6392 1 10 . 1 1 96 96 THR N N 96 114.100 114.100 116.214 -2.114 18802 6393 1 10 . 1 1 96 96 THR HA H 96 4.226 4.226 4.275 -0.049 18802 6394 1 10 . 1 1 96 96 THR C C 96 175.186 175.186 176.155 -0.969 18802 6395 1 10 . 1 1 96 96 THR CA C 96 62.203 62.203 64.857 -2.654 18802 6396 1 10 . 1 1 96 96 THR CB C 96 69.880 69.880 69.367 0.513 18802 6397 1 10 . 1 1 96 96 THR H H 96 8.031 8.031 8.702 -0.671 18802 6398 1 10 . 1 1 97 97 ARG N N 97 122.587 122.587 121.625 0.962 18802 6399 1 10 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.237 -0.124 18802 6400 1 10 . 1 1 97 97 ARG C C 97 177.938 177.938 178.698 -0.760 18802 6401 1 10 . 1 1 97 97 ARG CA C 97 58.412 58.412 60.203 -1.791 18802 6402 1 10 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.585 0.712 18802 6403 1 10 . 1 1 97 97 ARG H H 97 8.502 8.502 8.466 0.036 18802 6404 1 10 . 1 1 98 98 GLU N N 98 121.548 121.548 119.075 2.473 18802 6405 1 10 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.099 -0.082 18802 6406 1 10 . 1 1 98 98 GLU C C 98 177.113 177.113 178.558 -1.445 18802 6407 1 10 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.843 -1.163 18802 6408 1 10 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.771 0.895 18802 6409 1 10 . 1 1 98 98 GLU H H 98 8.517 8.517 8.665 -0.148 18802 6410 1 10 . 1 1 99 99 PHE N N 99 121.388 121.388 119.032 2.356 18802 6411 1 10 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.244 0.078 18802 6412 1 10 . 1 1 99 99 PHE C C 99 177.070 177.070 177.050 0.020 18802 6413 1 10 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.258 -1.183 18802 6414 1 10 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.079 0.407 18802 6415 1 10 . 1 1 99 99 PHE H H 99 8.176 8.176 8.226 -0.050 18802 6416 1 10 . 1 1 100 100 ARG N N 100 120.211 120.211 119.539 0.672 18802 6417 1 10 . 1 1 100 100 ARG C C 100 178.159 178.159 178.451 -0.292 18802 6418 1 10 . 1 1 100 100 ARG CA C 100 58.533 58.533 60.012 -1.479 18802 6419 1 10 . 1 1 100 100 ARG CB C 100 30.588 30.588 30.236 0.352 18802 6420 1 10 . 1 1 100 100 ARG H H 100 8.377 8.377 7.941 0.436 18802 6421 1 10 . 1 1 101 101 THR N N 101 115.416 115.416 115.785 -0.369 18802 6422 1 10 . 1 1 101 101 THR HA H 101 4.022 4.022 4.049 -0.027 18802 6423 1 10 . 1 1 101 101 THR C C 101 175.301 175.301 176.406 -1.105 18802 6424 1 10 . 1 1 101 101 THR CA C 101 65.141 65.141 66.821 -1.680 18802 6425 1 10 . 1 1 101 101 THR CB C 101 69.305 69.305 68.598 0.707 18802 6426 1 10 . 1 1 101 101 THR H H 101 7.992 7.992 7.934 0.058 18802 6427 1 10 . 1 1 102 102 ARG N N 102 122.212 122.212 121.523 0.689 18802 6428 1 10 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.987 0.320 18802 6429 1 10 . 1 1 102 102 ARG C C 102 177.644 177.644 178.114 -0.470 18802 6430 1 10 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.322 1.288 18802 6431 1 10 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.420 -0.612 18802 6432 1 10 . 1 1 102 102 ARG H H 102 8.369 8.369 8.400 -0.031 18802 6433 1 10 . 1 1 103 103 LYS N N 103 117.591 117.591 119.742 -2.151 18802 6434 1 10 . 1 1 103 103 LYS HA H 103 3.960 3.960 4.083 -0.123 18802 6435 1 10 . 1 1 103 103 LYS C C 103 178.913 178.913 178.559 0.354 18802 6436 1 10 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.392 0.659 18802 6437 1 10 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.317 0.824 18802 6438 1 10 . 1 1 103 103 LYS H H 103 7.941 7.941 7.942 -0.001 18802 6439 1 10 . 1 1 104 104 LYS N N 104 119.769 119.769 119.911 -0.142 18802 6440 1 10 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.016 0.130 18802 6441 1 10 . 1 1 104 104 LYS C C 104 179.377 179.377 178.729 0.648 18802 6442 1 10 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.818 0.161 18802 6443 1 10 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.655 0.536 18802 6444 1 10 . 1 1 104 104 LYS H H 104 7.615 7.615 7.367 0.248 18802 6445 1 10 . 1 1 105 105 LEU N N 105 120.500 120.500 118.914 1.586 18802 6446 1 10 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.937 0.180 18802 6447 1 10 . 1 1 105 105 LEU C C 105 179.481 179.481 178.989 0.492 18802 6448 1 10 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.105 0.156 18802 6449 1 10 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.598 0.406 18802 6450 1 10 . 1 1 105 105 LEU H H 105 8.057 8.057 7.803 0.254 18802 6451 1 10 . 1 1 106 106 GLU N N 106 118.803 118.803 118.716 0.087 18802 6452 1 10 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.964 0.025 18802 6453 1 10 . 1 1 106 106 GLU C C 106 180.577 180.577 179.248 1.329 18802 6454 1 10 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.762 0.048 18802 6455 1 10 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.203 0.806 18802 6456 1 10 . 1 1 106 106 GLU H H 106 8.652 8.652 7.892 0.760 18802 6457 1 10 . 1 1 107 107 GLU N N 107 122.396 122.396 119.180 3.216 18802 6458 1 10 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.181 -0.075 18802 6459 1 10 . 1 1 107 107 GLU C C 107 178.457 178.457 179.245 -0.788 18802 6460 1 10 . 1 1 107 107 GLU CA C 107 59.826 59.826 59.194 0.632 18802 6461 1 10 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.156 0.406 18802 6462 1 10 . 1 1 107 107 GLU H H 107 8.281 8.281 8.426 -0.145 18802 6463 1 10 . 1 1 108 108 GLU N N 108 120.976 120.976 119.263 1.713 18802 6464 1 10 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.093 -0.001 18802 6465 1 10 . 1 1 108 108 GLU C C 108 179.343 179.343 179.020 0.323 18802 6466 1 10 . 1 1 108 108 GLU CA C 108 59.696 59.696 58.899 0.797 18802 6467 1 10 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.322 0.248 18802 6468 1 10 . 1 1 108 108 GLU H H 108 8.321 8.321 8.064 0.257 18802 6469 1 10 . 1 1 109 109 ARG N N 109 118.559 118.559 120.312 -1.753 18802 6470 1 10 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.936 -0.144 18802 6471 1 10 . 1 1 109 109 ARG C C 109 177.178 177.178 178.202 -1.024 18802 6472 1 10 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.895 0.588 18802 6473 1 10 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.286 -0.137 18802 6474 1 10 . 1 1 109 109 ARG H H 109 8.594 8.594 8.380 0.214 18802 6475 1 10 . 1 1 110 110 HIS N N 110 119.632 119.632 118.283 1.349 18802 6476 1 10 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.360 -0.019 18802 6477 1 10 . 1 1 110 110 HIS C C 110 177.578 177.578 177.419 0.159 18802 6478 1 10 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.159 1.458 18802 6479 1 10 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.062 0.447 18802 6480 1 10 . 1 1 110 110 HIS H H 110 8.465 8.465 8.747 -0.282 18802 6481 1 10 . 1 1 111 111 ASN N N 111 119.587 119.587 118.271 1.316 18802 6482 1 10 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.354 -0.076 18802 6483 1 10 . 1 1 111 111 ASN C C 111 178.630 178.630 177.717 0.913 18802 6484 1 10 . 1 1 111 111 ASN CA C 111 56.281 56.281 56.465 -0.184 18802 6485 1 10 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.386 -0.691 18802 6486 1 10 . 1 1 111 111 ASN H H 111 8.323 8.323 8.001 0.322 18802 6487 1 10 . 1 1 112 112 LEU N N 112 122.320 122.320 120.563 1.757 18802 6488 1 10 . 1 1 112 112 LEU HA H 112 4.116 4.116 4.002 0.114 18802 6489 1 10 . 1 1 112 112 LEU C C 112 178.539 178.539 178.778 -0.239 18802 6490 1 10 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.797 0.182 18802 6491 1 10 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.776 0.818 18802 6492 1 10 . 1 1 112 112 LEU H H 112 7.966 7.966 7.667 0.299 18802 6493 1 10 . 1 1 113 113 ILE N N 113 121.495 121.495 120.464 1.031 18802 6494 1 10 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.691 -0.455 18802 6495 1 10 . 1 1 113 113 ILE C C 113 176.959 176.959 178.354 -1.395 18802 6496 1 10 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.615 1.439 18802 6497 1 10 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.162 1.441 18802 6498 1 10 . 1 1 113 113 ILE H H 113 8.472 8.472 8.704 -0.232 18802 6499 1 10 . 1 1 114 114 THR N N 114 115.066 115.066 115.758 -0.692 18802 6500 1 10 . 1 1 114 114 THR HA H 114 3.718 3.718 4.016 -0.298 18802 6501 1 10 . 1 1 114 114 THR C C 114 176.559 176.559 176.475 0.084 18802 6502 1 10 . 1 1 114 114 THR CA C 114 66.700 66.700 67.482 -0.782 18802 6503 1 10 . 1 1 114 114 THR CB C 114 68.759 68.759 68.256 0.503 18802 6504 1 10 . 1 1 114 114 THR H H 114 8.075 8.075 8.247 -0.172 18802 6505 1 10 . 