data_25342 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25342 _Entry.PDB_ID 2MWM 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 25342 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 3 3 ALA N N 3 125.638 125.638 129.021 -3.383 25342 2 1 1 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.546 -0.181 25342 3 1 1 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.548 -3.250 25342 4 1 1 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.971 -3.112 25342 5 1 1 . 1 1 3 3 ALA H H 3 8.325 8.325 8.260 0.065 25342 6 1 1 . 1 1 4 4 LYS N N 4 121.813 121.813 122.183 -0.370 25342 7 1 1 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.463 -0.236 25342 8 1 1 . 1 1 4 4 LYS C C 4 174.574 174.574 173.979 0.595 25342 9 1 1 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.123 -1.342 25342 10 1 1 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.984 -3.494 25342 11 1 1 . 1 1 4 4 LYS H H 4 8.486 8.486 7.994 0.492 25342 12 1 1 . 1 1 5 5 LYS N N 5 129.722 129.722 122.213 7.509 25342 13 1 1 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.559 -0.041 25342 14 1 1 . 1 1 5 5 LYS C C 5 174.720 174.720 174.452 0.268 25342 15 1 1 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.517 -0.795 25342 16 1 1 . 1 1 5 5 LYS CB C 5 29.785 29.785 35.722 -5.937 25342 17 1 1 . 1 1 5 5 LYS H H 5 10.015 10.015 8.344 1.671 25342 18 1 1 . 1 1 6 6 THR N N 6 126.254 126.254 116.449 9.805 25342 19 1 1 . 1 1 6 6 THR HA H 6 5.654 5.654 5.248 0.406 25342 20 1 1 . 1 1 6 6 THR C C 6 169.926 169.926 173.106 -3.180 25342 21 1 1 . 1 1 6 6 THR CA C 6 60.598 60.598 62.480 -1.882 25342 22 1 1 . 1 1 6 6 THR CB C 6 68.041 68.041 70.347 -2.307 25342 23 1 1 . 1 1 6 6 THR H H 6 8.538 8.538 8.763 -0.225 25342 24 1 1 . 1 1 7 7 LEU N N 7 130.775 130.775 127.773 3.002 25342 25 1 1 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.819 -0.225 25342 26 1 1 . 1 1 7 7 LEU C C 7 170.404 170.404 174.334 -3.930 25342 27 1 1 . 1 1 7 7 LEU CA C 7 49.933 49.933 52.819 -2.886 25342 28 1 1 . 1 1 7 7 LEU CB C 7 40.728 40.728 46.224 -5.496 25342 29 1 1 . 1 1 7 7 LEU H H 7 8.575 8.575 9.074 -0.499 25342 30 1 1 . 1 1 8 8 ILE N N 8 127.242 127.242 121.589 5.653 25342 31 1 1 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.791 0.057 25342 32 1 1 . 1 1 8 8 ILE C C 8 170.936 170.936 174.535 -3.599 25342 33 1 1 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.368 -3.116 25342 34 1 1 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.685 -3.750 25342 35 1 1 . 1 1 8 8 ILE H H 8 9.217 9.217 7.894 1.323 25342 36 1 1 . 1 1 9 9 LEU N N 9 127.183 127.183 127.431 -0.248 25342 37 1 1 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.913 0.781 25342 38 1 1 . 1 1 9 9 LEU C C 9 173.824 173.824 175.367 -1.543 25342 39 1 1 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.004 -4.165 25342 40 1 1 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.475 1.488 25342 41 1 1 . 1 1 9 9 LEU H H 9 9.248 9.248 9.022 0.226 25342 42 1 1 . 1 1 10 10 TYR N N 10 113.330 113.330 122.949 -9.619 25342 43 1 1 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.417 0.097 25342 44 1 1 . 1 1 10 10 TYR C C 10 167.898 167.898 172.759 -4.861 25342 45 1 1 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.475 -0.600 25342 46 1 1 . 1 1 10 10 TYR CB C 10 38.436 38.436 41.683 -3.247 25342 47 1 1 . 1 1 10 10 TYR H H 10 7.306 7.306 8.957 -1.651 25342 48 1 1 . 1 1 11 11 TYR N N 11 121.297 121.297 122.572 -1.275 25342 49 1 1 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.831 -0.069 25342 50 1 1 . 1 1 11 11 TYR C C 11 169.698 169.698 173.770 -4.072 25342 51 1 1 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.846 -0.799 25342 52 1 1 . 1 1 11 11 TYR CB C 11 40.538 40.538 40.059 0.479 25342 53 1 1 . 1 1 11 11 TYR H H 11 7.891 7.891 8.348 -0.457 25342 54 1 1 . 1 1 12 12 SER N N 12 117.763 117.763 123.201 -5.438 25342 55 1 1 . 1 1 12 12 SER HA H 12 4.679 4.679 4.016 0.663 25342 56 1 1 . 1 1 12 12 SER C C 12 170.075 170.075 173.773 -3.698 25342 57 1 1 . 1 1 12 12 SER CA C 12 53.619 53.619 56.810 -3.191 25342 58 1 1 . 1 1 12 12 SER CB C 12 62.847 62.847 62.760 0.087 25342 59 1 1 . 1 1 12 12 SER H H 12 7.557 7.557 8.031 -0.474 25342 60 1 1 . 1 1 13 13 TRP N N 13 135.232 135.232 130.662 4.570 25342 61 1 1 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.952 0.684 25342 62 1 1 . 1 1 13 13 TRP C C 13 175.708 175.708 176.203 -0.495 25342 63 1 1 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.670 -1.554 25342 64 1 1 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.805 -2.170 25342 65 1 1 . 1 1 13 13 TRP H H 13 9.755 9.755 7.768 1.987 25342 66 1 1 . 1 1 14 14 SER N N 14 113.789 113.789 113.379 0.410 25342 67 1 1 . 1 1 14 14 SER HA H 14 4.223 4.223 4.456 -0.233 25342 68 1 1 . 1 1 14 14 SER C C 14 172.747 172.747 174.099 -1.352 25342 69 1 1 . 1 1 14 14 SER CA C 14 53.828 53.828 58.217 -4.389 25342 70 1 1 . 1 1 14 14 SER CB C 14 60.037 60.037 62.882 -2.845 25342 71 1 1 . 1 1 14 14 SER H H 14 10.026 10.026 8.095 1.931 25342 72 1 1 . 1 1 15 15 GLY N N 15 110.489 110.489 110.736 -0.247 25342 73 1 1 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.325 -0.666 25342 74 1 1 . 1 1 15 15 GLY H H 15 7.391 7.391 8.306 -0.915 25342 75 1 1 . 1 1 16 16 GLU N N 16 129.005 129.005 119.910 9.095 25342 76 1 1 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.321 -0.258 25342 77 1 1 . 1 1 16 16 GLU CA C 16 56.761 56.761 57.143 -0.382 25342 78 1 1 . 1 1 16 16 GLU CB C 16 26.412 26.412 30.165 -3.753 25342 79 1 1 . 1 1 16 16 GLU H H 16 11.550 11.550 8.380 3.171 25342 80 1 1 . 1 1 17 17 THR N N 17 123.016 123.016 116.303 6.713 25342 81 1 1 . 1 1 17 17 THR HA H 17 4.035 4.035 4.005 0.030 25342 82 1 1 . 1 1 17 17 THR C C 17 173.360 173.360 176.444 -3.084 25342 83 1 1 . 1 1 17 17 THR CA C 17 64.303 64.303 65.665 -1.362 25342 84 1 1 . 1 1 17 17 THR CB C 17 63.999 63.999 68.530 -4.531 25342 85 1 1 . 1 1 17 17 THR H H 17 11.293 11.293 8.373 2.920 25342 86 1 1 . 1 1 18 18 LYS N N 18 120.156 120.156 121.983 -1.827 25342 87 1 1 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.287 -1.431 25342 88 1 1 . 1 1 18 18 LYS C C 18 173.901 173.901 179.559 -5.658 25342 89 1 1 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.887 -3.053 25342 90 1 1 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.372 -2.891 25342 91 1 1 . 1 1 18 18 LYS H H 18 6.940 6.940 8.244 -1.304 25342 92 1 1 . 1 1 19 19 LYS N N 19 117.237 117.237 119.594 -2.357 25342 93 1 1 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.002 -0.079 25342 94 1 1 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.118 -2.794 25342 95 1 1 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.210 -2.849 25342 96 1 1 . 1 1 19 19 LYS H H 19 7.212 7.212 7.755 -0.543 25342 97 1 1 . 1 1 20 20 MET N N 20 119.268 119.268 117.311 1.957 25342 98 1 1 . 1 1 20 20 MET HA H 20 4.413 4.413 4.237 0.176 25342 99 1 1 . 1 1 20 20 MET C C 20 173.625 173.625 177.434 -3.809 25342 100 1 1 . 1 1 20 20 MET CA C 20 52.261 52.261 57.217 -4.956 25342 101 1 1 . 1 1 20 20 MET CB C 20 26.680 26.680 32.270 -5.590 25342 102 1 1 . 1 1 20 20 MET H H 20 7.600 7.600 7.711 -0.111 25342 103 1 1 . 1 1 21 21 ALA N N 21 123.669 123.669 121.191 2.478 25342 104 1 1 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.071 -0.589 25342 105 1 1 . 1 1 21 21 ALA C C 21 176.628 176.628 179.248 -2.620 25342 106 1 1 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.288 -2.914 25342 107 1 1 . 1 1 21 21 ALA CB C 21 16.495 16.495 18.079 -1.584 25342 108 1 1 . 1 1 21 21 ALA H H 21 8.738 8.738 8.103 0.635 25342 109 1 1 . 1 1 22 22 GLU N N 22 117.242 117.242 117.576 -0.334 25342 110 1 1 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.016 -0.343 25342 111 1 1 . 1 1 22 22 GLU C C 22 176.698 176.698 178.856 -2.158 25342 112 1 1 . 1 1 22 22 GLU CA C 22 56.540 56.540 58.544 -2.003 25342 113 1 1 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.233 -2.799 25342 114 1 1 . 1 1 22 22 GLU H H 22 7.959 7.959 7.842 0.117 25342 115 1 1 . 1 1 23 23 LYS N N 23 123.302 123.302 120.172 3.130 25342 116 1 1 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.041 -0.220 25342 117 1 1 . 1 1 23 23 LYS C C 23 177.389 177.389 178.993 -1.604 25342 118 1 1 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.214 -2.292 25342 119 1 1 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.585 -3.071 25342 120 1 1 . 1 1 23 23 LYS H H 23 7.703 7.703 7.565 0.138 25342 121 1 1 . 1 1 24 24 ILE N N 24 122.208 122.208 119.224 2.984 25342 122 1 1 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.639 -0.356 25342 123 1 1 . 1 1 24 24 ILE C C 24 174.934 174.934 177.933 -2.999 25342 124 1 1 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.385 -2.093 25342 125 1 1 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.824 -3.086 25342 126 1 1 . 1 1 24 24 ILE H H 24 8.535 8.535 7.628 0.907 25342 127 1 1 . 1 1 25 25 ASN N N 25 118.640 118.640 117.766 0.874 25342 128 1 1 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.445 -0.218 25342 129 1 1 . 1 1 25 25 ASN C C 25 173.530 173.530 176.009 -2.479 25342 130 1 1 . 1 1 25 25 ASN CA C 25 52.211 52.211 55.627 -3.416 25342 131 1 1 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.719 -0.615 25342 132 1 1 . 1 1 25 25 ASN H H 25 8.317 8.317 8.435 -0.118 25342 133 1 1 . 1 1 26 26 SER N N 26 111.990 111.990 112.729 -0.739 25342 134 1 1 . 1 1 26 26 SER HA H 26 4.153 4.153 4.532 -0.379 25342 135 1 1 . 