1 1 115 115 GLU N N 115 123.259 123.259 121.866 1.393 18802 6506 1 10 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.035 -0.103 18802 6507 1 10 . 1 1 115 115 GLU C C 115 178.191 178.191 178.450 -0.259 18802 6508 1 10 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.117 0.223 18802 6509 1 10 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.625 -0.226 18802 6510 1 10 . 1 1 115 115 GLU H H 115 7.368 7.368 7.424 -0.056 18802 6511 1 10 . 1 1 116 116 MET N N 116 119.844 119.844 119.933 -0.089 18802 6512 1 10 . 1 1 116 116 MET HA H 116 4.014 4.014 3.961 0.053 18802 6513 1 10 . 1 1 116 116 MET C C 116 177.888 177.888 178.097 -0.209 18802 6514 1 10 . 1 1 116 116 MET CA C 116 57.183 57.183 57.007 0.176 18802 6515 1 10 . 1 1 116 116 MET CB C 116 32.126 32.126 31.513 0.613 18802 6516 1 10 . 1 1 116 116 MET H H 116 8.373 8.373 8.418 -0.045 18802 6517 1 10 . 1 1 117 117 VAL N N 117 117.572 117.572 119.009 -1.437 18802 6518 1 10 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.147 -0.251 18802 6519 1 10 . 1 1 117 117 VAL C C 117 177.567 177.567 178.191 -0.624 18802 6520 1 10 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.459 -1.589 18802 6521 1 10 . 1 1 117 117 VAL CB C 117 32.002 32.002 30.679 1.323 18802 6522 1 10 . 1 1 117 117 VAL H H 117 8.279 8.279 8.516 -0.237 18802 6523 1 10 . 1 1 118 118 ALA N N 118 120.560 120.560 121.742 -1.182 18802 6524 1 10 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.155 -0.019 18802 6525 1 10 . 1 1 118 118 ALA C C 118 179.595 179.595 179.555 0.040 18802 6526 1 10 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.754 -0.651 18802 6527 1 10 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.658 -0.408 18802 6528 1 10 . 1 1 118 118 ALA H H 118 7.074 7.074 7.299 -0.225 18802 6529 1 10 . 1 1 119 119 LEU N N 119 117.987 117.987 118.518 -0.531 18802 6530 1 10 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.102 0.038 18802 6531 1 10 . 1 1 119 119 LEU C C 119 177.863 177.863 177.748 0.115 18802 6532 1 10 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.658 0.014 18802 6533 1 10 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.631 0.603 18802 6534 1 10 . 1 1 119 119 LEU H H 119 7.525 7.525 8.059 -0.534 18802 6535 1 10 . 1 1 120 120 ASN N N 120 115.338 115.338 115.365 -0.027 18802 6536 1 10 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.135 -0.117 18802 6537 1 10 . 1 1 120 120 ASN C C 120 172.510 172.510 173.863 -1.353 18802 6538 1 10 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.210 -0.109 18802 6539 1 10 . 1 1 120 120 ASN CB C 120 39.305 39.305 39.938 -0.633 18802 6540 1 10 . 1 1 120 120 ASN H H 120 8.467 8.467 8.148 0.319 18802 6541 1 10 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.486 0.170 18802 6542 1 10 . 1 1 121 121 PRO C C 121 177.020 177.020 176.784 0.236 18802 6543 1 10 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.466 -0.168 18802 6544 1 10 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.267 0.032 18802 6545 1 10 . 1 1 122 122 ASP N N 122 115.744 115.744 117.440 -1.696 18802 6546 1 10 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.616 0.053 18802 6547 1 10 . 1 1 122 122 ASP C C 122 176.004 176.004 176.156 -0.152 18802 6548 1 10 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.751 0.616 18802 6549 1 10 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.245 0.079 18802 6550 1 10 . 1 1 122 122 ASP H H 122 7.600 7.600 7.929 -0.329 18802 6551 1 10 . 1 1 123 123 PHE N N 123 122.722 122.722 121.531 1.191 18802 6552 1 10 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.373 -0.238 18802 6553 1 10 . 1 1 123 123 PHE C C 123 173.954 173.954 174.762 -0.808 18802 6554 1 10 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.879 0.114 18802 6555 1 10 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.551 0.045 18802 6556 1 10 . 1 1 123 123 PHE H H 123 7.940 7.940 7.485 0.455 18802 6557 1 10 . 1 1 124 124 LYS N N 124 129.400 129.400 128.684 0.716 18802 6558 1 10 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.375 0.184 18802 6559 1 10 . 1 1 124 124 LYS C C 124 172.622 172.622 173.679 -1.057 18802 6560 1 10 . 1 1 124 124 LYS CA C 124 51.815 51.815 51.810 0.005 18802 6561 1 10 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.869 0.712 18802 6562 1 10 . 1 1 124 124 LYS H H 124 7.602 7.602 8.105 -0.503 18802 6563 1 10 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.133 -0.044 18802 6564 1 10 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.407 -0.411 18802 6565 1 10 . 1 1 125 125 PRO CB C 125 31.067 31.067 30.945 0.122 18802 6566 1 10 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.389 -0.015 18802 6567 1 10 . 1 1 126 126 PRO C C 126 177.630 177.630 177.954 -0.324 18802 6568 1 10 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.719 0.094 18802 6569 1 10 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.278 0.043 18802 6570 1 10 . 1 1 127 127 ALA N N 127 123.830 123.830 123.573 0.257 18802 6571 1 10 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.071 -0.013 18802 6572 1 10 . 1 1 127 127 ALA C C 127 177.641 177.641 178.553 -0.912 18802 6573 1 10 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.560 0.042 18802 6574 1 10 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.787 0.062 18802 6575 1 10 . 1 1 127 127 ALA H H 127 8.630 8.630 8.519 0.111 18802 6576 1 10 . 1 1 128 128 ASP N N 128 112.924 112.924 116.163 -3.239 18802 6577 1 10 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.620 -0.169 18802 6578 1 10 . 1 1 128 128 ASP C C 128 175.724 175.724 175.375 0.349 18802 6579 1 10 . 1 1 128 128 ASP CA C 128 53.604 53.604 53.838 -0.234 18802 6580 1 10 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.818 -0.400 18802 6581 1 10 . 1 1 128 128 ASP H H 128 8.335 8.335 8.192 0.143 18802 6582 1 10 . 1 1 129 129 TYR N N 129 121.114 121.114 122.023 -0.909 18802 6583 1 10 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.344 0.018 18802 6584 1 10 . 1 1 129 129 TYR C C 129 174.190 174.190 174.428 -0.238 18802 6585 1 10 . 1 1 129 129 TYR CA C 129 58.412 58.412 59.226 -0.814 18802 6586 1 10 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.853 0.206 18802 6587 1 10 . 1 1 129 129 TYR H H 129 7.600 7.600 7.602 -0.002 18802 6588 1 10 . 1 1 130 130 LYS N N 130 129.875 129.875 128.582 1.293 18802 6589 1 10 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.352 -0.034 18802 6590 1 10 . 1 1 130 130 LYS C C 130 172.314 172.314 173.875 -1.561 18802 6591 1 10 . 1 1 130 130 LYS CA C 130 52.570 52.570 52.196 0.374 18802 6592 1 10 . 1 1 130 130 LYS CB C 130 33.663 33.663 33.039 0.624 18802 6593 1 10 . 1 1 130 130 LYS H H 130 7.695 7.695 7.941 -0.246 18802 6594 1 10 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.238 0.039 18802 6595 1 10 . 1 1 131 131 PRO CA C 131 61.058 61.058 60.883 0.175 18802 6596 1 10 . 1 1 131 131 PRO CB C 131 30.852 30.852 30.869 -0.017 18802 6597 1 10 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.306 -0.062 18802 6598 1 10 . 1 1 132 132 PRO C C 132 176.459 176.459 177.752 -1.293 18802 6599 1 10 . 1 1 132 132 PRO CA C 132 62.874 62.874 63.758 -0.884 18802 6600 1 10 . 1 1 132 132 PRO CB C 132 32.047 32.047 31.805 0.242 18802 6601 1 10 . 1 1 133 133 ALA N N 133 124.170 124.170 125.268 -1.098 18802 6602 1 10 . 1 1 133 133 ALA HA H 133 4.250 4.250 3.980 0.270 18802 6603 1 10 . 1 1 133 133 ALA C C 133 177.870 177.870 176.981 0.889 18802 6604 1 10 . 1 1 133 133 ALA CA C 133 52.508 52.508 52.981 -0.473 18802 6605 1 10 . 1 1 133 133 ALA CB C 133 19.303 19.303 17.886 1.417 18802 6606 1 10 . 1 1 133 133 ALA H H 133 8.311 8.311 8.635 -0.324 18802 6607 1 10 . 1 1 134 134 THR N N 134 113.807 113.807 109.063 4.744 18802 6608 1 10 . 1 1 134 134 THR HA H 134 4.228 4.228 3.713 0.515 18802 6609 1 10 . 1 1 134 134 THR C C 134 174.282 174.282 173.630 0.652 18802 6610 1 10 . 1 1 134 134 THR CA C 134 62.127 62.127 63.801 -1.674 18802 6611 1 10 . 1 1 134 134 THR CB C 134 69.870 69.870 67.439 2.431 18802 6612 1 10 . 1 1 134 134 THR H H 134 8.019 8.019 8.041 -0.022 18802 6613 1 10 . 1 1 135 135 ARG N N 135 124.165 124.165 121.870 2.295 18802 6614 1 10 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.436 -0.087 18802 6615 1 10 . 1 1 135 135 ARG C C 135 176.217 176.217 175.072 1.145 18802 6616 1 10 . 1 1 135 135 ARG CA C 135 55.993 55.993 55.677 0.316 18802 6617 1 10 . 1 1 135 135 ARG CB C 135 30.992 30.992 31.145 -0.153 18802 6618 1 10 . 1 1 135 135 ARG H H 135 8.300 8.300 7.703 0.597 18802 6619 1 10 . 1 1 136 136 VAL N N 136 122.157 122.157 127.782 -5.625 18802 6620 1 10 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.414 -0.344 18802 6621 1 10 . 1 1 136 136 VAL C C 136 176.180 176.180 175.295 0.885 18802 6622 1 10 . 1 1 136 136 VAL CA C 136 61.937 61.937 61.681 0.256 18802 6623 1 10 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.513 0.235 18802 6624 1 10 . 1 1 136 136 VAL H H 136 8.233 8.233 8.632 -0.399 18802 6625 1 10 . 1 1 137 137 SER N N 137 118.837 118.837 120.393 -1.556 18802 6626 1 10 . 1 1 137 137 SER HA H 137 4.416 4.416 4.494 -0.078 18802 6627 1 10 . 1 1 137 137 SER C C 137 174.258 174.258 175.139 -0.881 18802 6628 1 10 . 1 1 137 137 SER CA C 137 58.341 58.341 58.754 -0.413 18802 6629 1 10 . 1 1 137 137 SER CB C 137 63.900 63.900 64.267 -0.367 18802 6630 1 10 . 1 1 137 137 SER H H 137 8.264 8.264 8.610 -0.346 18802 6631 1 10 . 1 1 138 138 ASP N N 138 122.871 122.871 121.778 1.093 18802 6632 1 10 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.516 0.021 18802 6633 1 10 . 1 1 138 138 ASP C C 138 176.053 176.053 176.898 -0.845 18802 6634 1 10 . 1 1 138 138 ASP CA C 138 54.489 54.489 56.015 -1.526 18802 6635 1 10 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.009 0.139 18802 6636 1 10 . 1 1 138 138 ASP H H 138 8.249 8.249 8.569 -0.320 18802 6637 1 10 . 1 1 139 139 LYS N N 139 120.944 120.944 118.663 2.281 18802 6638 1 10 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.232 0.028 18802 6639 1 10 . 1 1 139 139 LYS C C 139 176.343 176.343 176.536 -0.193 18802 6640 1 10 . 1 1 139 139 LYS CA C 139 56.261 56.261 57.461 -1.200 18802 6641 1 10 . 1 1 139 139 LYS CB C 139 33.077 33.077 33.031 0.047 18802 6642 1 10 . 1 1 139 139 LYS H H 139 8.084 8.084 7.899 0.185 18802 6643 1 10 . 1 1 140 140 VAL N N 140 121.670 121.670 119.648 2.022 18802 6644 1 10 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.207 -0.195 18802 6645 1 10 . 1 1 140 140 VAL C C 140 175.842 175.842 174.843 0.999 18802 6646 1 10 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.193 1.249 18802 6647 1 10 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.760 0.108 18802 6648 1 10 . 1 1 140 140 VAL H H 140 8.025 8.025 8.078 -0.053 18802 6649 1 10 . 1 1 141 141 MET N N 141 124.839 124.839 127.511 -2.672 18802 6650 1 10 . 1 1 141 141 MET HA H 141 4.453 4.453 4.629 -0.176 18802 6651 1 10 . 1 1 141 141 MET C C 141 175.562 175.562 175.283 0.279 18802 6652 1 10 . 1 1 141 141 MET CA C 141 55.349 55.349 55.118 0.230 18802 6653 1 10 . 1 1 141 141 MET CB C 141 32.993 32.993 32.444 0.549 18802 6654 1 10 . 1 1 141 141 MET H H 141 8.364 8.364 8.539 -0.175 18802 6655 1 10 . 1 1 142 142 ILE N N 142 124.515 124.515 129.462 -4.947 18802 6656 1 10 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.401 0.027 18802 6657 1 10 . 1 1 142 142 ILE C C 142 174.331 174.331 174.227 0.104 18802 6658 1 10 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.096 0.308 18802 6659 1 10 . 1 1 142 142 ILE CB C 142 38.755 38.755 38.431 0.324 18802 6660 1 10 . 1 1 142 142 ILE H H 142 8.093 8.093 8.089 0.004 18802 6661 1 10 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.453 -0.103 18802 6662 1 10 . 1 1 143 143 PRO C C 143 176.623 176.623 175.801 0.822 18802 6663 1 10 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.743 0.672 18802 6664 1 10 . 1 1 143 143 PRO CB C 143 32.233 32.233 31.998 0.235 18802 6665 1 10 . 1 1 144 144 GLN N N 144 121.557 121.557 121.654 -0.097 18802 6666 1 10 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.568 -0.262 18802 6667 1 10 . 1 1 144 144 GLN C C 144 174.751 174.751 175.013 -0.262 18802 6668 1 10 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.590 0.081 18802 6669 1 10 . 1 1 144 144 GLN CB C 144 30.118 30.118 31.246 -1.128 18802 6670 1 10 . 1 1 144 144 GLN H H 144 8.392 8.392 8.479 -0.087 18802 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 103 2.011 -0.085 2.019 18802 2 1 1 "Average Difference" HA 123 0.192 0.056 0.185 18802 3 1 1 "Average Difference" C 115 0.836 -0.038 0.839 18802 4 1 1 "Average Difference" CA 119 0.882 -0.074 0.883 18802 5 1 1 "Average Difference" CB 114 0.719 -0.182 0.699 18802 6 1 1 "Average Difference" HN 103 0.324 0.025 0.324 18802 7 1 2 "Average Difference" N 103 1.789 -0.096 1.795 18802 8 1 2 "Average Difference" HA 123 0.186 0.045 0.182 18802 9 1 2 "Average Difference" C 115 0.798 0.057 0.800 18802 10 1 2 "Average Difference" CA 119 0.840 -0.113 0.836 18802 11 1 2 "Average Difference" CB 114 0.654 -0.239 0.611 18802 12 1 2 "Average Difference" HN 103 0.304 0.026 0.304 18802 13 1 3 "Average Difference" N 103 1.677 -0.288 1.660 18802 14 1 3 "Average Difference" HA 123 0.213 0.049 0.209 18802 15 1 3 "Average Difference" C 115 0.779 0.043 0.782 18802 16 1 3 "Average Difference" CA 119 0.798 -0.142 0.789 18802 17 1 3 "Average Difference" CB 114 0.754 -0.194 0.731 18802 18 1 3 "Average Difference" HN 103 0.337 0.048 0.335 18802 19 1 4 "Average Difference" N 103 2.129 0.080 2.138 18802 20 1 4 "Average Difference" HA 123 0.193 0.033 0.191 18802 21 1 4 "Average Difference" C 115 0.788 0.061 0.789 18802 22 1 4 "Average Difference" CA 119 0.867 -0.072 0.868 18802 23 1 4 "Average Difference" CB 114 0.641 -0.259 0.588 18802 24 1 4 "Average Difference" HN 103 0.343 0.029 0.343 18802 25 1 5 "Average Difference" N 103 1.829 -0.171 1.830 18802 26 1 5 "Average Difference" HA 123 0.196 0.050 0.191 18802 27 1 5 "Average Difference" C 115 0.821 0.013 0.825 18802 28 1 5 "Average Difference" CA 119 0.887 -0.102 0.885 18802 29 1 5 "Average Difference" CB 114 0.732 -0.134 0.723 18802 30 1 5 "Average Difference" HN 103 0.311 0.051 0.308 18802 31 1 6 "Average Difference" N 103 2.124 0.374 2.101 18802 32 1 6 "Average Difference" HA 123 0.172 0.027 0.171 18802 33 1 6 "Average Difference" C 115 0.807 0.072 0.807 18802 34 1 6 "Average Difference" CA 119 0.839 -0.075 0.839 18802 35 1 6 "Average Difference" CB 114 0.658 -0.270 0.603 18802 36 1 6 "Average Difference" HN 103 0.332 0.047 0.331 18802 37 1 7 "Average Difference" N 103 1.949 -0.145 1.953 18802 38 1 7 "Average Difference" HA 123 0.189 0.025 0.188 18802 39 1 7 "Average Difference" C 115 0.764 0.066 0.765 18802 40 1 7 "Average Difference" CA 119 0.885 -0.121 0.881 18802 41 1 7 "Average Difference" CB 114 0.748 -0.315 0.682 18802 42 1 7 "Average Difference" HN 103 0.287 0.035 0.286 18802 43 1 8 "Average Difference" N 103 1.992 0.180 1.994 18802 44 1 8 "Average Difference" HA 123 0.188 0.029 0.186 18802 45 1 8 "Average Difference" C 115 0.795 0.056 0.796 18802 46 1 8 "Average Difference" CA 119 0.907 -0.072 0.908 18802 47 1 8 "Average Difference" CB 114 0.739 -0.239 0.702 18802 48 1 8 "Average Difference" HN 103 0.311 0.046 0.309 18802 49 1 9 "Average Difference" N 103 1.985 0.063 1.994 18802 50 1 9 "Average Difference" HA 123 0.187 0.031 0.185 18802 51 1 9 "Average Difference" C 115 0.729 0.013 0.732 18802 52 1 9 "Average Difference" CA 119 0.885 -0.114 0.881 18802 53 1 9 "Average Difference" CB 114 0.611 -0.206 0.577 18802 54 1 9 "Average Difference" HN 103 0.305 0.041 0.304 18802 55 1 10 "Average Difference" N 103 2.106 -0.113 2.113 18802 56 1 10 "Average Difference" HA 123 0.181 0.022 0.180 18802 57 1 10 "Average Difference" C 115 0.747 0.033 0.750 18802 58 1 10 "Average Difference" CA 119 0.848 -0.003 0.851 18802 59 1 10 "Average Difference" CB 114 0.728 -0.274 0.677 18802 60 1 10 "Average Difference" HN 103 0.303 0.021 0.304 18802 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 18802 _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 26 26 ALA N N 26 124.085 124.085 123.273 0.812 18802 2 1 . 1 1 26 26 ALA HA H 26 4.292 4.292 4.551 -0.259 18802 3 1 . 1 1 26 26 ALA C C 26 177.101 177.101 177.643 -0.542 18802 4 1 . 1 1 26 26 ALA CA C 26 52.921 52.921 52.457 0.463 18802 5 1 . 1 1 26 26 ALA CB C 26 19.426 19.426 19.480 -0.054 18802 6 1 . 1 1 26 26 ALA H H 26 8.498 8.498 8.550 -0.052 18802 7 1 . 1 1 27 27 MET N N 27 119.630 119.630 118.666 0.964 18802 8 1 . 1 1 27 27 MET HA H 27 4.391 4.391 4.482 -0.091 18802 9 1 . 1 1 27 27 MET C C 27 176.296 176.296 175.756 0.540 18802 10 1 . 1 1 27 27 MET CA C 27 55.834 55.834 55.567 0.267 18802 11 1 . 1 1 27 27 MET CB C 27 32.663 32.663 32.440 0.223 18802 12 1 . 1 1 27 27 MET H H 27 8.441 8.441 8.270 0.172 18802 13 1 . 1 1 28 28 GLU N N 28 122.376 122.376 121.743 0.633 18802 14 1 . 1 1 28 28 GLU HA H 28 4.214 4.214 4.368 -0.154 18802 15 1 . 