1 1 26 26 SER C C 26 172.110 172.110 174.563 -2.453 25342 136 1 1 . 1 1 26 26 SER CA C 26 57.905 57.905 58.707 -0.802 25342 137 1 1 . 1 1 26 26 SER CB C 26 60.655 60.655 63.818 -3.163 25342 138 1 1 . 1 1 26 26 SER H H 26 7.369 7.369 7.941 -0.572 25342 139 1 1 . 1 1 27 27 GLU N N 27 120.201 120.201 120.359 -0.158 25342 140 1 1 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.461 -0.360 25342 141 1 1 . 1 1 27 27 GLU C C 27 173.673 173.673 176.375 -2.702 25342 142 1 1 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.408 -2.173 25342 143 1 1 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.496 -3.895 25342 144 1 1 . 1 1 27 27 GLU H H 27 7.451 7.451 8.030 -0.579 25342 145 1 1 . 1 1 28 28 ILE N N 28 118.762 118.762 119.060 -0.298 25342 146 1 1 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.261 -0.062 25342 147 1 1 . 1 1 28 28 ILE C C 28 172.487 172.487 175.504 -3.017 25342 148 1 1 . 1 1 28 28 ILE CA C 28 57.732 57.732 59.908 -2.176 25342 149 1 1 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.227 -4.489 25342 150 1 1 . 1 1 28 28 ILE H H 28 7.255 7.255 7.193 0.062 25342 151 1 1 . 1 1 29 29 LYS N N 29 130.563 130.563 121.855 8.708 25342 152 1 1 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.118 -0.116 25342 153 1 1 . 1 1 29 29 LYS C C 29 174.386 174.386 176.810 -2.424 25342 154 1 1 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.065 -1.530 25342 155 1 1 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.085 -3.499 25342 156 1 1 . 1 1 29 29 LYS H H 29 8.564 8.564 8.562 0.002 25342 157 1 1 . 1 1 30 30 ASP N N 30 119.357 119.357 119.111 0.246 25342 158 1 1 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.418 -0.016 25342 159 1 1 . 1 1 30 30 ASP C C 30 172.570 172.570 175.794 -3.224 25342 160 1 1 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.924 -1.488 25342 161 1 1 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.955 -3.211 25342 162 1 1 . 1 1 30 30 ASP H H 30 8.920 8.920 8.631 0.289 25342 163 1 1 . 1 1 31 31 SER N N 31 114.019 114.019 117.565 -3.546 25342 164 1 1 . 1 1 31 31 SER HA H 31 4.782 4.782 4.998 -0.216 25342 165 1 1 . 1 1 31 31 SER C C 31 171.150 171.150 174.316 -3.166 25342 166 1 1 . 1 1 31 31 SER CA C 31 55.551 55.551 57.276 -1.725 25342 167 1 1 . 1 1 31 31 SER CB C 31 62.259 62.259 65.484 -3.224 25342 168 1 1 . 1 1 31 31 SER H H 31 8.006 8.006 8.064 -0.058 25342 169 1 1 . 1 1 32 32 GLU N N 32 121.455 121.455 118.547 2.908 25342 170 1 1 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.628 0.112 25342 171 1 1 . 1 1 32 32 GLU C C 32 171.185 171.185 174.411 -3.226 25342 172 1 1 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.464 -3.383 25342 173 1 1 . 1 1 32 32 GLU CB C 32 30.827 30.827 33.209 -2.382 25342 174 1 1 . 1 1 32 32 GLU H H 32 8.145 8.145 8.426 -0.281 25342 175 1 1 . 1 1 33 33 LEU N N 33 126.176 126.176 121.386 4.790 25342 176 1 1 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.431 0.875 25342 177 1 1 . 1 1 33 33 LEU C C 33 173.365 173.365 175.276 -1.911 25342 178 1 1 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.169 -2.729 25342 179 1 1 . 1 1 33 33 LEU CB C 33 43.635 43.635 42.819 0.816 25342 180 1 1 . 1 1 33 33 LEU H H 33 8.589 8.589 8.487 0.102 25342 181 1 1 . 1 1 34 34 LYS N N 34 127.200 127.200 124.710 2.490 25342 182 1 1 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.717 -0.121 25342 183 1 1 . 1 1 34 34 LYS C C 34 169.622 169.622 174.880 -5.258 25342 184 1 1 . 1 1 34 34 LYS CA C 34 52.329 52.329 53.812 -1.484 25342 185 1 1 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.039 -1.839 25342 186 1 1 . 1 1 34 34 LYS H H 34 9.380 9.380 8.627 0.753 25342 187 1 1 . 1 1 35 35 GLU N N 35 122.324 122.324 120.732 1.592 25342 188 1 1 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.413 -2.080 25342 189 1 1 . 1 1 35 35 GLU C C 35 172.734 172.734 175.437 -2.703 25342 190 1 1 . 1 1 35 35 GLU CA C 35 52.612 52.612 55.045 -2.433 25342 191 1 1 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.587 -3.268 25342 192 1 1 . 1 1 35 35 GLU H H 35 8.094 8.094 8.518 -0.424 25342 193 1 1 . 1 1 36 36 VAL N N 36 126.781 126.781 121.229 5.552 25342 194 1 1 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.375 -0.536 25342 195 1 1 . 1 1 36 36 VAL C C 36 171.482 171.482 175.807 -4.325 25342 196 1 1 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.671 -1.266 25342 197 1 1 . 1 1 36 36 VAL CB C 36 29.348 29.348 33.478 -4.130 25342 198 1 1 . 1 1 36 36 VAL H H 36 8.660 8.660 8.876 -0.216 25342 199 1 1 . 1 1 37 37 LYS N N 37 126.065 126.065 120.365 5.700 25342 200 1 1 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.650 0.315 25342 201 1 1 . 1 1 37 37 LYS C C 37 173.187 173.187 174.431 -1.244 25342 202 1 1 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.601 -2.321 25342 203 1 1 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.310 -2.389 25342 204 1 1 . 1 1 37 37 LYS H H 37 7.809 7.809 8.124 -0.315 25342 205 1 1 . 1 1 38 38 VAL N N 38 111.020 111.020 115.419 -4.399 25342 206 1 1 . 1 1 38 38 VAL HA H 38 4.824 4.824 5.025 -0.201 25342 207 1 1 . 1 1 38 38 VAL C C 38 173.604 173.604 176.135 -2.531 25342 208 1 1 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.560 -3.177 25342 209 1 1 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.613 -2.237 25342 210 1 1 . 1 1 38 38 VAL H H 38 8.305 8.305 8.218 0.087 25342 211 1 1 . 1 1 39 39 SER N N 39 117.887 117.887 116.166 1.721 25342 212 1 1 . 1 1 39 39 SER HA H 39 4.183 4.183 4.394 -0.211 25342 213 1 1 . 1 1 39 39 SER C C 39 173.538 173.538 174.266 -0.728 25342 214 1 1 . 1 1 39 39 SER CA C 39 56.279 56.279 58.883 -2.604 25342 215 1 1 . 1 1 39 39 SER CB C 39 60.537 60.537 63.748 -3.211 25342 216 1 1 . 1 1 39 39 SER H H 39 8.847 8.847 8.313 0.534 25342 217 1 1 . 1 1 40 40 GLU N N 40 126.316 126.316 123.337 2.979 25342 218 1 1 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.203 -0.049 25342 219 1 1 . 1 1 40 40 GLU C C 40 174.586 174.586 176.836 -2.250 25342 220 1 1 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.416 -0.604 25342 221 1 1 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.584 -2.864 25342 222 1 1 . 1 1 40 40 GLU H H 40 9.049 9.049 8.525 0.524 25342 223 1 1 . 1 1 41 41 GLY N N 41 112.494 112.494 113.899 -1.405 25342 224 1 1 . 1 1 41 41 GLY C C 41 171.994 171.994 175.452 -3.458 25342 225 1 1 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.534 -3.072 25342 226 1 1 . 1 1 41 41 GLY H H 41 8.780 8.780 8.753 0.027 25342 227 1 1 . 1 1 42 42 THR N N 42 118.631 118.631 116.242 2.389 25342 228 1 1 . 1 1 42 42 THR HA H 42 3.582 3.582 3.963 -0.381 25342 229 1 1 . 1 1 42 42 THR C C 42 171.225 171.225 173.889 -2.664 25342 230 1 1 . 1 1 42 42 THR CA C 42 64.104 64.104 64.259 -0.155 25342 231 1 1 . 1 1 42 42 THR CB C 42 65.914 65.914 68.988 -3.074 25342 232 1 1 . 1 1 42 42 THR H H 42 7.737 7.737 7.727 0.010 25342 233 1 1 . 1 1 43 43 PHE N N 43 116.279 116.279 113.001 3.278 25342 234 1 1 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.799 0.221 25342 235 1 1 . 1 1 43 43 PHE C C 43 170.141 170.141 173.277 -3.136 25342 236 1 1 . 1 1 43 43 PHE CA C 43 52.472 52.472 54.404 -1.932 25342 237 1 1 . 1 1 43 43 PHE CB C 43 37.385 37.385 39.573 -2.188 25342 238 1 1 . 1 1 43 43 PHE H H 43 8.114 8.114 7.061 1.053 25342 239 1 1 . 1 1 44 44 ASP N N 44 121.513 121.513 119.795 1.718 25342 240 1 1 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.997 -0.146 25342 241 1 1 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.074 -2.862 25342 242 1 1 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.094 0.291 25342 243 1 1 . 1 1 44 44 ASP H H 44 7.774 7.774 8.592 -0.818 25342 244 1 1 . 1 1 45 45 ALA N N 45 125.663 125.663 120.940 4.723 25342 245 1 1 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.746 -0.535 25342 246 1 1 . 1 1 45 45 ALA C C 45 175.139 175.139 176.990 -1.851 25342 247 1 1 . 1 1 45 45 ALA CA C 45 51.436 51.436 51.949 -0.513 25342 248 1 1 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.730 -3.498 25342 249 1 1 . 1 1 45 45 ALA H H 45 8.324 8.324 8.399 -0.075 25342 250 1 1 . 1 1 46 46 ASP N N 46 119.288 119.288 118.946 0.342 25342 251 1 1 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.562 0.263 25342 252 1 1 . 1 1 46 46 ASP C C 46 175.013 175.013 177.397 -2.384 25342 253 1 1 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.492 -2.331 25342 254 1 1 . 1 1 46 46 ASP CB C 46 41.233 41.233 41.861 -0.628 25342 255 1 1 . 1 1 46 46 ASP H H 46 9.618 9.618 7.847 1.771 25342 256 1 1 . 1 1 47 47 MET N N 47 127.347 127.347 119.461 7.886 25342 257 1 1 . 1 1 47 47 MET HA H 47 3.456 3.456 4.301 -0.845 25342 258 1 1 . 1 1 47 47 MET C C 47 173.605 173.605 177.505 -3.900 25342 259 1 1 . 1 1 47 47 MET CA C 47 56.699 56.699 58.278 -1.579 25342 260 1 1 . 1 1 47 47 MET CB C 47 29.930 29.930 33.383 -3.453 25342 261 1 1 . 1 1 47 47 MET H H 47 9.178 9.178 8.124 1.054 25342 262 1 1 . 1 1 48 48 TYR N N 48 121.040 121.040 116.883 4.157 25342 263 1 1 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.561 -0.689 25342 264 1 1 . 1 1 48 48 TYR CA C 48 58.712 58.712 59.298 -0.586 25342 265 1 1 . 1 1 48 48 TYR CB C 48 33.638 33.638 36.551 -2.913 25342 266 1 1 . 1 1 48 48 TYR H H 48 7.881 7.881 6.987 0.894 25342 267 1 1 . 1 1 49 49 LYS N N 49 121.754 121.754 120.321 1.433 25342 268 1 1 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.066 0.039 25342 269 1 1 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.908 -3.523 25342 270 1 1 . 1 1 49 49 LYS CB C 49 29.164 29.164 31.714 -2.550 25342 271 1 1 . 1 1 49 49 LYS H H 49 8.365 8.365 8.131 0.234 25342 272 1 1 . 1 1 50 50 THR N N 50 117.557 117.557 107.172 10.385 25342 273 1 1 . 1 1 50 50 THR HA H 50 3.586 3.586 4.131 -0.545 25342 274 1 1 . 1 1 50 50 THR CA C 50 65.634 65.634 65.408 0.226 25342 275 1 1 . 1 1 50 50 THR CB C 50 65.904 65.904 68.601 -2.697 25342 276 1 1 . 1 1 50 50 THR H H 50 8.007 8.007 8.153 -0.146 25342 277 1 1 . 1 1 51 51 SER N N 51 115.110 115.110 117.407 -2.297 25342 278 1 1 . 1 1 51 51 SER HA H 51 3.974 3.974 4.318 -0.344 25342 279 1 1 . 1 1 51 51 SER CA C 51 59.042 59.042 61.595 -2.553 25342 280 1 1 . 1 1 51 51 SER CB C 51 59.835 59.835 62.987 -3.152 25342 281 1 1 . 1 1 51 51 SER H H 51 7.606 7.606 7.863 -0.257 25342 282 1 1 . 1 1 52 52 ASP N N 52 119.713 119.713 122.003 -2.290 25342 283 1 1 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.374 -0.066 25342 284 1 1 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.585 -3.059 25342 285 1 1 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.917 -3.229 25342 286 1 1 . 1 1 52 52 ASP H H 52 7.552 7.552 7.750 -0.198 25342 287 1 1 . 1 1 53 53 ILE N N 53 121.982 121.982 118.874 3.108 25342 288 1 1 . 1 1 53 53 ILE HA H 53 3.722 3.722 4.016 -0.294 25342 289 1 1 . 1 1 53 53 ILE C C 53 175.325 175.325 177.927 -2.602 25342 290 1 1 . 1 1 53 53 ILE CA C 53 62.544 62.544 64.367 -1.823 25342 291 1 1 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.926 -1.227 25342 292 1 1 . 1 1 53 53 ILE H H 53 7.815 7.815 7.195 0.620 25342 293 1 1 . 1 1 54 54 ALA N N 54 121.552 121.552 120.814 0.738 25342 294 1 1 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.275 0.042 25342 295 1 1 . 1 1 54 54 ALA C C 54 177.475 177.475 178.579 -1.104 25342 296 1 1 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.345 -2.323 25342 297 1 1 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.896 -2.912 25342 298 1 1 . 1 1 54 54 ALA H H 54 8.332 8.332 7.737 0.595 25342 299 1 1 . 1 1 55 55 LEU N N 55 117.176 117.176 118.211 -1.035 25342 300 1 1 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.157 -0.223 25342 301 1 1 . 1 1 55 55 LEU C C 55 176.532 176.532 177.695 -1.163 25342 302 1 1 . 1 1 55 55 LEU CA C 55 55.331 55.331 56.533 -1.202 25342 303 1 1 . 1 1 55 55 LEU CB C 55 38.428 38.428 42.698 -4.270 25342 304 1 1 . 1 1 55 55 LEU H H 55 8.195 8.195 7.578 0.617 25342 305 1 1 . 1 1 56 56 ASP N N 56 120.056 120.056 119.600 0.456 25342 306 1 1 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.290 0.177 25342 307 1 1 . 1 1 56 56 ASP C C 56 176.585 176.585 177.454 -0.869 25342 308 1 1 . 1 1 56 56 ASP CA C 56 54.550 54.550 56.836 -2.286 25342 309 1 1 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.089 -1.784 25342 310 1 1 . 1 1 56 56 ASP H H 56 7.806 7.806 8.293 -0.487 25342 311 1 1 . 1 1 57 57 GLN N N 57 120.020 120.020 116.519 3.501 25342 312 1 1 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.400 -0.277 25342 313 1 1 . 1 1 57 57 GLN C C 57 175.689 175.689 176.097 -0.408 25342 314 1 1 . 1 1 57 57 GLN CA C 57 54.405 54.405 55.876 -1.471 25342 315 1 1 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.816 -5.047 25342 316 1 1 . 1 1 57 57 GLN H H 57 7.661 7.661 7.600 0.061 25342 317 1 1 . 1 1 58 58 ILE N N 58 120.644 120.644 119.381 1.263 25342 318 1 1 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.073 -0.497 25342 319 1 1 . 1 1 58 58 ILE C C 58 176.237 176.237 177.011 -0.774 25342 320 1 1 . 1 1 58 58 ILE CA C 58 62.506 62.506 61.864 0.642 25342 321 1 1 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.389 -3.361 25342 322 1 1 . 1 1 58 58 ILE H H 58 8.228 8.228 7.736 0.492 25342 323 1 1 . 1 1 59 59 GLN N N 59 115.498 115.498 119.234 -3.736 25342 324 1 1 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.186 -0.044 25342 325 1 1 . 1 1 59 59 GLN C C 59 173.781 173.781 177.170 -3.389 25342 326 1 1 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.697 -3.715 25342 327 1 1 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.299 -2.688 25342 328 1 1 . 1 1 59 59 GLN H H 59 8.331 8.331 7.989 0.342 25342 329 1 1 . 1 1 60 60 GLY N N 60 106.623 106.623 104.662 1.961 25342 330 1 1 . 1 1 60 60 GLY C C 60 172.068 172.068 175.032 -2.964 25342 331 1 1 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.227 -2.354 25342 332 1 1 . 1 1 60 60 GLY H H 60 7.611 7.611 8.426 -0.815 25342 333 1 1 . 1 1 61 61 ASN N N 61 117.691 117.691 118.082 -0.391 25342 334 1 1 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.580 -0.036 25342 335 1 1 . 1 1 61 61 ASN C C 61 171.946 171.946 175.938 -3.992 25342 336 1 1 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.596 -3.027 25342 337 1 1 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.794 -2.434 25342 338 1 1 . 1 1 61 61 ASN H H 61 8.151 8.151 8.493 -0.342 25342 339 1 1 . 1 1 62 62 LYS N N 62 118.289 118.289 119.150 -0.861 25342 340 1 1 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.566 -0.238 25342 341 1 1 . 1 1 62 62 LYS C C 62 171.773 171.773 174.776 -3.003 25342 342 1 1 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.875 -3.579 25342 343 1 1 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.648 -0.965 25342 344 1 1 . 1 1 62 62 LYS H H 62 7.242 7.242 8.041 -0.799 25342 345 1 1 . 1 1 63 63 ASP N N 63 119.888 119.888 118.314 1.574 25342 346 1 1 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.308 0.108 25342 347 1 1 . 1 1 63 63 ASP C C 63 174.476 174.476 175.542 -1.066 25342 348 1 1 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.786 -2.325 25342 349 1 1 . 1 1 63 63 ASP CB C 63 38.515 38.515 40.959 -2.444 25342 350 1 1 . 1 1 63 63 ASP H H 63 8.230 8.230 8.049 0.181 25342 351 1 1 . 1 1 64 64 PHE N N 64 119.789 119.789 112.352 7.437 25342 352 1 1 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.889 -1.073 25342 353 1 1 . 1 1 64 64 PHE CA C 64 56.250 56.250 53.775 2.475 25342 354 1 1 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.937 -3.903 25342 355 1 1 . 1 1 64 64 PHE H H 64 8.428 8.428 7.256 1.172 25342 356 1 1 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.594 -0.281 25342 357 1 1 . 1 1 65 65 PRO C C 65 173.975 173.975 176.486 -2.511 25342 358 1 1 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.682 -2.626 25342 359 1 1 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.571 -3.051 25342 360 1 1 . 1 1 66 66 GLU N N 66 121.326 121.326 122.921 -1.595 25342 361 1 1 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.552 -0.319 25342 362 1 1 . 1 1 66 66 GLU C C 66 173.978 173.978 175.988 -2.010 25342 363 1 1 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.890 -2.359 25342 364 1 1 . 1 1 66 66 GLU CB C 66 27.700 27.700 30.475 -2.775 25342 365 1 1 . 1 1 66 66 GLU H H 66 8.225 8.225 8.268 -0.043 25342 366 1 1 . 1 1 67 67 ILE N N 67 113.897 113.897 114.011 -0.114 25342 367 1 1 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.958 0.211 25342 368 1 1 . 1 1 67 67 ILE C C 67 172.791 172.791 175.925 -3.134 25342 369 1 1 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.156 -2.881 25342 370 1 1 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.198 -2.182 25342 371 1 1 . 1 1 67 67 ILE H H 67 8.366 8.366 8.043 0.323 25342 372 1 1 . 1 1 68 68 GLN N N 68 121.654 121.654 123.019 -1.365 25342 373 1 1 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.689 -0.170 25342 374 1 1 . 1 1 68 68 GLN C C 68 171.562 171.562 174.103 -2.541 25342 375 1 1 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.624 -2.311 25342 376 1 1 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.005 -1.220 25342 377 1 1 . 1 1 68 68 GLN H H 68 8.763 8.763 8.403 0.360 25342 378 1 1 . 1 1 69 69 LEU N N 69 125.289 125.289 122.424 2.865 25342 379 1 1 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.648 -0.129 25342 380 1 1 . 1 1 69 69 LEU C C 69 172.567 172.567 175.224 -2.657 25342 381 1 1 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.134 -2.337 25342 382 1 1 . 1 1 69 69 LEU CB C 69 42.742 42.742 44.874 -2.132 25342 383 1 1 . 1 1 69 69 LEU H H 69 7.996 7.996 7.967 0.029 25342 384 1 1 . 1 1 70 70 ASP N N 70 123.170 123.170 120.554 2.616 25342 385 1 1 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.849 -0.443 25342 386 1 1 . 1 1 70 70 ASP C C 70 171.978 171.978 174.875 -2.897 25342 387 1 1 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.426 -1.744 25342 388 1 1 . 1 1 70 70 ASP CB C 70 38.729 38.729 42.976 -4.247 25342 389 1 1 . 1 1 70 70 ASP H H 70 8.278 8.278 8.384 -0.106 25342 390 1 1 . 1 1 71 71 ASN N N 71 117.524 117.524 119.285 -1.761 25342 391 1 1 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.707 -0.380 25342 392 1 1 . 1 1 71 71 ASN C C 71 171.825 171.825 174.817 -2.992 25342 393 1 1 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.335 -1.678 25342 394 1 1 . 1 1 71 71 ASN CB C 71 35.230 35.230 39.067 -3.837 25342 395 1 1 . 1 1 71 71 ASN H H 71 8.372 8.372 8.402 -0.030 25342 396 1 1 . 1 1 72 72 ILE N N 72 124.515 124.515 123.798 0.717 25342 397 1 1 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.066 -0.137 25342 398 1 1 . 1 1 72 72 ILE C C 72 171.607 171.607 174.609 -3.002 25342 399 1 1 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.163 -2.874 25342 400 1 1 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.513 -2.753 25342 401 1 1 . 1 1 72 72 ILE H H 72 7.653 7.653 8.055 -0.402 25342 402 1 1 . 