1 1 28 28 GLU C C 28 176.310 176.310 176.004 0.306 18802 16 1 . 1 1 28 28 GLU CA C 28 56.819 56.819 56.500 0.319 18802 17 1 . 1 1 28 28 GLU CB C 28 30.252 30.252 29.818 0.434 18802 18 1 . 1 1 28 28 GLU H H 28 8.336 8.336 8.346 -0.010 18802 19 1 . 1 1 29 29 GLN N N 29 122.010 122.010 120.891 1.119 18802 20 1 . 1 1 29 29 GLN HA H 29 4.291 4.291 4.356 -0.065 18802 21 1 . 1 1 29 29 GLN C C 29 175.765 175.765 175.291 0.474 18802 22 1 . 1 1 29 29 GLN CA C 29 55.839 55.839 55.403 0.436 18802 23 1 . 1 1 29 29 GLN CB C 29 29.559 29.559 29.623 -0.064 18802 24 1 . 1 1 29 29 GLN H H 29 8.347 8.347 8.298 0.049 18802 25 1 . 1 1 30 30 LYS N N 30 123.090 123.090 125.262 -2.172 18802 26 1 . 1 1 30 30 LYS HA H 30 4.336 4.336 4.406 -0.070 18802 27 1 . 1 1 30 30 LYS C C 30 176.474 176.474 176.349 0.125 18802 28 1 . 1 1 30 30 LYS CA C 30 56.391 56.391 56.001 0.390 18802 29 1 . 1 1 30 30 LYS CB C 30 32.993 32.993 32.678 0.316 18802 30 1 . 1 1 30 30 LYS H H 30 8.327 8.327 8.417 -0.090 18802 31 1 . 1 1 31 31 THR N N 31 116.800 116.800 119.295 -2.495 18802 32 1 . 1 1 31 31 THR HA H 31 4.273 4.273 4.296 -0.023 18802 33 1 . 1 1 31 31 THR C C 31 174.071 174.071 174.202 -0.131 18802 34 1 . 1 1 31 31 THR CA C 31 62.103 62.103 62.323 -0.220 18802 35 1 . 1 1 31 31 THR CB C 31 69.899 69.899 69.408 0.491 18802 36 1 . 1 1 31 31 THR H H 31 8.160 8.160 8.481 -0.321 18802 37 1 . 1 1 32 32 VAL N N 32 124.108 124.108 126.148 -2.040 18802 38 1 . 1 1 32 32 VAL HA H 32 4.066 4.066 4.258 -0.192 18802 39 1 . 1 1 32 32 VAL C C 32 175.573 175.573 174.785 0.788 18802 40 1 . 1 1 32 32 VAL CA C 32 62.344 62.344 61.415 0.929 18802 41 1 . 1 1 32 32 VAL CB C 32 32.912 32.912 33.338 -0.426 18802 42 1 . 1 1 32 32 VAL H H 32 8.192 8.192 8.445 -0.253 18802 43 1 . 1 1 33 33 ILE N N 33 127.371 127.371 129.409 -2.038 18802 44 1 . 1 1 33 33 ILE HA H 33 4.424 4.424 4.517 -0.093 18802 45 1 . 1 1 33 33 ILE C C 33 174.335 174.335 174.293 0.042 18802 46 1 . 1 1 33 33 ILE CA C 33 58.394 58.394 57.352 1.042 18802 47 1 . 1 1 33 33 ILE CB C 33 38.799 38.799 37.972 0.827 18802 48 1 . 1 1 33 33 ILE H H 33 8.275 8.275 8.411 -0.136 18802 49 1 . 1 1 34 34 PRO HA H 34 4.303 4.303 4.485 -0.182 18802 50 1 . 1 1 34 34 PRO C C 34 177.261 177.261 177.681 -0.420 18802 51 1 . 1 1 34 34 PRO CA C 34 63.672 63.672 63.237 0.436 18802 52 1 . 1 1 34 34 PRO CB C 34 32.177 32.177 32.082 0.095 18802 53 1 . 1 1 35 35 GLY N N 35 109.540 109.540 111.128 -1.587 18802 54 1 . 1 1 35 35 GLY C C 35 173.906 173.906 174.363 -0.457 18802 55 1 . 1 1 35 35 GLY CA C 35 45.270 45.270 44.832 0.438 18802 56 1 . 1 1 35 35 GLY H H 35 8.376 8.376 8.595 -0.219 18802 57 1 . 1 1 36 36 MET N N 36 120.834 120.834 121.424 -0.590 18802 58 1 . 1 1 36 36 MET HA H 36 4.780 4.780 4.794 -0.014 18802 59 1 . 1 1 36 36 MET C C 36 174.235 174.235 174.210 0.025 18802 60 1 . 1 1 36 36 MET CA C 36 53.258 53.258 52.627 0.631 18802 61 1 . 1 1 36 36 MET CB C 36 32.734 32.734 32.793 -0.059 18802 62 1 . 1 1 36 36 MET H H 36 7.986 7.986 7.746 0.240 18802 63 1 . 1 1 37 37 PRO HA H 37 4.462 4.462 4.542 -0.080 18802 64 1 . 1 1 37 37 PRO C C 37 176.736 176.736 176.205 0.531 18802 65 1 . 1 1 37 37 PRO CA C 37 63.258 63.258 62.776 0.482 18802 66 1 . 1 1 37 37 PRO CB C 37 32.200 32.200 32.051 0.149 18802 67 1 . 1 1 38 38 THR N N 38 115.642 115.642 117.087 -1.445 18802 68 1 . 1 1 38 38 THR HA H 38 4.226 4.226 4.497 -0.271 18802 69 1 . 1 1 38 38 THR C C 38 174.164 174.164 174.435 -0.271 18802 70 1 . 1 1 38 38 THR CA C 38 62.462 62.462 61.765 0.697 18802 71 1 . 1 1 38 38 THR CB C 38 69.874 69.874 69.784 0.090 18802 72 1 . 1 1 38 38 THR H H 38 8.189 8.189 8.234 -0.045 18802 73 1 . 1 1 39 39 VAL N N 39 123.700 123.700 125.830 -2.130 18802 74 1 . 1 1 39 39 VAL HA H 39 4.079 4.079 4.349 -0.270 18802 75 1 . 1 1 39 39 VAL C C 39 175.177 175.177 175.157 0.020 18802 76 1 . 1 1 39 39 VAL CA C 39 61.991 61.991 61.515 0.476 18802 77 1 . 1 1 39 39 VAL CB C 39 32.898 32.898 32.961 -0.063 18802 78 1 . 1 1 39 39 VAL H H 39 8.036 8.036 8.540 -0.504 18802 79 1 . 1 1 40 40 ILE N N 40 127.780 127.780 128.398 -0.618 18802 80 1 . 1 1 40 40 ILE HA H 40 4.177 4.177 4.123 0.054 18802 81 1 . 1 1 40 40 ILE C C 40 173.894 173.894 174.646 -0.752 18802 82 1 . 1 1 40 40 ILE CA C 40 57.911 57.911 59.289 -1.378 18802 83 1 . 1 1 40 40 ILE CB C 40 38.633 38.633 37.777 0.856 18802 84 1 . 1 1 40 40 ILE H H 40 8.236 8.236 8.351 -0.115 18802 85 1 . 1 1 41 41 PRO HA H 41 4.491 4.491 4.627 -0.136 18802 86 1 . 1 1 41 41 PRO CA C 41 61.624 61.624 61.226 0.398 18802 87 1 . 1 1 41 41 PRO CB C 41 31.102 31.102 31.095 0.007 18802 88 1 . 1 1 42 42 PRO HA H 42 4.255 4.255 4.354 -0.099 18802 89 1 . 1 1 42 42 PRO C C 42 177.721 177.721 177.922 -0.202 18802 90 1 . 1 1 42 42 PRO CA C 42 62.800 62.800 63.040 -0.240 18802 91 1 . 1 1 42 42 PRO CB C 42 32.355 32.355 31.943 0.412 18802 92 1 . 1 1 43 43 GLY N N 43 107.305 107.305 108.574 -1.269 18802 93 1 . 1 1 43 43 GLY C C 43 174.642 174.642 173.915 0.727 18802 94 1 . 1 1 43 43 GLY CA C 43 45.718 45.718 44.810 0.908 18802 95 1 . 1 1 43 43 GLY H H 43 8.321 8.321 8.552 -0.231 18802 96 1 . 1 1 44 44 LEU N N 44 120.897 120.897 121.776 -0.879 18802 97 1 . 1 1 44 44 LEU HA H 44 4.529 4.529 4.527 0.002 18802 98 1 . 1 1 44 44 LEU C C 44 178.580 178.580 176.580 2.000 18802 99 1 . 1 1 44 44 LEU CA C 44 54.550 54.550 54.216 0.334 18802 100 1 . 1 1 44 44 LEU CB C 44 42.579 42.579 43.009 -0.430 18802 101 1 . 1 1 44 44 LEU H H 44 8.043 8.043 7.700 0.343 18802 102 1 . 1 1 45 45 THR N N 45 113.195 113.195 112.280 0.915 18802 103 1 . 1 1 45 45 THR HA H 45 4.386 4.386 4.552 -0.166 18802 104 1 . 1 1 45 45 THR C C 45 175.377 175.377 175.615 -0.238 18802 105 1 . 1 1 45 45 THR CA C 45 61.188 61.188 60.381 0.807 18802 106 1 . 1 1 45 45 THR CB C 45 71.043 71.043 70.912 0.131 18802 107 1 . 1 1 45 45 THR H H 45 8.427 8.427 8.088 0.339 18802 108 1 . 1 1 46 46 ARG N N 46 121.322 121.322 122.073 -0.751 18802 109 1 . 1 1 46 46 ARG HA H 46 4.037 4.037 4.188 -0.151 18802 110 1 . 1 1 46 46 ARG C C 46 179.309 179.309 178.170 1.139 18802 111 1 . 1 1 46 46 ARG CA C 46 59.384 59.384 59.207 0.177 18802 112 1 . 1 1 46 46 ARG CB C 46 29.816 29.816 29.359 0.457 18802 113 1 . 1 1 46 46 ARG H H 46 8.832 8.832 8.894 -0.062 18802 114 1 . 1 1 47 47 GLU N N 47 119.109 119.109 119.876 -0.767 18802 115 1 . 1 1 47 47 GLU HA H 47 4.009 4.009 4.103 -0.094 18802 116 1 . 1 1 47 47 GLU C C 47 178.931 178.931 178.963 -0.032 18802 117 1 . 1 1 47 47 GLU CA C 47 60.276 60.276 59.739 0.537 18802 118 1 . 1 1 47 47 GLU CB C 47 29.291 29.291 28.598 0.693 18802 119 1 . 1 1 47 47 GLU H H 47 8.754 8.754 8.441 0.313 18802 120 1 . 1 1 48 48 GLN N N 48 119.556 119.556 119.930 -0.374 18802 121 1 . 1 1 48 48 GLN HA H 48 4.066 4.066 4.043 0.023 18802 122 1 . 1 1 48 48 GLN C C 48 179.286 179.286 178.240 1.046 18802 123 1 . 1 1 48 48 GLN CA C 48 58.215 58.215 58.714 -0.499 18802 124 1 . 1 1 48 48 GLN CB C 48 29.667 29.667 28.417 1.250 18802 125 1 . 1 1 48 48 GLN H H 48 7.711 7.711 7.991 -0.280 18802 126 1 . 1 1 49 49 GLU N N 49 122.227 122.227 120.796 1.431 18802 127 1 . 1 1 49 49 GLU HA H 49 3.873 3.873 3.953 -0.080 18802 128 1 . 1 1 49 49 GLU C C 49 177.879 177.879 179.076 -1.197 18802 129 1 . 1 1 49 49 GLU CA C 49 59.958 59.958 59.985 -0.027 18802 130 1 . 1 1 49 49 GLU CB C 49 29.778 29.778 29.504 0.274 18802 131 1 . 1 1 49 49 GLU H H 49 8.730 8.730 8.714 0.016 18802 132 1 . 1 1 50 50 ARG N N 50 119.109 119.109 118.736 0.374 18802 133 1 . 1 1 50 50 ARG HA H 50 4.069 4.069 4.070 -0.001 18802 134 1 . 1 1 50 50 ARG C C 50 177.567 177.567 178.619 -1.052 18802 135 1 . 1 1 50 50 ARG CA C 50 58.226 58.226 58.102 0.124 18802 136 1 . 1 1 50 50 ARG CB C 50 29.096 29.096 29.296 -0.200 18802 137 1 . 1 1 50 50 ARG H H 50 7.906 7.906 8.104 -0.198 18802 138 1 . 1 1 51 51 ALA N N 51 119.411 119.411 123.006 -3.595 18802 139 1 . 1 1 51 51 ALA HA H 51 3.804 3.804 3.880 -0.076 18802 140 1 . 1 1 51 51 ALA C C 51 178.740 178.740 179.082 -0.342 18802 141 1 . 1 1 51 51 ALA CA C 51 55.235 55.235 55.035 0.201 18802 142 1 . 1 1 51 51 ALA CB C 51 18.259 18.259 18.289 -0.030 18802 143 1 . 1 1 51 51 ALA H H 51 7.956 7.956 8.351 -0.395 18802 144 1 . 1 1 52 52 TYR N N 52 119.160 119.160 120.086 -0.926 18802 145 1 . 1 1 52 52 TYR HA H 52 4.058 4.058 4.181 -0.123 18802 146 1 . 1 1 52 52 TYR C C 52 177.367 177.367 177.600 -0.233 18802 147 1 . 1 1 52 52 TYR CA C 52 61.605 61.605 61.204 0.401 18802 148 1 . 1 1 52 52 TYR CB C 52 38.709 38.709 38.540 0.169 18802 149 1 . 