1 1 73 73 ASP N N 73 125.182 125.182 127.590 -2.408 25342 403 1 1 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.441 0.187 25342 404 1 1 . 1 1 73 73 ASP C C 73 173.980 173.980 176.319 -2.339 25342 405 1 1 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.587 -5.373 25342 406 1 1 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.405 -3.503 25342 407 1 1 . 1 1 73 73 ASP H H 73 8.382 8.382 8.621 -0.239 25342 408 1 1 . 1 1 74 74 TYR N N 74 123.092 123.092 123.932 -0.840 25342 409 1 1 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.421 -0.556 25342 410 1 1 . 1 1 74 74 TYR C C 74 173.582 173.582 176.930 -3.348 25342 411 1 1 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.809 1.677 25342 412 1 1 . 1 1 74 74 TYR CB C 74 34.808 34.808 37.420 -2.612 25342 413 1 1 . 1 1 74 74 TYR H H 74 7.348 7.348 7.585 -0.237 25342 414 1 1 . 1 1 75 75 ASN N N 75 109.447 109.447 117.016 -7.569 25342 415 1 1 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.383 0.542 25342 416 1 1 . 1 1 75 75 ASN C C 75 172.570 172.570 175.744 -3.174 25342 417 1 1 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.032 -2.414 25342 418 1 1 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.409 -2.875 25342 419 1 1 . 1 1 75 75 ASN H H 75 8.040 8.040 7.805 0.235 25342 420 1 1 . 1 1 76 76 ASN N N 76 117.411 117.411 115.127 2.284 25342 421 1 1 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.638 -0.184 25342 422 1 1 . 1 1 76 76 ASN C C 76 171.155 171.155 174.367 -3.212 25342 423 1 1 . 1 1 76 76 ASN CA C 76 50.934 50.934 52.890 -1.956 25342 424 1 1 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.475 -2.817 25342 425 1 1 . 1 1 76 76 ASN H H 76 7.750 7.750 7.704 0.046 25342 426 1 1 . 1 1 77 77 TYR N N 77 116.878 116.878 119.816 -2.938 25342 427 1 1 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.553 -0.199 25342 428 1 1 . 1 1 77 77 TYR C C 77 172.224 172.224 174.596 -2.372 25342 429 1 1 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.374 -3.134 25342 430 1 1 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.613 -2.500 25342 431 1 1 . 1 1 77 77 TYR H H 77 7.789 7.789 7.623 0.166 25342 432 1 1 . 1 1 78 78 ASP N N 78 121.352 121.352 122.969 -1.617 25342 433 1 1 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.670 0.127 25342 434 1 1 . 1 1 78 78 ASP C C 78 172.623 172.623 175.409 -2.786 25342 435 1 1 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.821 -3.631 25342 436 1 1 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.383 -1.347 25342 437 1 1 . 1 1 78 78 ASP H H 78 9.036 9.036 8.339 0.697 25342 438 1 1 . 1 1 79 79 LEU N N 79 123.073 123.073 118.723 4.350 25342 439 1 1 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.423 -0.315 25342 440 1 1 . 1 1 79 79 LEU C C 79 170.730 170.730 174.528 -3.798 25342 441 1 1 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.942 -2.685 25342 442 1 1 . 1 1 79 79 LEU CB C 79 42.284 42.284 45.687 -3.403 25342 443 1 1 . 1 1 79 79 LEU H H 79 7.877 7.877 8.141 -0.264 25342 444 1 1 . 1 1 80 80 ILE N N 80 126.348 126.348 124.940 1.408 25342 445 1 1 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.749 0.320 25342 446 1 1 . 1 1 80 80 ILE C C 80 171.584 171.584 174.533 -2.949 25342 447 1 1 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.467 -3.052 25342 448 1 1 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.395 -2.397 25342 449 1 1 . 1 1 80 80 ILE H H 80 8.704 8.704 8.932 -0.228 25342 450 1 1 . 1 1 81 81 LEU N N 81 126.303 126.303 128.048 -1.745 25342 451 1 1 . 1 1 81 81 LEU HA H 81 5.123 5.123 5.244 -0.121 25342 452 1 1 . 1 1 81 81 LEU C C 81 172.779 172.779 175.876 -3.097 25342 453 1 1 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.151 -4.642 25342 454 1 1 . 1 1 81 81 LEU CB C 81 41.715 41.715 44.519 -2.804 25342 455 1 1 . 1 1 81 81 LEU H H 81 9.202 9.202 8.997 0.205 25342 456 1 1 . 1 1 82 82 ILE N N 82 120.931 120.931 120.449 0.482 25342 457 1 1 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.875 -0.028 25342 458 1 1 . 1 1 82 82 ILE C C 82 172.796 172.796 174.336 -1.540 25342 459 1 1 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.717 -2.836 25342 460 1 1 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.108 -4.311 25342 461 1 1 . 1 1 82 82 ILE H H 82 8.846 8.846 8.779 0.067 25342 462 1 1 . 1 1 83 83 GLY N N 83 120.905 120.905 112.245 8.660 25342 463 1 1 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.976 -2.419 25342 464 1 1 . 1 1 83 83 GLY H H 83 9.558 9.558 7.937 1.621 25342 465 1 1 . 1 1 84 84 SER N N 84 116.601 116.601 116.622 -0.021 25342 466 1 1 . 1 1 84 84 SER HA H 84 5.476 5.476 4.941 0.535 25342 467 1 1 . 1 1 84 84 SER CA C 84 51.324 51.324 54.808 -3.484 25342 468 1 1 . 1 1 84 84 SER CB C 84 64.271 64.271 65.256 -0.985 25342 469 1 1 . 1 1 84 84 SER H H 84 7.533 7.533 7.572 -0.039 25342 470 1 1 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.561 0.602 25342 471 1 1 . 1 1 85 85 PRO C C 85 175.590 175.590 176.024 -0.434 25342 472 1 1 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.478 -3.595 25342 473 1 1 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.790 -2.316 25342 474 1 1 . 1 1 86 86 VAL N N 86 116.295 116.295 118.412 -2.117 25342 475 1 1 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.392 -0.571 25342 476 1 1 . 1 1 86 86 VAL C C 86 172.692 172.692 175.758 -3.066 25342 477 1 1 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.414 -1.602 25342 478 1 1 . 1 1 86 86 VAL CB C 86 30.083 30.083 33.372 -3.289 25342 479 1 1 . 1 1 86 86 VAL H H 86 7.246 7.246 7.837 -0.591 25342 480 1 1 . 1 1 87 87 TRP N N 87 131.042 131.042 127.339 3.703 25342 481 1 1 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.474 -0.163 25342 482 1 1 . 1 1 87 87 TRP C C 87 173.323 173.323 176.916 -3.593 25342 483 1 1 . 1 1 87 87 TRP CA C 87 50.887 50.887 57.613 -6.726 25342 484 1 1 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.030 -3.720 25342 485 1 1 . 1 1 87 87 TRP H H 87 9.555 9.555 8.016 1.539 25342 486 1 1 . 1 1 88 88 SER N N 88 122.660 122.660 116.793 5.867 25342 487 1 1 . 1 1 88 88 SER HA H 88 4.582 4.582 4.124 0.458 25342 488 1 1 . 1 1 88 88 SER C C 88 172.096 172.096 174.438 -2.342 25342 489 1 1 . 1 1 88 88 SER CA C 88 55.391 55.391 59.780 -4.389 25342 490 1 1 . 1 1 88 88 SER CB C 88 57.813 57.813 61.038 -3.225 25342 491 1 1 . 1 1 88 88 SER H H 88 10.257 10.257 8.846 1.411 25342 492 1 1 . 1 1 89 89 GLY N N 89 128.381 128.381 112.964 15.417 25342 493 1 1 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.816 -2.187 25342 494 1 1 . 1 1 89 89 GLY H H 89 6.372 6.372 8.119 -1.747 25342 495 1 1 . 1 1 90 90 TYR N N 90 120.345 120.345 117.426 2.919 25342 496 1 1 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.951 -0.762 25342 497 1 1 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.510 0.039 25342 498 1 1 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.955 -0.759 25342 499 1 1 . 1 1 90 90 TYR H H 90 8.113 8.113 6.966 1.147 25342 500 1 1 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.654 0.180 25342 501 1 1 . 1 1 91 91 PRO C C 91 170.911 170.911 176.330 -5.419 25342 502 1 1 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.665 -3.830 25342 503 1 1 . 1 1 91 91 PRO CB C 91 26.070 26.070 33.239 -7.169 25342 504 1 1 . 1 1 92 92 ALA N N 92 120.629 120.629 121.970 -1.341 25342 505 1 1 . 1 1 92 92 ALA HA H 92 3.619 3.619 4.322 -0.703 25342 506 1 1 . 1 1 92 92 ALA C C 92 176.782 176.782 177.182 -0.400 25342 507 1 1 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.844 -2.427 25342 508 1 1 . 1 1 92 92 ALA CB C 92 15.516 15.516 18.571 -3.055 25342 509 1 1 . 1 1 92 92 ALA H H 92 7.554 7.554 8.738 -1.184 25342 510 1 1 . 1 1 93 93 THR N N 93 112.558 112.558 110.301 2.257 25342 511 1 1 . 1 1 93 93 THR CB C 93 64.173 64.173 67.099 -2.926 25342 512 1 1 . 1 1 93 93 THR H H 93 6.730 6.730 8.081 -1.351 25342 513 1 1 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.301 -0.442 25342 514 1 1 . 1 1 94 94 PRO C C 94 173.309 173.309 178.220 -4.911 25342 515 1 1 . 1 1 94 94 PRO CA C 94 63.063 63.063 65.084 -2.021 25342 516 1 1 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.070 -2.791 25342 517 1 1 . 1 1 95 95 ILE N N 95 111.014 111.014 116.762 -5.748 25342 518 1 1 . 1 1 95 95 ILE HA H 95 3.605 3.605 3.954 -0.349 25342 519 1 1 . 1 1 95 95 ILE C C 95 174.302 174.302 177.698 -3.396 25342 520 1 1 . 1 1 95 95 ILE CA C 95 57.181 57.181 61.046 -3.865 25342 521 1 1 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.770 -4.987 25342 522 1 1 . 1 1 95 95 ILE H H 95 7.995 7.995 8.435 -0.440 25342 523 1 1 . 1 1 96 96 LYS N N 96 123.208 123.208 121.593 1.615 25342 524 1 1 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.955 -0.863 25342 525 1 1 . 1 1 96 96 LYS C C 96 174.451 174.451 178.528 -4.077 25342 526 1 1 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.528 -2.487 25342 527 1 1 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.690 -2.943 25342 528 1 1 . 1 1 96 96 LYS H H 96 6.928 6.928 7.883 -0.955 25342 529 1 1 . 1 1 97 97 THR N N 97 113.320 113.320 114.876 -1.556 25342 530 1 1 . 1 1 97 97 THR HA H 97 3.436 3.436 3.676 -0.240 25342 531 1 1 . 1 1 97 97 THR C C 97 173.221 173.221 176.556 -3.335 25342 532 1 1 . 1 1 97 97 THR CA C 97 62.710 62.710 65.347 -2.637 25342 533 1 1 . 1 1 97 97 THR CB C 97 65.562 65.562 68.637 -3.075 25342 534 1 1 . 1 1 97 97 THR H H 97 6.325 6.325 7.696 -1.371 25342 535 1 1 . 1 1 98 98 LEU N N 98 120.963 120.963 122.775 -1.812 25342 536 1 1 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.128 -0.503 25342 537 1 1 . 1 1 98 98 LEU C C 98 174.713 174.713 177.765 -3.052 25342 538 1 1 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.706 -2.192 25342 539 1 1 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.715 -1.987 25342 540 1 1 . 1 1 98 98 LEU H H 98 7.536 7.536 7.554 -0.018 25342 541 1 1 . 1 1 99 99 LEU N N 99 118.859 118.859 118.755 0.104 25342 542 1 1 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.914 -0.242 25342 543 1 1 . 1 1 99 99 LEU C C 99 177.458 177.458 178.406 -0.948 25342 544 1 1 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.285 -3.140 25342 545 1 1 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.138 -2.281 25342 546 1 1 . 1 1 99 99 LEU H H 99 8.179 8.179 8.091 0.088 25342 547 1 1 . 1 1 100 100 ASP N N 100 118.703 118.703 117.554 1.149 25342 548 1 1 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.312 -0.091 25342 549 1 1 . 1 1 100 100 ASP C C 100 176.472 176.472 178.279 -1.807 25342 550 1 1 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.203 -2.896 25342 551 1 1 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.771 -3.413 25342 552 1 1 . 1 1 100 100 ASP H H 100 7.867 7.867 7.764 0.103 25342 553 1 1 . 1 1 101 101 GLN N N 101 117.829 117.829 117.172 0.657 25342 554 1 1 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.226 -0.026 25342 555 1 1 . 1 1 101 101 GLN C C 101 174.508 174.508 177.871 -3.363 25342 556 1 1 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.183 -3.495 25342 557 1 1 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.535 -3.938 25342 558 1 1 . 1 1 101 101 GLN H H 101 7.597 7.597 7.651 -0.054 25342 559 1 1 . 1 1 102 102 MET N N 102 118.406 118.406 113.310 5.096 25342 560 1 1 . 1 1 102 102 MET HA H 102 3.864 3.864 5.019 -1.155 25342 561 1 1 . 1 1 102 102 MET C C 102 172.820 172.820 177.137 -4.317 25342 562 1 1 . 1 1 102 102 MET CA C 102 53.298 53.298 56.627 -3.329 25342 563 1 1 . 1 1 102 102 MET CB C 102 31.207 31.207 33.101 -1.894 25342 564 1 1 . 1 1 102 102 MET H H 102 7.434 7.434 7.813 -0.379 25342 565 1 1 . 1 1 103 103 LYS N N 103 115.889 115.889 121.073 -5.184 25342 566 1 1 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.926 -0.007 25342 567 1 1 . 1 1 103 103 LYS C C 103 173.938 173.938 176.819 -2.881 25342 568 1 1 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.231 -2.795 25342 569 1 1 . 1 1 103 103 LYS CB C 103 29.263 29.263 32.008 -2.745 25342 570 1 1 . 1 1 103 103 LYS H H 103 6.881 6.881 7.853 -0.972 25342 571 1 1 . 1 1 104 104 ASN N N 104 114.951 114.951 113.410 1.541 25342 572 1 1 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.704 0.027 25342 573 1 1 . 1 1 104 104 ASN C C 104 172.617 172.617 175.344 -2.727 25342 574 1 1 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.133 -2.867 25342 575 1 1 . 1 1 104 104 ASN CB C 104 35.783 35.783 39.300 -3.517 25342 576 1 1 . 1 1 104 104 ASN H H 104 8.493 8.493 7.947 0.546 25342 577 1 1 . 1 1 105 105 TYR N N 105 122.680 122.680 120.325 2.355 25342 578 1 1 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.549 0.013 25342 579 1 1 . 1 1 105 105 TYR CA C 105 55.433 55.433 58.088 -2.655 25342 580 1 1 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.294 -3.462 25342 581 1 1 . 1 1 105 105 TYR H H 105 8.217 8.217 7.511 0.706 25342 582 1 1 . 1 1 106 106 ARG N N 106 128.872 128.872 118.481 10.391 25342 583 1 1 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.694 -0.429 25342 584 1 1 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.079 -2.097 25342 585 1 1 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.621 -5.491 25342 586 1 1 . 1 1 106 106 ARG H H 106 8.801 8.801 8.766 0.035 25342 587 1 1 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.701 -2.300 25342 588 1 1 . 1 1 108 108 GLU N N 108 117.000 117.000 121.041 -4.041 25342 589 1 1 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.793 -0.167 25342 590 1 1 . 1 1 108 108 GLU C C 108 174.125 174.125 175.164 -1.039 25342 591 1 1 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.618 -1.830 25342 592 1 1 . 1 1 108 108 GLU CB C 108 30.440 30.440 32.940 -2.500 25342 593 1 1 . 1 1 108 108 GLU H H 108 7.514 7.514 8.487 -0.973 25342 594 1 1 . 1 1 109 109 VAL N N 109 123.398 123.398 124.728 -1.330 25342 595 1 1 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.925 0.412 25342 596 1 1 . 1 1 109 109 VAL C C 109 170.606 170.606 174.353 -3.747 25342 597 1 1 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.885 -3.605 25342 598 1 1 . 1 1 109 109 VAL CB C 109 32.657 32.657 32.835 -0.178 25342 599 1 1 . 1 1 109 109 VAL H H 109 8.942 8.942 8.836 0.106 25342 600 1 1 . 1 1 110 110 ALA N N 110 127.905 127.905 129.514 -1.609 25342 601 1 1 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.688 -0.061 25342 602 1 1 . 1 1 110 110 ALA C C 110 173.195 173.195 175.754 -2.559 25342 603 1 1 . 1 1 110 110 ALA CA C 110 47.346 47.346 50.065 -2.719 25342 604 1 1 . 1 1 110 110 ALA CB C 110 18.325 18.325 20.953 -2.628 25342 605 1 1 . 1 1 110 110 ALA H H 110 8.776 8.776 7.975 0.801 25342 606 1 1 . 1 1 111 111 SER N N 111 110.523 110.523 119.322 -8.799 25342 607 1 1 . 1 1 111 111 SER HA H 111 5.562 5.562 4.986 0.576 25342 608 1 1 . 1 1 111 111 SER C C 111 170.719 170.719 173.394 -2.675 25342 609 1 1 . 1 1 111 111 SER CA C 111 51.314 51.314 57.257 -5.943 25342 610 1 1 . 1 1 111 111 SER CB C 111 61.907 61.907 63.211 -1.304 25342 611 1 1 . 1 1 111 111 SER H H 111 7.480 7.480 7.940 -0.460 25342 612 1 1 . 1 1 112 112 PHE N N 112 125.567 125.567 121.787 3.780 25342 613 1 1 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.875 0.481 25342 614 1 1 . 1 1 112 112 PHE C C 112 169.536 169.536 173.826 -4.290 25342 615 1 1 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.370 -4.999 25342 616 1 1 . 1 1 112 112 PHE CB C 112 39.788 39.788 41.282 -1.494 25342 617 1 1 . 1 1 112 112 PHE H H 112 7.848 7.848 8.409 -0.561 25342 618 1 1 . 1 1 113 113 PHE N N 113 115.065 115.065 115.703 -0.638 25342 619 1 1 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.325 0.779 25342 620 1 1 . 1 1 113 113 PHE C C 113 173.006 173.006 175.183 -2.177 25342 621 1 1 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.389 -6.127 25342 622 1 1 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.756 -5.007 25342 623 1 1 . 1 1 113 113 PHE H H 113 7.361 7.361 8.298 -0.937 25342 624 1 1 . 1 1 114 114 THR N N 114 108.014 108.014 113.039 -5.025 25342 625 1 1 . 1 1 114 114 THR HA H 114 4.999 4.999 4.894 0.105 25342 626 1 1 . 1 1 114 114 THR C C 114 169.874 169.874 173.897 -4.023 25342 627 1 1 . 1 1 114 114 THR CA C 114 56.500 56.500 60.520 -4.020 25342 628 1 1 . 1 1 114 114 THR CB C 114 68.809 68.809 70.431 -1.622 25342 629 1 1 . 1 1 114 114 THR H H 114 7.867 7.867 8.508 -0.641 25342 630 1 1 . 1 1 115 115 SER N N 115 115.049 115.049 117.492 -2.443 25342 631 1 1 . 1 1 115 115 SER HA H 115 5.613 5.613 4.607 1.006 25342 632 1 1 . 1 1 115 115 SER C C 115 171.247 171.247 174.598 -3.351 25342 633 1 1 . 1 1 115 115 SER CA C 115 54.830 54.830 57.112 -2.283 25342 634 1 1 . 1 1 115 115 SER CB C 115 63.992 63.992 65.306 -1.314 25342 635 1 1 . 1 1 115 115 SER H H 115 8.970 8.970 8.305 0.665 25342 636 1 1 . 1 1 116 116 ALA N N 116 122.671 122.671 123.657 -0.986 25342 637 1 1 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.499 0.486 25342 638 1 1 . 1 1 116 116 ALA C C 116 176.180 176.180 177.879 -1.699 25342 639 1 1 . 1 1 116 116 ALA CA C 116 49.200 49.200 50.932 -1.732 25342 640 1 1 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.734 -1.739 25342 641 1 1 . 1 1 116 116 ALA H H 116 8.963 8.963 8.806 0.157 25342 642 1 1 . 1 1 117 117 GLY N N 117 107.387 107.387 107.033 0.354 25342 643 1 1 . 1 1 117 117 GLY C C 117 172.528 172.528 173.671 -1.143 25342 644 1 1 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.835 -2.103 25342 645 1 1 . 1 1 117 117 GLY H H 117 9.340 9.340 8.209 1.131 25342 646 1 1 . 1 1 118 118 THR N N 118 113.481 113.481 112.041 1.440 25342 647 1 1 . 1 1 118 118 THR HA H 118 4.651 4.651 4.474 0.177 25342 648 1 1 . 1 1 118 118 THR C C 118 172.067 172.067 174.760 -2.693 25342 649 1 1 . 1 1 118 118 THR CA C 118 57.357 57.357 60.441 -3.083 25342 650 1 1 . 1 1 118 118 THR CB C 118 69.475 69.475 70.475 -1.000 25342 651 1 1 . 1 1 118 118 THR H H 118 9.373 9.373 7.487 1.886 25342 652 1 1 . 1 1 119 119 ASN N N 119 113.202 113.202 118.505 -5.303 25342 653 1 1 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.389 0.229 25342 654 1 1 . 1 1 119 119 ASN C C 119 173.114 173.114 176.211 -3.097 25342 655 1 1 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.433 -2.749 25342 656 1 1 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.204 -3.474 25342 657 1 1 . 1 1 119 119 ASN H H 119 8.908 8.908 8.893 0.015 25342 658 1 1 . 1 1 120 120 HIS N N 120 117.315 117.315 115.393 1.922 25342 659 1 1 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.643 -0.857 25342 660 1 1 . 1 1 120 120 HIS C C 120 174.381 174.381 174.943 -0.562 25342 661 1 1 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.210 -3.694 25342 662 1 1 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.620 -3.116 25342 663 1 1 . 1 1 120 120 HIS H H 120 8.074 8.074 8.745 -0.671 25342 664 1 1 . 1 1 121 121 LYS N N 121 118.678 118.678 118.464 0.214 25342 665 1 1 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.147 -0.313 25342 666 1 1 . 