1 1 52 52 TYR H H 52 7.854 7.854 7.990 -0.136 18802 150 1 . 1 1 53 53 ILE N N 53 119.173 119.173 119.496 -0.323 18802 151 1 . 1 1 53 53 ILE HA H 53 3.602 3.602 3.225 0.377 18802 152 1 . 1 1 53 53 ILE C C 53 178.711 178.711 177.955 0.756 18802 153 1 . 1 1 53 53 ILE CA C 53 64.188 64.188 65.505 -1.317 18802 154 1 . 1 1 53 53 ILE CB C 53 38.314 38.314 37.953 0.361 18802 155 1 . 1 1 53 53 ILE H H 53 7.809 7.809 8.313 -0.504 18802 156 1 . 1 1 54 54 VAL N N 54 121.549 121.549 119.304 2.245 18802 157 1 . 1 1 54 54 VAL HA H 54 3.474 3.474 3.639 -0.165 18802 158 1 . 1 1 54 54 VAL C C 54 177.992 177.992 177.825 0.167 18802 159 1 . 1 1 54 54 VAL CA C 54 66.995 66.995 66.227 0.768 18802 160 1 . 1 1 54 54 VAL CB C 54 31.231 31.231 31.140 0.091 18802 161 1 . 1 1 54 54 VAL H H 54 8.572 8.572 8.511 0.061 18802 162 1 . 1 1 55 55 GLN N N 55 119.997 119.997 120.181 -0.184 18802 163 1 . 1 1 55 55 GLN HA H 55 3.701 3.701 3.891 -0.191 18802 164 1 . 1 1 55 55 GLN C C 55 178.604 178.604 178.449 0.155 18802 165 1 . 1 1 55 55 GLN CA C 55 60.195 60.195 59.206 0.989 18802 166 1 . 1 1 55 55 GLN CB C 55 28.142 28.142 28.550 -0.408 18802 167 1 . 1 1 55 55 GLN H H 55 8.183 8.183 7.830 0.352 18802 168 1 . 1 1 56 56 LEU N N 56 119.605 119.605 118.969 0.636 18802 169 1 . 1 1 56 56 LEU HA H 56 3.946 3.946 3.906 0.040 18802 170 1 . 1 1 56 56 LEU C C 56 180.439 180.439 179.318 1.121 18802 171 1 . 1 1 56 56 LEU CA C 56 58.235 58.235 57.597 0.638 18802 172 1 . 1 1 56 56 LEU CB C 56 41.849 41.849 41.433 0.416 18802 173 1 . 1 1 56 56 LEU H H 56 7.586 7.586 7.630 -0.044 18802 174 1 . 1 1 57 57 GLN N N 57 120.332 120.332 118.611 1.721 18802 175 1 . 1 1 57 57 GLN HA H 57 4.109 4.109 3.964 0.145 18802 176 1 . 1 1 57 57 GLN C C 57 179.166 179.166 178.729 0.436 18802 177 1 . 1 1 57 57 GLN CA C 57 59.390 59.390 58.839 0.551 18802 178 1 . 1 1 57 57 GLN CB C 57 29.490 29.490 28.684 0.806 18802 179 1 . 1 1 57 57 GLN H H 57 8.046 8.046 7.543 0.503 18802 180 1 . 1 1 58 58 ILE N N 58 120.945 120.945 120.836 0.109 18802 181 1 . 1 1 58 58 ILE HA H 58 3.405 3.405 3.564 -0.159 18802 182 1 . 1 1 58 58 ILE C C 58 179.368 179.368 177.972 1.396 18802 183 1 . 1 1 58 58 ILE CA C 58 67.066 67.066 65.894 1.172 18802 184 1 . 1 1 58 58 ILE CB C 58 38.256 38.256 37.782 0.474 18802 185 1 . 1 1 58 58 ILE H H 58 8.778 8.778 8.479 0.299 18802 186 1 . 1 1 59 59 GLU N N 59 122.689 122.689 119.091 3.598 18802 187 1 . 1 1 59 59 GLU HA H 59 4.047 4.047 3.943 0.104 18802 188 1 . 1 1 59 59 GLU C C 59 178.901 178.901 178.648 0.253 18802 189 1 . 1 1 59 59 GLU CA C 59 59.864 59.864 59.470 0.394 18802 190 1 . 1 1 59 59 GLU CB C 59 29.536 29.536 28.948 0.588 18802 191 1 . 1 1 59 59 GLU H H 59 8.305 8.305 8.531 -0.227 18802 192 1 . 1 1 60 60 ASP N N 60 121.505 121.505 121.353 0.152 18802 193 1 . 1 1 60 60 ASP HA H 60 4.437 4.437 4.379 0.058 18802 194 1 . 1 1 60 60 ASP C C 60 178.312 178.312 178.662 -0.350 18802 195 1 . 1 1 60 60 ASP CA C 60 58.115 58.115 57.267 0.848 18802 196 1 . 1 1 60 60 ASP CB C 60 42.248 42.248 41.007 1.241 18802 197 1 . 1 1 60 60 ASP H H 60 8.142 8.142 7.831 0.310 18802 198 1 . 1 1 61 61 LEU N N 61 118.666 118.666 119.980 -1.314 18802 199 1 . 1 1 61 61 LEU HA H 61 3.925 3.925 3.905 0.020 18802 200 1 . 1 1 61 61 LEU C C 61 178.866 178.866 179.053 -0.187 18802 201 1 . 1 1 61 61 LEU CA C 61 58.302 58.302 58.227 0.075 18802 202 1 . 1 1 61 61 LEU CB C 61 42.610 42.610 41.978 0.632 18802 203 1 . 1 1 61 61 LEU H H 61 8.425 8.425 8.436 -0.011 18802 204 1 . 1 1 62 62 THR N N 62 115.786 115.786 114.607 1.179 18802 205 1 . 1 1 62 62 THR HA H 62 3.771 3.771 3.962 -0.191 18802 206 1 . 1 1 62 62 THR C C 62 175.988 175.988 176.379 -0.392 18802 207 1 . 1 1 62 62 THR CA C 62 67.649 67.649 66.988 0.661 18802 208 1 . 1 1 62 62 THR CB C 62 68.848 68.848 68.439 0.409 18802 209 1 . 1 1 62 62 THR H H 62 8.340 8.340 8.435 -0.095 18802 210 1 . 1 1 63 63 ARG N N 63 122.111 122.111 121.747 0.364 18802 211 1 . 1 1 63 63 ARG HA H 63 3.989 3.989 3.957 0.032 18802 212 1 . 1 1 63 63 ARG C C 63 179.715 179.715 177.846 1.869 18802 213 1 . 1 1 63 63 ARG CA C 63 60.086 60.086 59.756 0.330 18802 214 1 . 1 1 63 63 ARG CB C 63 29.811 29.811 30.174 -0.363 18802 215 1 . 1 1 63 63 ARG H H 63 8.024 8.024 8.391 -0.367 18802 216 1 . 1 1 64 64 LYS N N 64 120.824 120.824 120.223 0.601 18802 217 1 . 1 1 64 64 LYS HA H 64 3.854 3.854 4.143 -0.289 18802 218 1 . 1 1 64 64 LYS C C 64 178.707 178.707 179.181 -0.474 18802 219 1 . 1 1 64 64 LYS CA C 64 60.555 60.555 59.475 1.080 18802 220 1 . 1 1 64 64 LYS CB C 64 33.178 33.178 32.359 0.819 18802 221 1 . 1 1 64 64 LYS H H 64 8.130 8.130 7.649 0.481 18802 222 1 . 1 1 65 65 LEU N N 65 118.497 118.497 115.490 3.007 18802 223 1 . 1 1 65 65 LEU HA H 65 3.969 3.969 4.164 -0.195 18802 224 1 . 1 1 65 65 LEU C C 65 179.023 179.023 178.860 0.163 18802 225 1 . 1 1 65 65 LEU CA C 65 57.281 57.281 57.544 -0.263 18802 226 1 . 1 1 65 65 LEU CB C 65 42.390 42.390 41.457 0.933 18802 227 1 . 1 1 65 65 LEU H H 65 8.108 8.108 8.017 0.091 18802 228 1 . 1 1 66 66 ARG N N 66 119.000 119.000 118.759 0.241 18802 229 1 . 1 1 66 66 ARG HA H 66 4.214 4.214 4.177 0.037 18802 230 1 . 1 1 66 66 ARG C C 66 178.064 178.064 178.485 -0.421 18802 231 1 . 1 1 66 66 ARG CA C 66 58.224 58.224 58.815 -0.591 18802 232 1 . 1 1 66 66 ARG CB C 66 30.623 30.623 30.711 -0.088 18802 233 1 . 1 1 66 66 ARG H H 66 8.102 8.102 8.287 -0.185 18802 234 1 . 1 1 67 67 THR N N 67 109.849 109.849 108.531 1.318 18802 235 1 . 1 1 67 67 THR HA H 67 4.313 4.313 4.439 -0.127 18802 236 1 . 1 1 67 67 THR C C 67 175.834 175.834 175.835 -0.000 18802 237 1 . 1 1 67 67 THR CA C 67 62.681 62.681 62.199 0.482 18802 238 1 . 1 1 67 67 THR CB C 67 70.768 70.768 70.159 0.609 18802 239 1 . 1 1 67 67 THR H H 67 7.956 7.956 8.055 -0.099 18802 240 1 . 1 1 68 68 GLY N N 68 110.673 110.673 111.071 -0.398 18802 241 1 . 1 1 68 68 GLY C C 68 173.968 173.968 173.530 0.438 18802 242 1 . 1 1 68 68 GLY CA C 68 46.030 46.030 45.036 0.994 18802 243 1 . 1 1 68 68 GLY H H 68 8.016 8.016 8.102 -0.086 18802 244 1 . 1 1 69 69 ASP N N 69 121.490 121.490 120.872 0.618 18802 245 1 . 1 1 69 69 ASP HA H 69 4.655 4.655 4.793 -0.138 18802 246 1 . 1 1 69 69 ASP C C 69 175.983 175.983 176.290 -0.307 18802 247 1 . 1 1 69 69 ASP CA C 69 53.855 53.855 53.349 0.506 18802 248 1 . 1 1 69 69 ASP CB C 69 40.646 40.646 40.748 -0.102 18802 249 1 . 1 1 69 69 ASP H H 69 8.048 8.048 7.767 0.281 18802 250 1 . 1 1 70 70 LEU N N 70 120.838 120.838 125.349 -4.511 18802 251 1 . 1 1 70 70 LEU HA H 70 4.139 4.139 4.490 -0.351 18802 252 1 . 1 1 70 70 LEU C C 70 177.530 177.530 177.953 -0.424 18802 253 1 . 1 1 70 70 LEU CA C 70 55.280 55.280 54.808 0.472 18802 254 1 . 1 1 70 70 LEU CB C 70 42.136 42.136 42.631 -0.495 18802 255 1 . 1 1 70 70 LEU H H 70 7.988 7.988 7.957 0.031 18802 256 1 . 1 1 71 71 GLY N N 71 108.059 108.059 107.046 1.013 18802 257 1 . 1 1 71 71 GLY C C 71 173.936 173.936 174.569 -0.633 18802 258 1 . 1 1 71 71 GLY CA C 71 45.558 45.558 45.622 -0.064 18802 259 1 . 1 1 71 71 GLY H H 71 8.341 8.341 8.357 -0.016 18802 260 1 . 1 1 72 72 ILE N N 72 121.037 121.037 121.735 -0.698 18802 261 1 . 1 1 72 72 ILE HA H 72 4.394 4.394 4.385 0.009 18802 262 1 . 1 1 72 72 ILE C C 72 174.227 174.227 174.505 -0.278 18802 263 1 . 1 1 72 72 ILE CA C 72 58.539 58.539 57.911 0.628 18802 264 1 . 1 1 72 72 ILE CB C 72 38.810 38.810 38.468 0.342 18802 265 1 . 1 1 72 72 ILE H H 72 7.793 7.793 7.835 -0.042 18802 266 1 . 1 1 73 73 PRO HA H 73 4.622 4.622 4.697 -0.075 18802 267 1 . 1 1 73 73 PRO CA C 73 61.640 61.640 61.757 -0.117 18802 268 1 . 1 1 73 73 PRO CB C 73 31.104 31.104 31.263 -0.159 18802 269 1 . 1 1 74 74 PRO HA H 74 4.372 4.372 4.468 -0.096 18802 270 1 . 1 1 74 74 PRO C C 74 176.423 176.423 175.950 0.473 18802 271 1 . 1 1 74 74 PRO CA C 74 63.041 63.041 62.847 0.194 18802 272 1 . 1 1 74 74 PRO CB C 74 32.030 32.030 32.422 -0.392 18802 273 1 . 1 1 75 75 ASN N N 75 119.550 119.550 120.745 -1.195 18802 274 1 . 1 1 75 75 ASN HA H 75 4.929 4.929 4.872 0.057 18802 275 1 . 1 1 75 75 ASN C C 75 174.066 174.066 175.485 -1.419 18802 276 1 . 1 1 75 75 ASN CA C 75 51.151 51.151 50.738 0.413 18802 277 1 . 1 1 75 75 ASN CB C 75 38.924 38.924 38.816 0.108 18802 278 1 . 1 1 75 75 ASN H H 75 8.422 8.422 8.427 -0.005 18802 279 1 . 1 1 76 76 PRO HA H 76 4.293 4.293 4.258 0.035 18802 280 1 . 1 1 76 76 PRO C C 76 177.322 177.322 177.784 -0.462 18802 281 1 . 1 1 76 76 PRO CA C 76 64.384 64.384 64.927 -0.543 18802 282 1 . 