1 1 121 121 LYS C C 121 176.564 176.564 177.531 -0.967 25342 667 1 1 . 1 1 121 121 LYS CA C 121 57.295 57.295 57.179 0.115 25342 668 1 1 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.390 -3.448 25342 669 1 1 . 1 1 121 121 LYS H H 121 8.336 8.336 7.690 0.646 25342 670 1 1 . 1 1 122 122 ALA N N 122 122.146 122.146 123.786 -1.640 25342 671 1 1 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.129 -0.434 25342 672 1 1 . 1 1 122 122 ALA C C 122 175.163 175.163 179.384 -4.221 25342 673 1 1 . 1 1 122 122 ALA CA C 122 51.692 51.692 55.172 -3.480 25342 674 1 1 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.310 -2.592 25342 675 1 1 . 1 1 122 122 ALA H H 122 7.584 7.584 8.192 -0.608 25342 676 1 1 . 1 1 123 123 TYR N N 123 119.730 119.730 116.884 2.846 25342 677 1 1 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.117 -0.964 25342 678 1 1 . 1 1 123 123 TYR C C 123 174.340 174.340 177.238 -2.898 25342 679 1 1 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.803 -0.405 25342 680 1 1 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.354 -2.691 25342 681 1 1 . 1 1 123 123 TYR H H 123 7.317 7.317 8.254 -0.937 25342 682 1 1 . 1 1 124 124 VAL N N 124 118.649 118.649 120.124 -1.475 25342 683 1 1 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.280 -0.078 25342 684 1 1 . 1 1 124 124 VAL C C 124 175.603 175.603 178.118 -2.515 25342 685 1 1 . 1 1 124 124 VAL CA C 124 64.680 64.680 65.965 -1.285 25342 686 1 1 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.548 -1.259 25342 687 1 1 . 1 1 124 124 VAL H H 124 7.799 7.799 6.875 0.924 25342 688 1 1 . 1 1 125 125 SER N N 125 114.475 114.475 116.022 -1.547 25342 689 1 1 . 1 1 125 125 SER HA H 125 4.032 4.032 4.095 -0.063 25342 690 1 1 . 1 1 125 125 SER C C 125 174.849 174.849 177.001 -2.152 25342 691 1 1 . 1 1 125 125 SER CA C 125 59.002 59.002 62.470 -3.468 25342 692 1 1 . 1 1 125 125 SER CB C 125 59.613 59.613 62.870 -3.257 25342 693 1 1 . 1 1 125 125 SER H H 125 7.766 7.766 7.855 -0.089 25342 694 1 1 . 1 1 126 126 HIS N N 126 119.326 119.326 120.562 -1.236 25342 695 1 1 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.397 -0.270 25342 696 1 1 . 1 1 126 126 HIS C C 126 172.865 172.865 178.147 -5.282 25342 697 1 1 . 1 1 126 126 HIS CA C 126 55.706 55.706 60.086 -4.380 25342 698 1 1 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.314 -4.321 25342 699 1 1 . 1 1 126 126 HIS H H 126 8.569 8.569 8.464 0.105 25342 700 1 1 . 1 1 127 127 PHE N N 127 121.044 121.044 120.313 0.731 25342 701 1 1 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.420 -1.246 25342 702 1 1 . 1 1 127 127 PHE C C 127 173.378 173.378 176.181 -2.803 25342 703 1 1 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.170 -0.303 25342 704 1 1 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.301 -3.248 25342 705 1 1 . 1 1 127 127 PHE H H 127 9.139 9.139 8.651 0.488 25342 706 1 1 . 1 1 128 128 ASN N N 128 114.893 114.893 117.285 -2.392 25342 707 1 1 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.305 -0.265 25342 708 1 1 . 1 1 128 128 ASN C C 128 175.230 175.230 177.566 -2.336 25342 709 1 1 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.172 -1.872 25342 710 1 1 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.812 -2.642 25342 711 1 1 . 1 1 128 128 ASN H H 128 7.774 7.774 8.219 -0.445 25342 712 1 1 . 1 1 129 129 GLU N N 129 119.804 119.804 120.026 -0.222 25342 713 1 1 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.816 0.224 25342 714 1 1 . 1 1 129 129 GLU C C 129 177.052 177.052 178.453 -1.401 25342 715 1 1 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.956 -2.225 25342 716 1 1 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.264 -2.068 25342 717 1 1 . 1 1 129 129 GLU H H 129 7.577 7.577 7.775 -0.198 25342 718 1 1 . 1 1 130 130 TRP N N 130 120.979 120.979 117.674 3.305 25342 719 1 1 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.443 0.014 25342 720 1 1 . 1 1 130 130 TRP C C 130 174.329 174.329 174.584 -0.255 25342 721 1 1 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.508 -1.820 25342 722 1 1 . 1 1 130 130 TRP CB C 130 26.991 26.991 28.963 -1.972 25342 723 1 1 . 1 1 130 130 TRP H H 130 8.225 8.225 7.290 0.935 25342 724 1 1 . 1 1 131 131 ALA N N 131 120.450 120.450 119.225 1.225 25342 725 1 1 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.359 -0.423 25342 726 1 1 . 1 1 131 131 ALA C C 131 172.487 172.487 175.380 -2.893 25342 727 1 1 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.872 -3.438 25342 728 1 1 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.910 -3.622 25342 729 1 1 . 1 1 131 131 ALA H H 131 8.081 8.081 7.554 0.527 25342 730 1 1 . 1 1 132 132 ASP N N 132 117.813 117.813 120.035 -2.222 25342 731 1 1 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.422 -0.214 25342 732 1 1 . 1 1 132 132 ASP C C 132 173.804 173.804 176.197 -2.393 25342 733 1 1 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.300 -1.119 25342 734 1 1 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.487 -1.166 25342 735 1 1 . 1 1 132 132 ASP H H 132 6.772 6.772 7.804 -1.032 25342 736 1 1 . 1 1 133 133 GLY N N 133 115.052 115.052 112.857 2.195 25342 737 1 1 . 1 1 133 133 GLY C C 133 172.078 172.078 173.942 -1.864 25342 738 1 1 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.997 -2.577 25342 739 1 1 . 1 1 133 133 GLY H H 133 8.626 8.626 7.884 0.742 25342 740 1 1 . 1 1 134 134 LEU N N 134 120.063 120.063 123.147 -3.084 25342 741 1 1 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.487 -0.015 25342 742 1 1 . 1 1 134 134 LEU C C 134 174.079 174.079 176.706 -2.627 25342 743 1 1 . 1 1 134 134 LEU CA C 134 50.964 50.964 54.313 -3.349 25342 744 1 1 . 1 1 134 134 LEU CB C 134 40.370 40.370 42.293 -1.923 25342 745 1 1 . 1 1 134 134 LEU H H 134 8.094 8.094 8.248 -0.154 25342 746 1 1 . 1 1 135 135 ASN N N 135 119.292 119.292 120.552 -1.260 25342 747 1 1 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.653 -0.030 25342 748 1 1 . 1 1 135 135 ASN C C 135 170.527 170.527 174.355 -3.828 25342 749 1 1 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.302 -4.300 25342 750 1 1 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.656 -5.096 25342 751 1 1 . 1 1 135 135 ASN H H 135 8.513 8.513 8.704 -0.191 25342 752 1 1 . 1 1 136 136 VAL N N 136 125.412 125.412 126.435 -1.023 25342 753 1 1 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.589 0.017 25342 754 1 1 . 1 1 136 136 VAL C C 136 175.420 175.420 176.153 -0.733 25342 755 1 1 . 1 1 136 136 VAL CA C 136 58.382 58.382 60.376 -1.994 25342 756 1 1 . 1 1 136 136 VAL CB C 136 29.247 29.247 33.256 -4.009 25342 757 1 1 . 1 1 136 136 VAL H H 136 7.648 7.648 8.379 -0.731 25342 758 1 1 . 1 1 137 137 ILE N N 137 121.881 121.881 123.378 -1.497 25342 759 1 1 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.404 0.029 25342 760 1 1 . 1 1 137 137 ILE C C 137 173.906 173.906 175.257 -1.351 25342 761 1 1 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.963 -1.985 25342 762 1 1 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.149 -1.953 25342 763 1 1 . 1 1 137 137 ILE H H 137 9.139 9.139 8.504 0.635 25342 764 1 1 . 1 1 138 138 GLY N N 138 108.226 108.226 106.583 1.643 25342 765 1 1 . 1 1 138 138 GLY CA C 138 43.391 43.391 44.991 -1.600 25342 766 1 1 . 1 1 138 138 GLY H H 138 6.645 6.645 7.368 -0.723 25342 767 1 1 . 1 1 139 139 VAL N N 139 119.408 119.408 119.528 -0.120 25342 768 1 1 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.379 0.978 25342 769 1 1 . 1 1 139 139 VAL C C 139 172.327 172.327 175.214 -2.887 25342 770 1 1 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.750 -3.483 25342 771 1 1 . 1 1 139 139 VAL CB C 139 32.743 32.743 32.808 -0.065 25342 772 1 1 . 1 1 139 139 VAL H H 139 8.092 8.092 8.602 -0.510 25342 773 1 1 . 1 1 140 140 ALA N N 140 127.415 127.415 129.806 -2.391 25342 774 1 1 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.098 -0.653 25342 775 1 1 . 1 1 140 140 ALA C C 140 170.718 170.718 176.454 -5.736 25342 776 1 1 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.893 -1.993 25342 777 1 1 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.623 -1.564 25342 778 1 1 . 1 1 140 140 ALA H H 140 9.093 9.093 8.610 0.483 25342 779 1 1 . 1 1 141 141 ARG N N 141 119.287 119.287 119.726 -0.439 25342 780 1 1 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.144 -2.657 25342 781 1 1 . 1 1 141 141 ARG C C 141 173.375 173.375 175.847 -2.472 25342 782 1 1 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.213 -3.329 25342 783 1 1 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.006 -4.322 25342 784 1 1 . 1 1 141 141 ARG H H 141 7.620 7.620 8.551 -0.931 25342 785 1 1 . 1 1 142 142 ASP N N 142 125.999 125.999 121.503 4.496 25342 786 1 1 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.317 -0.593 25342 787 1 1 . 1 1 142 142 ASP C C 142 169.292 169.292 176.638 -7.346 25342 788 1 1 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.280 -2.942 25342 789 1 1 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.781 -4.104 25342 790 1 1 . 1 1 142 142 ASP H H 142 9.482 9.482 9.158 0.324 25342 791 1 1 . 1 1 143 143 ASP N N 143 119.293 119.293 119.667 -0.374 25342 792 1 1 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.259 0.047 25342 793 1 1 . 1 1 143 143 ASP C C 143 175.686 175.686 177.295 -1.609 25342 794 1 1 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.916 -6.011 25342 795 1 1 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.150 -3.838 25342 796 1 1 . 