1 1 76 76 PRO CB C 76 32.236 32.236 31.945 0.291 18802 283 1 . 1 1 77 77 GLU N N 77 118.523 118.523 116.440 2.083 18802 284 1 . 1 1 77 77 GLU HA H 77 4.176 4.176 4.209 -0.033 18802 285 1 . 1 1 77 77 GLU C C 77 176.403 176.403 177.678 -1.275 18802 286 1 . 1 1 77 77 GLU CA C 77 56.977 56.977 57.732 -0.756 18802 287 1 . 1 1 77 77 GLU CB C 77 29.860 29.860 28.607 1.253 18802 288 1 . 1 1 77 77 GLU H H 77 8.426 8.426 8.580 -0.154 18802 289 1 . 1 1 78 78 ASP N N 78 120.581 120.581 119.260 1.321 18802 290 1 . 1 1 78 78 ASP HA H 78 4.543 4.543 4.514 0.029 18802 291 1 . 1 1 78 78 ASP C C 78 176.085 176.085 176.799 -0.715 18802 292 1 . 1 1 78 78 ASP CA C 78 54.544 54.544 55.506 -0.962 18802 293 1 . 1 1 78 78 ASP CB C 78 41.239 41.239 41.198 0.041 18802 294 1 . 1 1 78 78 ASP H H 78 7.941 7.941 7.862 0.079 18802 295 1 . 1 1 79 79 ARG N N 79 121.043 121.043 117.976 3.067 18802 296 1 . 1 1 79 79 ARG HA H 79 4.325 4.325 4.254 0.071 18802 297 1 . 1 1 79 79 ARG C C 79 176.123 176.123 176.526 -0.403 18802 298 1 . 1 1 79 79 ARG CA C 79 55.927 55.927 56.046 -0.119 18802 299 1 . 1 1 79 79 ARG CB C 79 30.650 30.650 29.029 1.621 18802 300 1 . 1 1 79 79 ARG H H 79 8.066 8.066 7.580 0.486 18802 301 1 . 1 1 80 80 SER N N 80 118.338 118.338 118.048 0.290 18802 302 1 . 1 1 80 80 SER HA H 80 4.672 4.672 4.662 0.010 18802 303 1 . 1 1 80 80 SER C C 80 172.577 172.577 173.040 -0.462 18802 304 1 . 1 1 80 80 SER CA C 80 56.564 56.564 56.931 -0.367 18802 305 1 . 1 1 80 80 SER CB C 80 63.415 63.415 63.421 -0.006 18802 306 1 . 1 1 80 80 SER H H 80 8.281 8.281 7.766 0.515 18802 307 1 . 1 1 81 81 PRO HA H 81 4.420 4.420 4.407 0.013 18802 308 1 . 1 1 81 81 PRO C C 81 176.727 176.727 176.139 0.588 18802 309 1 . 1 1 81 81 PRO CA C 81 63.263 63.263 63.345 -0.082 18802 310 1 . 1 1 81 81 PRO CB C 81 32.052 32.052 32.108 -0.056 18802 311 1 . 1 1 82 82 SER N N 82 117.341 117.341 118.880 -1.539 18802 312 1 . 1 1 82 82 SER HA H 82 4.693 4.693 4.687 0.006 18802 313 1 . 1 1 82 82 SER C C 82 172.803 172.803 172.911 -0.108 18802 314 1 . 1 1 82 82 SER CA C 82 56.288 56.288 56.772 -0.484 18802 315 1 . 1 1 82 82 SER CB C 82 63.500 63.500 63.347 0.153 18802 316 1 . 1 1 82 82 SER H H 82 8.280 8.280 8.239 0.041 18802 317 1 . 1 1 83 83 PRO HA H 83 4.311 4.311 4.473 -0.162 18802 318 1 . 1 1 83 83 PRO C C 83 176.273 176.273 176.004 0.269 18802 319 1 . 1 1 83 83 PRO CA C 83 63.115 63.115 62.838 0.277 18802 320 1 . 1 1 83 83 PRO CB C 83 32.099 32.099 32.305 -0.206 18802 321 1 . 1 1 84 84 GLU N N 84 122.213 122.213 122.419 -0.206 18802 322 1 . 1 1 84 84 GLU HA H 84 4.493 4.493 4.391 0.102 18802 323 1 . 1 1 84 84 GLU C C 84 174.546 174.546 175.203 -0.657 18802 324 1 . 1 1 84 84 GLU CA C 84 54.529 54.529 54.604 -0.075 18802 325 1 . 1 1 84 84 GLU CB C 84 29.938 29.938 29.542 0.396 18802 326 1 . 1 1 84 84 GLU H H 84 8.230 8.230 8.461 -0.231 18802 327 1 . 1 1 85 85 PRO HA H 85 4.415 4.415 4.386 0.029 18802 328 1 . 1 1 85 85 PRO C C 85 176.024 176.024 175.818 0.206 18802 329 1 . 1 1 85 85 PRO CA C 85 63.242 63.242 62.812 0.429 18802 330 1 . 1 1 85 85 PRO CB C 85 32.189 32.189 32.191 -0.002 18802 331 1 . 1 1 86 86 ILE N N 86 120.281 120.281 121.104 -0.823 18802 332 1 . 1 1 86 86 ILE HA H 86 4.062 4.062 4.176 -0.114 18802 333 1 . 1 1 86 86 ILE C C 86 175.419 175.419 175.731 -0.312 18802 334 1 . 1 1 86 86 ILE CA C 86 61.029 61.029 60.877 0.153 18802 335 1 . 1 1 86 86 ILE CB C 86 39.258 39.258 39.183 0.075 18802 336 1 . 1 1 86 86 ILE H H 86 7.980 7.980 8.066 -0.086 18802 337 1 . 1 1 87 87 TYR N N 87 123.089 123.089 124.886 -1.797 18802 338 1 . 1 1 87 87 TYR HA H 87 4.817 4.817 4.689 0.128 18802 339 1 . 1 1 87 87 TYR C C 87 175.920 175.920 176.169 -0.249 18802 340 1 . 1 1 87 87 TYR CA C 87 57.197 57.197 57.821 -0.624 18802 341 1 . 1 1 87 87 TYR CB C 87 40.178 40.178 39.364 0.814 18802 342 1 . 1 1 87 87 TYR H H 87 8.194 8.194 8.480 -0.286 18802 343 1 . 1 1 88 88 ASN N N 88 120.117 120.117 120.678 -0.560 18802 344 1 . 1 1 88 88 ASN HA H 88 4.745 4.745 4.778 -0.033 18802 345 1 . 1 1 88 88 ASN C C 88 176.275 176.275 176.939 -0.664 18802 346 1 . 1 1 88 88 ASN CA C 88 52.286 52.286 53.028 -0.742 18802 347 1 . 1 1 88 88 ASN CB C 88 39.082 39.082 39.621 -0.539 18802 348 1 . 1 1 88 88 ASN H H 88 8.386 8.386 8.779 -0.393 18802 349 1 . 1 1 89 89 SER N N 89 115.826 115.826 116.620 -0.794 18802 350 1 . 1 1 89 89 SER HA H 89 4.248 4.248 4.274 -0.026 18802 351 1 . 1 1 89 89 SER C C 89 175.066 175.066 174.753 0.313 18802 352 1 . 1 1 89 89 SER CA C 89 60.012 60.012 60.839 -0.827 18802 353 1 . 1 1 89 89 SER CB C 89 63.400 63.400 62.971 0.429 18802 354 1 . 1 1 89 89 SER H H 89 8.371 8.371 8.786 -0.415 18802 355 1 . 1 1 90 90 GLU N N 90 121.062 121.062 119.144 1.918 18802 356 1 . 1 1 90 90 GLU HA H 90 4.278 4.278 4.348 -0.070 18802 357 1 . 1 1 90 90 GLU C C 90 176.936 176.936 176.886 0.050 18802 358 1 . 1 1 90 90 GLU CA C 90 56.781 56.781 56.111 0.670 18802 359 1 . 1 1 90 90 GLU CB C 90 30.063 30.063 29.128 0.935 18802 360 1 . 1 1 90 90 GLU H H 90 8.018 8.018 8.057 -0.039 18802 361 1 . 1 1 91 91 GLY N N 91 108.499 108.499 109.065 -0.566 18802 362 1 . 1 1 91 91 GLY C C 91 174.115 174.115 173.695 0.420 18802 363 1 . 1 1 91 91 GLY CA C 91 45.744 45.744 45.130 0.614 18802 364 1 . 1 1 91 91 GLY H H 91 8.199 8.199 8.158 0.041 18802 365 1 . 1 1 92 92 LYS N N 92 120.638 120.638 120.494 0.144 18802 366 1 . 1 1 92 92 LYS HA H 92 4.309 4.309 4.481 -0.172 18802 367 1 . 1 1 92 92 LYS C C 92 176.453 176.453 175.084 1.369 18802 368 1 . 1 1 92 92 LYS CA C 92 55.856 55.856 55.279 0.578 18802 369 1 . 1 1 92 92 LYS CB C 92 33.109 33.109 34.079 -0.970 18802 370 1 . 1 1 92 92 LYS H H 92 7.956 7.956 7.702 0.254 18802 371 1 . 1 1 93 93 ARG N N 93 122.999 122.999 125.244 -2.245 18802 372 1 . 1 1 93 93 ARG HA H 93 4.191 4.191 4.226 -0.035 18802 373 1 . 1 1 93 93 ARG C C 93 176.325 176.325 175.033 1.292 18802 374 1 . 1 1 93 93 ARG CA C 93 56.382 56.382 55.444 0.938 18802 375 1 . 1 1 93 93 ARG CB C 93 30.656 30.656 31.451 -0.795 18802 376 1 . 1 1 93 93 ARG H H 93 8.403 8.403 8.607 -0.204 18802 377 1 . 1 1 94 94 LEU N N 94 124.100 124.100 122.601 1.499 18802 378 1 . 1 1 94 94 LEU HA H 94 4.263 4.263 4.672 -0.409 18802 379 1 . 1 1 94 94 LEU C C 94 176.993 176.993 175.322 1.671 18802 380 1 . 1 1 94 94 LEU CA C 94 55.034 55.034 53.241 1.793 18802 381 1 . 1 1 94 94 LEU CB C 94 42.941 42.941 43.441 -0.500 18802 382 1 . 1 1 94 94 LEU H H 94 8.283 8.283 8.218 0.065 18802 383 1 . 1 1 95 95 ASN N N 95 119.593 119.593 117.645 1.948 18802 384 1 . 1 1 95 95 ASN HA H 95 4.747 4.747 4.856 -0.109 18802 385 1 . 1 1 95 95 ASN C C 95 175.598 175.598 174.738 0.860 18802 386 1 . 1 1 95 95 ASN CA C 95 52.680 52.680 53.285 -0.606 18802 387 1 . 1 1 95 95 ASN CB C 95 38.723 38.723 39.814 -1.091 18802 388 1 . 1 1 95 95 ASN H H 95 8.460 8.460 8.162 0.298 18802 389 1 . 1 1 96 96 THR N N 96 114.100 114.100 116.865 -2.765 18802 390 1 . 1 1 96 96 THR HA H 96 4.226 4.226 4.374 -0.148 18802 391 1 . 1 1 96 96 THR C C 96 175.186 175.186 175.855 -0.669 18802 392 1 . 1 1 96 96 THR CA C 96 62.203 62.203 64.749 -2.546 18802 393 1 . 1 1 96 96 THR CB C 96 69.880 69.880 69.738 0.142 18802 394 1 . 1 1 96 96 THR H H 96 8.031 8.031 8.701 -0.670 18802 395 1 . 1 1 97 97 ARG N N 97 122.587 122.587 121.374 1.213 18802 396 1 . 1 1 97 97 ARG HA H 97 4.113 4.113 4.179 -0.066 18802 397 1 . 1 1 97 97 ARG C C 97 177.938 177.938 178.296 -0.358 18802 398 1 . 1 1 97 97 ARG CA C 97 58.412 58.412 60.018 -1.607 18802 399 1 . 1 1 97 97 ARG CB C 97 30.297 30.297 29.765 0.532 18802 400 1 . 1 1 97 97 ARG H H 97 8.502 8.502 8.500 0.002 18802 401 1 . 1 1 98 98 GLU N N 98 121.548 121.548 119.914 1.634 18802 402 1 . 1 1 98 98 GLU HA H 98 4.017 4.017 4.115 -0.098 18802 403 1 . 1 1 98 98 GLU C C 98 177.113 177.113 178.877 -1.764 18802 404 1 . 1 1 98 98 GLU CA C 98 58.680 58.680 59.692 -1.012 18802 405 1 . 1 1 98 98 GLU CB C 98 29.666 29.666 28.912 0.754 18802 406 1 . 1 1 98 98 GLU H H 98 8.517 8.517 8.744 -0.227 18802 407 1 . 1 1 99 99 PHE N N 99 121.388 121.388 119.993 1.395 18802 408 1 . 1 1 99 99 PHE HA H 99 4.322 4.322 4.241 0.081 18802 409 1 . 1 1 99 99 PHE C C 99 177.070 177.070 177.205 -0.135 18802 410 1 . 1 1 99 99 PHE CA C 99 60.075 60.075 61.223 -1.148 18802 411 1 . 1 1 99 99 PHE CB C 99 39.486 39.486 39.133 0.353 18802 412 1 . 1 1 99 99 PHE H H 99 8.176 8.176 8.263 -0.087 18802 413 1 . 1 1 100 100 ARG N N 100 120.211 120.211 119.493 0.718 18802 414 1 . 1 1 100 100 ARG C C 100 178.159 178.159 178.703 -0.544 18802 415 1 . 1 1 100 100 ARG CA C 100 58.533 58.533 59.639 -1.106 18802 416 1 . 1 1 100 100 ARG CB C 100 30.588 30.588 29.881 0.707 18802 417 1 . 1 1 100 100 ARG H H 100 8.377 8.377 8.356 0.021 18802 418 1 . 1 1 101 101 THR N N 101 115.416 115.416 116.322 -0.906 18802 419 1 . 1 1 101 101 THR HA H 101 4.022 4.022 3.994 0.028 18802 420 1 . 1 1 101 101 THR C C 101 175.301 175.301 176.583 -1.282 18802 421 1 . 1 1 101 101 THR CA C 101 65.141 65.141 66.700 -1.559 18802 422 1 . 1 1 101 101 THR CB C 101 69.305 69.305 68.520 0.786 18802 423 1 . 1 1 101 101 THR H H 101 7.992 7.992 8.093 -0.102 18802 424 1 . 1 1 102 102 ARG N N 102 122.212 122.212 121.309 0.903 18802 425 1 . 1 1 102 102 ARG HA H 102 4.307 4.307 3.933 0.374 18802 426 1 . 1 1 102 102 ARG C C 102 177.644 177.644 178.259 -0.615 18802 427 1 . 1 1 102 102 ARG CA C 102 60.611 60.611 59.468 1.143 18802 428 1 . 1 1 102 102 ARG CB C 102 29.808 29.808 30.071 -0.264 18802 429 1 . 1 1 102 102 ARG H H 102 8.369 8.369 8.233 0.136 18802 430 1 . 1 1 103 103 LYS N N 103 117.591 117.591 119.594 -2.003 18802 431 1 . 1 1 103 103 LYS HA H 103 3.960 3.960 3.951 0.009 18802 432 1 . 1 1 103 103 LYS C C 103 178.913 178.913 178.703 0.210 18802 433 1 . 1 1 103 103 LYS CA C 103 59.050 59.050 58.494 0.556 18802 434 1 . 1 1 103 103 LYS CB C 103 32.141 32.141 31.584 0.556 18802 435 1 . 1 1 103 103 LYS H H 103 7.941 7.941 8.225 -0.284 18802 436 1 . 1 1 104 104 LYS N N 104 119.769 119.769 120.052 -0.283 18802 437 1 . 1 1 104 104 LYS HA H 104 4.146 4.146 4.096 0.050 18802 438 1 . 1 1 104 104 LYS C C 104 179.377 179.377 178.810 0.567 18802 439 1 . 1 1 104 104 LYS CA C 104 58.979 58.979 58.740 0.239 18802 440 1 . 1 1 104 104 LYS CB C 104 32.191 32.191 31.658 0.533 18802 441 1 . 1 1 104 104 LYS H H 104 7.615 7.615 7.637 -0.022 18802 442 1 . 1 1 105 105 LEU N N 105 120.500 120.500 119.052 1.448 18802 443 1 . 1 1 105 105 LEU HA H 105 4.117 4.117 3.959 0.158 18802 444 1 . 1 1 105 105 LEU C C 105 179.481 179.481 179.094 0.388 18802 445 1 . 1 1 105 105 LEU CA C 105 58.261 58.261 58.093 0.168 18802 446 1 . 1 1 105 105 LEU CB C 105 42.004 42.004 41.530 0.473 18802 447 1 . 1 1 105 105 LEU H H 105 8.057 8.057 7.884 0.173 18802 448 1 . 1 1 106 106 GLU N N 106 118.803 118.803 118.932 -0.130 18802 449 1 . 1 1 106 106 GLU HA H 106 3.989 3.989 3.955 0.034 18802 450 1 . 1 1 106 106 GLU C C 106 180.577 180.577 179.265 1.312 18802 451 1 . 1 1 106 106 GLU CA C 106 59.810 59.810 59.785 0.025 18802 452 1 . 1 1 106 106 GLU CB C 106 30.009 30.009 29.281 0.728 18802 453 1 . 1 1 106 106 GLU H H 106 8.652 8.652 8.175 0.477 18802 454 1 . 1 1 107 107 GLU N N 107 122.396 122.396 119.415 2.981 18802 455 1 . 1 1 107 107 GLU HA H 107 4.106 4.106 4.224 -0.118 18802 456 1 . 1 1 107 107 GLU C C 107 178.457 178.457 179.238 -0.781 18802 457 1 . 1 1 107 107 GLU CA C 107 59.826 59.826 59.148 0.678 18802 458 1 . 1 1 107 107 GLU CB C 107 29.562 29.562 29.315 0.247 18802 459 1 . 1 1 107 107 GLU H H 107 8.281 8.281 8.419 -0.139 18802 460 1 . 1 1 108 108 GLU N N 108 120.976 120.976 119.337 1.639 18802 461 1 . 1 1 108 108 GLU HA H 108 4.092 4.092 4.044 0.048 18802 462 1 . 1 1 108 108 GLU C C 108 179.343 179.343 179.045 0.298 18802 463 1 . 1 1 108 108 GLU CA C 108 59.696 59.696 59.130 0.566 18802 464 1 . 1 1 108 108 GLU CB C 108 29.570 29.570 29.238 0.332 18802 465 1 . 1 1 108 108 GLU H H 108 8.321 8.321 8.299 0.022 18802 466 1 . 1 1 109 109 ARG N N 109 118.559 118.559 120.061 -1.502 18802 467 1 . 1 1 109 109 ARG HA H 109 3.792 3.792 3.926 -0.134 18802 468 1 . 1 1 109 109 ARG C C 109 177.178 177.178 178.145 -0.967 18802 469 1 . 1 1 109 109 ARG CA C 109 60.483 60.483 59.815 0.668 18802 470 1 . 1 1 109 109 ARG CB C 109 30.149 30.149 30.252 -0.103 18802 471 1 . 1 1 109 109 ARG H H 109 8.594 8.594 8.268 0.326 18802 472 1 . 1 1 110 110 HIS N N 110 119.632 119.632 118.710 0.922 18802 473 1 . 1 1 110 110 HIS HA H 110 4.341 4.341 4.201 0.140 18802 474 1 . 1 1 110 110 HIS C C 110 177.578 177.578 177.456 0.122 18802 475 1 . 1 1 110 110 HIS CA C 110 60.617 60.617 59.260 1.357 18802 476 1 . 1 1 110 110 HIS CB C 110 30.509 30.509 30.080 0.430 18802 477 1 . 1 1 110 110 HIS H H 110 8.465 8.465 8.532 -0.067 18802 478 1 . 1 1 111 111 ASN N N 111 119.587 119.587 118.374 1.213 18802 479 1 . 1 1 111 111 ASN HA H 111 4.278 4.278 4.336 -0.058 18802 480 1 . 1 1 111 111 ASN C C 111 178.630 178.630 177.780 0.850 18802 481 1 . 1 1 111 111 ASN CA C 111 56.281 56.281 56.121 0.160 18802 482 1 . 1 1 111 111 ASN CB C 111 37.695 37.695 38.284 -0.589 18802 483 1 . 1 1 111 111 ASN H H 111 8.323 8.323 8.397 -0.074 18802 484 1 . 1 1 112 112 LEU N N 112 122.320 122.320 120.464 1.856 18802 485 1 . 1 1 112 112 LEU HA H 112 4.116 4.116 3.987 0.129 18802 486 1 . 1 1 112 112 LEU C C 112 178.539 178.539 178.796 -0.257 18802 487 1 . 1 1 112 112 LEU CA C 112 57.979 57.979 57.733 0.246 18802 488 1 . 1 1 112 112 LEU CB C 112 42.594 42.594 41.762 0.832 18802 489 1 . 1 1 112 112 LEU H H 112 7.966 7.966 7.765 0.201 18802 490 1 . 1 1 113 113 ILE N N 113 121.495 121.495 120.435 1.060 18802 491 1 . 1 1 113 113 ILE HA H 113 3.236 3.236 3.732 -0.496 18802 492 1 . 1 1 113 113 ILE C C 113 176.959 176.959 178.412 -1.453 18802 493 1 . 1 1 113 113 ILE CA C 113 66.054 66.054 64.617 1.437 18802 494 1 . 1 1 113 113 ILE CB C 113 37.603 37.603 36.129 1.474 18802 495 1 . 1 1 113 113 ILE H H 113 8.472 8.472 8.635 -0.163 18802 496 1 . 1 1 114 114 THR N N 114 115.066 115.066 115.558 -0.492 18802 497 1 . 1 1 114 114 THR HA H 114 3.718 3.718 4.007 -0.289 18802 498 1 . 1 1 114 114 THR C C 114 176.559 176.559 176.695 -0.136 18802 499 1 . 1 1 114 114 THR CA C 114 66.700 66.700 67.215 -0.515 18802 500 1 . 1 1 114 114 THR CB C 114 68.759 68.759 68.339 0.420 18802 501 1 . 1 1 114 114 THR H H 114 8.075 8.075 8.307 -0.232 18802 502 1 . 1 1 115 115 GLU N N 115 123.259 123.259 121.978 1.281 18802 503 1 . 1 1 115 115 GLU HA H 115 3.932 3.932 4.079 -0.147 18802 504 1 . 1 1 115 115 GLU C C 115 178.191 178.191 178.540 -0.349 18802 505 1 . 1 1 115 115 GLU CA C 115 59.340 59.340 59.128 0.212 18802 506 1 . 1 1 115 115 GLU CB C 115 29.399 29.399 29.437 -0.038 18802 507 1 . 1 1 115 115 GLU H H 115 7.368 7.368 7.580 -0.212 18802 508 1 . 1 1 116 116 MET N N 116 119.844 119.844 119.989 -0.145 18802 509 1 . 1 1 116 116 MET HA H 116 4.014 4.014 3.975 0.039 18802 510 1 . 1 1 116 116 MET C C 116 177.888 177.888 178.109 -0.221 18802 511 1 . 1 1 116 116 MET CA C 116 57.183 57.183 58.170 -0.987 18802 512 1 . 1 1 116 116 MET CB C 116 32.126 32.126 32.006 0.120 18802 513 1 . 1 1 116 116 MET H H 116 8.373 8.373 8.395 -0.022 18802 514 1 . 1 1 117 117 VAL N N 117 117.572 117.572 119.437 -1.865 18802 515 1 . 1 1 117 117 VAL HA H 117 3.896 3.896 4.142 -0.246 18802 516 1 . 1 1 117 117 VAL C C 117 177.567 177.567 178.000 -0.433 18802 517 1 . 1 1 117 117 VAL CA C 117 64.870 64.870 66.326 -1.456 18802 518 1 . 1 1 117 117 VAL CB C 117 32.002 32.002 31.106 0.896 18802 519 1 . 1 1 117 117 VAL H H 117 8.279 8.279 8.630 -0.351 18802 520 1 . 1 1 118 118 ALA N N 118 120.560 120.560 121.604 -1.044 18802 521 1 . 1 1 118 118 ALA HA H 118 4.136 4.136 4.163 -0.027 18802 522 1 . 1 1 118 118 ALA C C 118 179.595 179.595 179.452 0.143 18802 523 1 . 1 1 118 118 ALA CA C 118 54.103 54.103 54.736 -0.633 18802 524 1 . 1 1 118 118 ALA CB C 118 18.250 18.250 18.695 -0.445 18802 525 1 . 1 1 118 118 ALA H H 118 7.074 7.074 7.389 -0.315 18802 526 1 . 1 1 119 119 LEU N N 119 117.987 117.987 117.604 0.383 18802 527 1 . 1 1 119 119 LEU HA H 119 4.140 4.140 4.134 0.006 18802 528 1 . 1 1 119 119 LEU C C 119 177.863 177.863 177.281 0.582 18802 529 1 . 1 1 119 119 LEU CA C 119 56.672 56.672 56.679 -0.007 18802 530 1 . 1 1 119 119 LEU CB C 119 43.234 43.234 42.748 0.486 18802 531 1 . 1 1 119 119 LEU H H 119 7.525 7.525 7.849 -0.324 18802 532 1 . 1 1 120 120 ASN N N 120 115.338 115.338 115.844 -0.506 18802 533 1 . 1 1 120 120 ASN HA H 120 5.018 5.018 5.127 -0.109 18802 534 1 . 1 1 120 120 ASN C C 120 172.510 172.510 173.970 -1.461 18802 535 1 . 1 1 120 120 ASN CA C 120 50.101 50.101 50.146 -0.045 18802 536 1 . 1 1 120 120 ASN CB C 120 39.305 39.305 40.477 -1.172 18802 537 1 . 1 1 120 120 ASN H H 120 8.467 8.467 8.105 0.362 18802 538 1 . 1 1 121 121 PRO HA H 121 4.656 4.656 4.521 0.135 18802 539 1 . 1 1 121 121 PRO C C 121 177.020 177.020 176.812 0.208 18802 540 1 . 1 1 121 121 PRO CA C 121 64.298 64.298 64.363 -0.065 18802 541 1 . 