1 1 143 143 ASP H H 143 8.108 8.108 8.495 -0.387 25342 797 1 1 . 1 1 144 144 SER N N 144 115.303 115.303 115.512 -0.209 25342 798 1 1 . 1 1 144 144 SER HA H 144 3.740 3.740 4.233 -0.493 25342 799 1 1 . 1 1 144 144 SER C C 144 172.925 172.925 174.056 -1.131 25342 800 1 1 . 1 1 144 144 SER CA C 144 59.213 59.213 59.729 -0.516 25342 801 1 1 . 1 1 144 144 SER CB C 144 60.806 60.806 62.910 -2.104 25342 802 1 1 . 1 1 144 144 SER H H 144 7.642 7.642 7.887 -0.245 25342 803 1 1 . 1 1 145 145 GLU N N 145 119.523 119.523 117.282 2.241 25342 804 1 1 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.153 0.153 25342 805 1 1 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.244 -3.205 25342 806 1 1 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.610 -2.811 25342 807 1 1 . 1 1 145 145 GLU H H 145 7.771 7.771 7.641 0.130 25342 808 1 1 . 1 1 146 146 VAL N N 146 118.683 118.683 122.337 -3.654 25342 809 1 1 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.438 -0.497 25342 810 1 1 . 1 1 146 146 VAL C C 146 174.591 174.591 175.881 -1.290 25342 811 1 1 . 1 1 146 146 VAL CA C 146 63.932 63.932 65.626 -1.694 25342 812 1 1 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.823 -2.776 25342 813 1 1 . 1 1 146 146 VAL H H 146 6.352 6.352 7.699 -1.347 25342 814 1 1 . 1 1 147 147 ASP N N 147 119.312 119.312 116.849 2.463 25342 815 1 1 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.393 -0.338 25342 816 1 1 . 1 1 147 147 ASP C C 147 174.783 174.783 177.118 -2.335 25342 817 1 1 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.213 -1.972 25342 818 1 1 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.542 -3.309 25342 819 1 1 . 1 1 147 147 ASP H H 147 8.370 8.370 8.490 -0.120 25342 820 1 1 . 1 1 148 148 LYS N N 148 119.342 119.342 117.254 2.088 25342 821 1 1 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.322 -0.385 25342 822 1 1 . 1 1 148 148 LYS C C 148 176.384 176.384 178.654 -2.270 25342 823 1 1 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.794 -2.088 25342 824 1 1 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.830 -3.319 25342 825 1 1 . 1 1 148 148 LYS H H 148 7.040 7.040 7.389 -0.349 25342 826 1 1 . 1 1 149 149 TRP N N 149 118.258 118.258 120.031 -1.773 25342 827 1 1 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.648 -0.057 25342 828 1 1 . 1 1 149 149 TRP C C 149 174.212 174.212 176.666 -2.454 25342 829 1 1 . 1 1 149 149 TRP CA C 149 53.745 53.745 57.887 -4.142 25342 830 1 1 . 1 1 149 149 TRP CB C 149 26.940 26.940 29.464 -2.524 25342 831 1 1 . 1 1 149 149 TRP H H 149 7.811 7.811 7.393 0.418 25342 832 1 1 . 1 1 150 150 SER N N 150 109.618 109.618 114.764 -5.146 25342 833 1 1 . 1 1 150 150 SER HA H 150 4.234 4.234 4.786 -0.552 25342 834 1 1 . 1 1 150 150 SER C C 150 170.189 170.189 173.484 -3.295 25342 835 1 1 . 1 1 150 150 SER CA C 150 56.695 56.695 57.350 -0.655 25342 836 1 1 . 1 1 150 150 SER CB C 150 61.935 61.935 63.300 -1.365 25342 837 1 1 . 1 1 150 150 SER H H 150 7.793 7.793 7.615 0.178 25342 838 1 2 . 1 1 3 3 ALA N N 3 125.638 125.638 125.557 0.081 25342 839 1 2 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.494 -0.129 25342 840 1 2 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.136 -2.837 25342 841 1 2 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.508 -2.649 25342 842 1 2 . 1 1 3 3 ALA H H 3 8.325 8.325 8.088 0.237 25342 843 1 2 . 1 1 4 4 LYS N N 4 121.813 121.813 120.532 1.281 25342 844 1 2 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.784 -0.557 25342 845 1 2 . 1 1 4 4 LYS C C 4 174.574 174.574 174.655 -0.081 25342 846 1 2 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.281 -1.500 25342 847 1 2 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.162 -2.672 25342 848 1 2 . 1 1 4 4 LYS H H 4 8.486 8.486 7.998 0.488 25342 849 1 2 . 1 1 5 5 LYS N N 5 129.722 129.722 120.600 9.122 25342 850 1 2 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.598 -0.080 25342 851 1 2 . 1 1 5 5 LYS C C 5 174.720 174.720 175.009 -0.289 25342 852 1 2 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.789 -1.067 25342 853 1 2 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.301 -6.516 25342 854 1 2 . 1 1 5 5 LYS H H 5 10.015 10.015 8.157 1.858 25342 855 1 2 . 1 1 6 6 THR N N 6 126.254 126.254 116.131 10.123 25342 856 1 2 . 1 1 6 6 THR HA H 6 5.654 5.654 5.443 0.211 25342 857 1 2 . 1 1 6 6 THR C C 6 169.926 169.926 173.627 -3.701 25342 858 1 2 . 1 1 6 6 THR CA C 6 60.598 60.598 61.885 -1.287 25342 859 1 2 . 1 1 6 6 THR CB C 6 68.041 68.041 71.399 -3.358 25342 860 1 2 . 1 1 6 6 THR H H 6 8.538 8.538 8.682 -0.144 25342 861 1 2 . 1 1 7 7 LEU N N 7 130.775 130.775 126.334 4.441 25342 862 1 2 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.669 -0.075 25342 863 1 2 . 1 1 7 7 LEU C C 7 170.404 170.404 174.172 -3.768 25342 864 1 2 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.262 -3.329 25342 865 1 2 . 1 1 7 7 LEU CB C 7 40.728 40.728 46.014 -5.286 25342 866 1 2 . 1 1 7 7 LEU H H 7 8.575 8.575 9.024 -0.449 25342 867 1 2 . 1 1 8 8 ILE N N 8 127.242 127.242 123.550 3.692 25342 868 1 2 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.715 0.133 25342 869 1 2 . 1 1 8 8 ILE C C 8 170.936 170.936 174.203 -3.267 25342 870 1 2 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.472 -3.220 25342 871 1 2 . 1 1 8 8 ILE CB C 8 36.935 36.935 39.744 -2.809 25342 872 1 2 . 1 1 8 8 ILE H H 8 9.217 9.217 8.418 0.799 25342 873 1 2 . 1 1 9 9 LEU N N 9 127.183 127.183 128.705 -1.522 25342 874 1 2 . 1 1 9 9 LEU HA H 9 5.694 5.694 5.105 0.589 25342 875 1 2 . 1 1 9 9 LEU C C 9 173.824 173.824 175.706 -1.882 25342 876 1 2 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.691 -3.852 25342 877 1 2 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.583 1.380 25342 878 1 2 . 1 1 9 9 LEU H H 9 9.248 9.248 8.993 0.255 25342 879 1 2 . 1 1 10 10 TYR N N 10 113.330 113.330 122.036 -8.706 25342 880 1 2 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.348 0.166 25342 881 1 2 . 1 1 10 10 TYR C C 10 167.898 167.898 172.857 -4.959 25342 882 1 2 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.566 -0.692 25342 883 1 2 . 1 1 10 10 TYR CB C 10 38.436 38.436 41.397 -2.961 25342 884 1 2 . 1 1 10 10 TYR H H 10 7.306 7.306 8.811 -1.505 25342 885 1 2 . 1 1 11 11 TYR N N 11 121.297 121.297 123.308 -2.011 25342 886 1 2 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.690 0.072 25342 887 1 2 . 1 1 11 11 TYR C C 11 169.698 169.698 174.237 -4.539 25342 888 1 2 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.564 -0.517 25342 889 1 2 . 1 1 11 11 TYR CB C 11 40.538 40.538 39.847 0.691 25342 890 1 2 . 1 1 11 11 TYR H H 11 7.891 7.891 8.533 -0.642 25342 891 1 2 . 1 1 12 12 SER N N 12 117.763 117.763 123.116 -5.353 25342 892 1 2 . 1 1 12 12 SER HA H 12 4.679 4.679 4.357 0.322 25342 893 1 2 . 1 1 12 12 SER C C 12 170.075 170.075 173.739 -3.664 25342 894 1 2 . 1 1 12 12 SER CA C 12 53.619 53.619 56.827 -3.208 25342 895 1 2 . 1 1 12 12 SER CB C 12 62.847 62.847 63.154 -0.306 25342 896 1 2 . 1 1 12 12 SER H H 12 7.557 7.557 8.073 -0.516 25342 897 1 2 . 1 1 13 13 TRP N N 13 135.232 135.232 128.465 6.767 25342 898 1 2 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.830 0.806 25342 899 1 2 . 1 1 13 13 TRP C C 13 175.708 175.708 176.432 -0.724 25342 900 1 2 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.444 -1.328 25342 901 1 2 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.754 -2.119 25342 902 1 2 . 1 1 13 13 TRP H H 13 9.755 9.755 8.073 1.681 25342 903 1 2 . 1 1 14 14 SER N N 14 113.789 113.789 109.855 3.934 25342 904 1 2 . 1 1 14 14 SER HA H 14 4.223 4.223 4.741 -0.518 25342 905 1 2 . 1 1 14 14 SER C C 14 172.747 172.747 173.609 -0.862 25342 906 1 2 . 1 1 14 14 SER CA C 14 53.828 53.828 58.969 -5.141 25342 907 1 2 . 1 1 14 14 SER CB C 14 60.037 60.037 65.153 -5.116 25342 908 1 2 . 1 1 14 14 SER H H 14 10.026 10.026 8.673 1.353 25342 909 1 2 . 1 1 15 15 GLY N N 15 110.489 110.489 107.449 3.040 25342 910 1 2 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.588 -0.929 25342 911 1 2 . 1 1 15 15 GLY H H 15 7.391 7.391 8.119 -0.728 25342 912 1 2 . 1 1 16 16 GLU N N 16 129.005 129.005 122.109 6.896 25342 913 1 2 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.191 -0.128 25342 914 1 2 . 1 1 16 16 GLU CA C 16 56.761 56.761 58.613 -1.852 25342 915 1 2 . 1 1 16 16 GLU CB C 16 26.412 26.412 28.746 -2.334 25342 916 1 2 . 1 1 16 16 GLU H H 16 11.550 11.550 8.369 3.181 25342 917 1 2 . 1 1 17 17 THR N N 17 123.016 123.016 115.626 7.390 25342 918 1 2 . 1 1 17 17 THR HA H 17 4.035 4.035 4.071 -0.036 25342 919 1 2 . 1 1 17 17 THR C C 17 173.360 173.360 176.242 -2.882 25342 920 1 2 . 1 1 17 17 THR CA C 17 64.303 64.303 66.028 -1.725 25342 921 1 2 . 1 1 17 17 THR CB C 17 63.999 63.999 68.015 -4.016 25342 922 1 2 . 1 1 17 17 THR H H 17 11.293 11.293 8.560 2.733 25342 923 1 2 . 1 1 18 18 LYS N N 18 120.156 120.156 122.326 -2.170 25342 924 1 2 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.232 -1.376 25342 925 1 2 . 1 1 18 18 LYS C C 18 173.901 173.901 178.021 -4.120 25342 926 1 2 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.035 -2.201 25342 927 1 2 . 1 1 18 18 LYS CB C 18 29.481 29.481 31.604 -2.123 25342 928 1 2 . 1 1 18 18 LYS H H 18 6.940 6.940 7.952 -1.012 25342 929 1 2 . 