1 1 121 121 PRO CB C 121 32.299 32.299 32.284 0.015 18802 542 1 . 1 1 122 122 ASP N N 122 115.744 115.744 117.931 -2.187 18802 543 1 . 1 1 122 122 ASP HA H 122 4.669 4.669 4.677 -0.008 18802 544 1 . 1 1 122 122 ASP C C 122 176.004 176.004 175.850 0.154 18802 545 1 . 1 1 122 122 ASP CA C 122 54.366 54.366 53.635 0.731 18802 546 1 . 1 1 122 122 ASP CB C 122 41.324 41.324 41.547 -0.223 18802 547 1 . 1 1 122 122 ASP H H 122 7.600 7.600 8.177 -0.577 18802 548 1 . 1 1 123 123 PHE N N 123 122.722 122.722 121.777 0.945 18802 549 1 . 1 1 123 123 PHE HA H 123 4.135 4.135 4.425 -0.290 18802 550 1 . 1 1 123 123 PHE C C 123 173.954 173.954 174.473 -0.519 18802 551 1 . 1 1 123 123 PHE CA C 123 58.993 58.993 58.502 0.491 18802 552 1 . 1 1 123 123 PHE CB C 123 39.596 39.596 39.563 0.033 18802 553 1 . 1 1 123 123 PHE H H 123 7.940 7.940 7.467 0.472 18802 554 1 . 1 1 124 124 LYS N N 124 129.400 129.400 129.347 0.053 18802 555 1 . 1 1 124 124 LYS HA H 124 4.559 4.559 4.407 0.152 18802 556 1 . 1 1 124 124 LYS C C 124 172.622 172.622 173.924 -1.302 18802 557 1 . 1 1 124 124 LYS CA C 124 51.815 51.815 52.452 -0.637 18802 558 1 . 1 1 124 124 LYS CB C 124 32.581 32.581 31.713 0.868 18802 559 1 . 1 1 124 124 LYS H H 124 7.602 7.602 8.272 -0.670 18802 560 1 . 1 1 125 125 PRO HA H 125 4.089 4.089 4.054 0.035 18802 561 1 . 1 1 125 125 PRO CA C 125 60.996 60.996 61.374 -0.378 18802 562 1 . 1 1 125 125 PRO CB C 125 31.067 31.067 30.993 0.074 18802 563 1 . 1 1 126 126 PRO HA H 126 4.374 4.374 4.395 -0.021 18802 564 1 . 1 1 126 126 PRO C C 126 177.630 177.630 177.754 -0.125 18802 565 1 . 1 1 126 126 PRO CA C 126 62.813 62.813 62.752 0.062 18802 566 1 . 1 1 126 126 PRO CB C 126 32.321 32.321 32.265 0.056 18802 567 1 . 1 1 127 127 ALA N N 127 123.830 123.830 123.342 0.488 18802 568 1 . 1 1 127 127 ALA HA H 127 4.058 4.058 4.091 -0.033 18802 569 1 . 1 1 127 127 ALA C C 127 177.641 177.641 178.412 -0.771 18802 570 1 . 1 1 127 127 ALA CA C 127 54.602 54.602 54.346 0.256 18802 571 1 . 1 1 127 127 ALA CB C 127 18.849 18.849 18.761 0.088 18802 572 1 . 1 1 127 127 ALA H H 127 8.630 8.630 8.573 0.057 18802 573 1 . 1 1 128 128 ASP N N 128 112.924 112.924 115.534 -2.610 18802 574 1 . 1 1 128 128 ASP HA H 128 4.451 4.451 4.554 -0.103 18802 575 1 . 1 1 128 128 ASP C C 128 175.724 175.724 175.721 0.003 18802 576 1 . 1 1 128 128 ASP CA C 128 53.604 53.604 54.579 -0.976 18802 577 1 . 1 1 128 128 ASP CB C 128 40.418 40.418 40.834 -0.416 18802 578 1 . 1 1 128 128 ASP H H 128 8.335 8.335 8.310 0.025 18802 579 1 . 1 1 129 129 TYR N N 129 121.114 121.114 122.193 -1.079 18802 580 1 . 1 1 129 129 TYR HA H 129 4.362 4.362 4.376 -0.013 18802 581 1 . 1 1 129 129 TYR C C 129 174.190 174.190 174.470 -0.280 18802 582 1 . 1 1 129 129 TYR CA C 129 58.412 58.412 58.878 -0.466 18802 583 1 . 1 1 129 129 TYR CB C 129 39.059 39.059 38.763 0.296 18802 584 1 . 1 1 129 129 TYR H H 129 7.600 7.600 7.566 0.034 18802 585 1 . 1 1 130 130 LYS N N 130 129.875 129.875 128.642 1.233 18802 586 1 . 1 1 130 130 LYS HA H 130 4.318 4.318 4.415 -0.098 18802 587 1 . 1 1 130 130 LYS C C 130 172.314 172.314 173.820 -1.506 18802 588 1 . 1 1 130 130 LYS CA C 130 52.570 52.570 51.949 0.621 18802 589 1 . 1 1 130 130 LYS CB C 130 33.663 33.663 32.886 0.777 18802 590 1 . 1 1 130 130 LYS H H 130 7.695 7.695 8.135 -0.440 18802 591 1 . 1 1 131 131 PRO HA H 131 4.277 4.277 4.176 0.100 18802 592 1 . 1 1 131 131 PRO CA C 131 61.058 61.058 61.325 -0.267 18802 593 1 . 1 1 131 131 PRO CB C 131 30.852 30.852 31.028 -0.176 18802 594 1 . 1 1 132 132 PRO HA H 132 4.244 4.244 4.383 -0.139 18802 595 1 . 1 1 132 132 PRO C C 132 176.459 176.459 176.690 -0.231 18802 596 1 . 1 1 132 132 PRO CA C 132 62.874 62.874 62.882 -0.008 18802 597 1 . 1 1 132 132 PRO CB C 132 32.047 32.047 32.267 -0.220 18802 598 1 . 1 1 133 133 ALA N N 133 124.170 124.170 125.056 -0.886 18802 599 1 . 1 1 133 133 ALA HA H 133 4.250 4.250 4.331 -0.081 18802 600 1 . 1 1 133 133 ALA C C 133 177.870 177.870 177.585 0.285 18802 601 1 . 1 1 133 133 ALA CA C 133 52.508 52.508 52.604 -0.096 18802 602 1 . 1 1 133 133 ALA CB C 133 19.303 19.303 19.020 0.283 18802 603 1 . 1 1 133 133 ALA H H 133 8.311 8.311 8.294 0.017 18802 604 1 . 1 1 134 134 THR N N 134 113.807 113.807 112.864 0.943 18802 605 1 . 1 1 134 134 THR HA H 134 4.228 4.228 4.246 -0.018 18802 606 1 . 1 1 134 134 THR C C 134 174.282 174.282 174.652 -0.370 18802 607 1 . 1 1 134 134 THR CA C 134 62.127 62.127 62.471 -0.344 18802 608 1 . 1 1 134 134 THR CB C 134 69.870 69.870 68.860 1.010 18802 609 1 . 1 1 134 134 THR H H 134 8.019 8.019 7.992 0.027 18802 610 1 . 1 1 135 135 ARG N N 135 124.165 124.165 123.006 1.159 18802 611 1 . 1 1 135 135 ARG HA H 135 4.349 4.349 4.393 -0.044 18802 612 1 . 1 1 135 135 ARG C C 135 176.217 176.217 176.225 -0.008 18802 613 1 . 1 1 135 135 ARG CA C 135 55.993 55.993 55.913 0.080 18802 614 1 . 1 1 135 135 ARG CB C 135 30.992 30.992 30.195 0.797 18802 615 1 . 1 1 135 135 ARG H H 135 8.300 8.300 8.138 0.162 18802 616 1 . 1 1 136 136 VAL N N 136 122.157 122.157 121.436 0.721 18802 617 1 . 1 1 136 136 VAL HA H 136 4.070 4.070 4.111 -0.040 18802 618 1 . 1 1 136 136 VAL C C 136 176.180 176.180 175.726 0.454 18802 619 1 . 1 1 136 136 VAL CA C 136 61.937 61.937 62.931 -0.994 18802 620 1 . 1 1 136 136 VAL CB C 136 32.747 32.747 32.151 0.596 18802 621 1 . 1 1 136 136 VAL H H 136 8.233 8.233 8.179 0.054 18802 622 1 . 1 1 137 137 SER N N 137 118.837 118.837 117.398 1.439 18802 623 1 . 1 1 137 137 SER HA H 137 4.416 4.416 4.487 -0.071 18802 624 1 . 1 1 137 137 SER C C 137 174.258 174.258 174.410 -0.152 18802 625 1 . 1 1 137 137 SER CA C 137 58.341 58.341 58.551 -0.210 18802 626 1 . 1 1 137 137 SER CB C 137 63.900 63.900 63.552 0.348 18802 627 1 . 1 1 137 137 SER H H 137 8.264 8.264 8.250 0.014 18802 628 1 . 1 1 138 138 ASP N N 138 122.871 122.871 122.457 0.415 18802 629 1 . 1 1 138 138 ASP HA H 138 4.537 4.537 4.551 -0.014 18802 630 1 . 1 1 138 138 ASP C C 138 176.053 176.053 176.622 -0.569 18802 631 1 . 1 1 138 138 ASP CA C 138 54.489 54.489 55.502 -1.013 18802 632 1 . 1 1 138 138 ASP CB C 138 41.148 41.148 41.329 -0.181 18802 633 1 . 1 1 138 138 ASP H H 138 8.249 8.249 8.457 -0.208 18802 634 1 . 1 1 139 139 LYS N N 139 120.944 120.944 119.009 1.935 18802 635 1 . 1 1 139 139 LYS HA H 139 4.260 4.260 4.286 -0.026 18802 636 1 . 1 1 139 139 LYS C C 139 176.343 176.343 175.750 0.593 18802 637 1 . 1 1 139 139 LYS CA C 139 56.261 56.261 56.279 -0.018 18802 638 1 . 1 1 139 139 LYS CB C 139 33.077 33.077 32.674 0.403 18802 639 1 . 1 1 139 139 LYS H H 139 8.084 8.084 8.012 0.072 18802 640 1 . 1 1 140 140 VAL N N 140 121.670 121.670 119.791 1.879 18802 641 1 . 1 1 140 140 VAL HA H 140 4.012 4.012 4.286 -0.274 18802 642 1 . 1 1 140 140 VAL C C 140 175.842 175.842 175.204 0.638 18802 643 1 . 1 1 140 140 VAL CA C 140 62.442 62.442 61.453 0.989 18802 644 1 . 1 1 140 140 VAL CB C 140 32.867 32.867 32.841 0.026 18802 645 1 . 1 1 140 140 VAL H H 140 8.025 8.025 8.037 -0.012 18802 646 1 . 1 1 141 141 MET N N 141 124.839 124.839 125.360 -0.521 18802 647 1 . 1 1 141 141 MET HA H 141 4.453 4.453 4.732 -0.279 18802 648 1 . 1 1 141 141 MET C C 141 175.562 175.562 175.467 0.095 18802 649 1 . 1 1 141 141 MET CA C 141 55.349 55.349 54.751 0.598 18802 650 1 . 1 1 141 141 MET CB C 141 32.993 32.993 33.174 -0.181 18802 651 1 . 1 1 141 141 MET H H 141 8.364 8.364 8.418 -0.054 18802 652 1 . 1 1 142 142 ILE N N 142 124.515 124.515 127.920 -3.405 18802 653 1 . 1 1 142 142 ILE HA H 142 4.428 4.428 4.443 -0.015 18802 654 1 . 1 1 142 142 ILE C C 142 174.331 174.331 174.407 -0.076 18802 655 1 . 1 1 142 142 ILE CA C 142 58.404 58.404 58.701 -0.297 18802 656 1 . 1 1 142 142 ILE CB C 142 38.755 38.755 38.388 0.367 18802 657 1 . 1 1 142 142 ILE H H 142 8.093 8.093 8.371 -0.278 18802 658 1 . 1 1 143 143 PRO HA H 143 4.350 4.350 4.505 -0.155 18802 659 1 . 1 1 143 143 PRO C C 143 176.623 176.623 175.903 0.720 18802 660 1 . 1 1 143 143 PRO CA C 143 63.415 63.415 62.480 0.935 18802 661 1 . 1 1 143 143 PRO CB C 143 32.233 32.233 32.313 -0.080 18802 662 1 . 1 1 144 144 GLN N N 144 121.557 121.557 121.487 0.070 18802 663 1 . 1 1 144 144 GLN HA H 144 4.306 4.306 4.472 -0.166 18802 664 1 . 1 1 144 144 GLN C C 144 174.751 174.751 175.333 -0.582 18802 665 1 . 1 1 144 144 GLN CA C 144 55.671 55.671 55.565 0.106 18802 666 1 . 1 1 144 144 GLN CB C 144 30.118 30.118 29.717 0.401 18802 667 1 . 1 1 144 144 GLN H H 144 8.392 8.392 8.445 -0.053 18802 stop_ save_