1 1 19 19 LYS N N 19 117.237 117.237 119.166 -1.929 25342 930 1 2 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.069 -0.146 25342 931 1 2 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.952 -2.628 25342 932 1 2 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.287 -2.926 25342 933 1 2 . 1 1 19 19 LYS H H 19 7.212 7.212 7.926 -0.714 25342 934 1 2 . 1 1 20 20 MET N N 20 119.268 119.268 115.429 3.839 25342 935 1 2 . 1 1 20 20 MET HA H 20 4.413 4.413 4.228 0.185 25342 936 1 2 . 1 1 20 20 MET C C 20 173.625 173.625 176.436 -2.811 25342 937 1 2 . 1 1 20 20 MET CA C 20 52.261 52.261 55.594 -3.333 25342 938 1 2 . 1 1 20 20 MET CB C 20 26.680 26.680 32.057 -5.377 25342 939 1 2 . 1 1 20 20 MET H H 20 7.600 7.600 8.143 -0.543 25342 940 1 2 . 1 1 21 21 ALA N N 21 123.669 123.669 121.121 2.548 25342 941 1 2 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.061 -0.579 25342 942 1 2 . 1 1 21 21 ALA C C 21 176.628 176.628 178.916 -2.288 25342 943 1 2 . 1 1 21 21 ALA CA C 21 52.374 52.374 54.168 -1.794 25342 944 1 2 . 1 1 21 21 ALA CB C 21 16.495 16.495 19.062 -2.567 25342 945 1 2 . 1 1 21 21 ALA H H 21 8.738 8.738 7.826 0.912 25342 946 1 2 . 1 1 22 22 GLU N N 22 117.242 117.242 119.082 -1.840 25342 947 1 2 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.815 -0.142 25342 948 1 2 . 1 1 22 22 GLU C C 22 176.698 176.698 178.806 -2.108 25342 949 1 2 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.284 -2.744 25342 950 1 2 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.069 -2.635 25342 951 1 2 . 1 1 22 22 GLU H H 22 7.959 7.959 7.856 0.103 25342 952 1 2 . 1 1 23 23 LYS N N 23 123.302 123.302 119.311 3.991 25342 953 1 2 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.051 -0.230 25342 954 1 2 . 1 1 23 23 LYS C C 23 177.389 177.389 177.912 -0.523 25342 955 1 2 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.223 -2.301 25342 956 1 2 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.329 -2.815 25342 957 1 2 . 1 1 23 23 LYS H H 23 7.703 7.703 7.619 0.084 25342 958 1 2 . 1 1 24 24 ILE N N 24 122.208 122.208 116.701 5.507 25342 959 1 2 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.887 -0.604 25342 960 1 2 . 1 1 24 24 ILE C C 24 174.934 174.934 177.689 -2.755 25342 961 1 2 . 1 1 24 24 ILE CA C 24 63.292 63.292 63.664 -0.372 25342 962 1 2 . 1 1 24 24 ILE CB C 24 34.738 34.738 38.235 -3.497 25342 963 1 2 . 1 1 24 24 ILE H H 24 8.535 8.535 7.303 1.232 25342 964 1 2 . 1 1 25 25 ASN N N 25 118.640 118.640 119.718 -1.078 25342 965 1 2 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.405 -0.178 25342 966 1 2 . 1 1 25 25 ASN C C 25 173.530 173.530 177.860 -4.330 25342 967 1 2 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.567 -4.356 25342 968 1 2 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.637 -0.533 25342 969 1 2 . 1 1 25 25 ASN H H 25 8.317 8.317 8.544 -0.227 25342 970 1 2 . 1 1 26 26 SER N N 26 111.990 111.990 114.729 -2.739 25342 971 1 2 . 1 1 26 26 SER HA H 26 4.153 4.153 4.299 -0.146 25342 972 1 2 . 1 1 26 26 SER C C 26 172.110 172.110 175.207 -3.097 25342 973 1 2 . 1 1 26 26 SER CA C 26 57.905 57.905 60.796 -2.891 25342 974 1 2 . 1 1 26 26 SER CB C 26 60.655 60.655 63.012 -2.357 25342 975 1 2 . 1 1 26 26 SER H H 26 7.369 7.369 8.283 -0.914 25342 976 1 2 . 1 1 27 27 GLU N N 27 120.201 120.201 118.133 2.068 25342 977 1 2 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.437 -0.336 25342 978 1 2 . 1 1 27 27 GLU C C 27 173.673 173.673 175.911 -2.238 25342 979 1 2 . 1 1 27 27 GLU CA C 27 54.235 54.235 55.804 -1.569 25342 980 1 2 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.556 -3.955 25342 981 1 2 . 1 1 27 27 GLU H H 27 7.451 7.451 7.790 -0.339 25342 982 1 2 . 1 1 28 28 ILE N N 28 118.762 118.762 120.898 -2.136 25342 983 1 2 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.356 -0.157 25342 984 1 2 . 1 1 28 28 ILE C C 28 172.487 172.487 175.014 -2.527 25342 985 1 2 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.351 -2.619 25342 986 1 2 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.979 -5.241 25342 987 1 2 . 1 1 28 28 ILE H H 28 7.255 7.255 7.339 -0.084 25342 988 1 2 . 1 1 29 29 LYS N N 29 130.563 130.563 128.441 2.122 25342 989 1 2 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.183 -0.181 25342 990 1 2 . 1 1 29 29 LYS C C 29 174.386 174.386 176.015 -1.629 25342 991 1 2 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.270 -1.735 25342 992 1 2 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.181 -3.595 25342 993 1 2 . 1 1 29 29 LYS H H 29 8.564 8.564 8.954 -0.390 25342 994 1 2 . 1 1 30 30 ASP N N 30 119.357 119.357 120.164 -0.807 25342 995 1 2 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.346 0.056 25342 996 1 2 . 1 1 30 30 ASP C C 30 172.570 172.570 175.313 -2.743 25342 997 1 2 . 1 1 30 30 ASP CA C 30 53.436 53.436 55.553 -2.118 25342 998 1 2 . 1 1 30 30 ASP CB C 30 36.744 36.744 40.304 -3.560 25342 999 1 2 . 1 1 30 30 ASP H H 30 8.920 8.920 8.672 0.248 25342 1000 1 2 . 1 1 31 31 SER N N 31 114.019 114.019 112.761 1.258 25342 1001 1 2 . 1 1 31 31 SER HA H 31 4.782 4.782 4.745 0.037 25342 1002 1 2 . 1 1 31 31 SER C C 31 171.150 171.150 173.716 -2.566 25342 1003 1 2 . 1 1 31 31 SER CA C 31 55.551 55.551 58.171 -2.620 25342 1004 1 2 . 1 1 31 31 SER CB C 31 62.259 62.259 65.339 -3.080 25342 1005 1 2 . 1 1 31 31 SER H H 31 8.006 8.006 7.408 0.598 25342 1006 1 2 . 1 1 32 32 GLU N N 32 121.455 121.455 119.554 1.901 25342 1007 1 2 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.488 0.252 25342 1008 1 2 . 1 1 32 32 GLU C C 32 171.185 171.185 174.430 -3.245 25342 1009 1 2 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.338 -3.257 25342 1010 1 2 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.643 -1.816 25342 1011 1 2 . 1 1 32 32 GLU H H 32 8.145 8.145 8.417 -0.272 25342 1012 1 2 . 1 1 33 33 LEU N N 33 126.176 126.176 122.895 3.281 25342 1013 1 2 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.974 0.332 25342 1014 1 2 . 1 1 33 33 LEU C C 33 173.365 173.365 176.282 -2.917 25342 1015 1 2 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.043 -2.603 25342 1016 1 2 . 1 1 33 33 LEU CB C 33 43.635 43.635 44.139 -0.504 25342 1017 1 2 . 1 1 33 33 LEU H H 33 8.589 8.589 8.532 0.057 25342 1018 1 2 . 1 1 34 34 LYS N N 34 127.200 127.200 123.058 4.142 25342 1019 1 2 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.838 -0.242 25342 1020 1 2 . 1 1 34 34 LYS C C 34 169.622 169.622 174.537 -4.915 25342 1021 1 2 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.841 -2.512 25342 1022 1 2 . 1 1 34 34 LYS CB C 34 34.200 34.200 37.034 -2.834 25342 1023 1 2 . 1 1 34 34 LYS H H 34 9.380 9.380 9.098 0.282 25342 1024 1 2 . 1 1 35 35 GLU N N 35 122.324 122.324 119.953 2.371 25342 1025 1 2 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.576 -2.243 25342 1026 1 2 . 1 1 35 35 GLU C C 35 172.734 172.734 175.566 -2.832 25342 1027 1 2 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.499 -1.887 25342 1028 1 2 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.704 -3.385 25342 1029 1 2 . 1 1 35 35 GLU H H 35 8.094 8.094 8.447 -0.353 25342 1030 1 2 . 1 1 36 36 VAL N N 36 126.781 126.781 121.373 5.408 25342 1031 1 2 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.315 -0.476 25342 1032 1 2 . 1 1 36 36 VAL C C 36 171.482 171.482 174.592 -3.110 25342 1033 1 2 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.616 -1.211 25342 1034 1 2 . 1 1 36 36 VAL CB C 36 29.348 29.348 34.679 -5.331 25342 1035 1 2 . 1 1 36 36 VAL H H 36 8.660 8.660 8.549 0.111 25342 1036 1 2 . 1 1 37 37 LYS N N 37 126.065 126.065 122.561 3.504 25342 1037 1 2 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.323 0.642 25342 1038 1 2 . 1 1 37 37 LYS C C 37 173.187 173.187 174.800 -1.613 25342 1039 1 2 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.498 -2.218 25342 1040 1 2 . 1 1 37 37 LYS CB C 37 32.921 32.921 34.491 -1.570 25342 1041 1 2 . 1 1 37 37 LYS H H 37 7.809 7.809 8.119 -0.310 25342 1042 1 2 . 1 1 38 38 VAL N N 38 111.020 111.020 114.735 -3.715 25342 1043 1 2 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.934 -0.110 25342 1044 1 2 . 1 1 38 38 VAL C C 38 173.604 173.604 175.939 -2.335 25342 1045 1 2 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.320 -2.937 25342 1046 1 2 . 1 1 38 38 VAL CB C 38 32.376 32.376 33.808 -1.432 25342 1047 1 2 . 1 1 38 38 VAL H H 38 8.305 8.305 7.961 0.344 25342 1048 1 2 . 1 1 39 39 SER N N 39 117.887 117.887 114.577 3.310 25342 1049 1 2 . 1 1 39 39 SER HA H 39 4.183 4.183 4.363 -0.180 25342 1050 1 2 . 1 1 39 39 SER C C 39 173.538 173.538 173.881 -0.343 25342 1051 1 2 . 1 1 39 39 SER CA C 39 56.279 56.279 58.668 -2.389 25342 1052 1 2 . 1 1 39 39 SER CB C 39 60.537 60.537 63.814 -3.277 25342 1053 1 2 . 1 1 39 39 SER H H 39 8.847 8.847 8.429 0.418 25342 1054 1 2 . 1 1 40 40 GLU N N 40 126.316 126.316 120.826 5.490 25342 1055 1 2 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.310 -0.156 25342 1056 1 2 . 1 1 40 40 GLU C C 40 174.586 174.586 178.041 -3.455 25342 1057 1 2 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.460 -0.648 25342 1058 1 2 . 1 1 40 40 GLU CB C 40 26.720 26.720 30.348 -3.627 25342 1059 1 2 . 1 1 40 40 GLU H H 40 9.049 9.049 8.458 0.591 25342 1060 1 2 . 1 1 41 41 GLY N N 41 112.494 112.494 111.908 0.586 25342 1061 1 2 . 1 1 41 41 GLY C C 41 171.994 171.994 175.320 -3.326 25342 1062 1 2 . 1 1 41 41 GLY CA C 41 42.462 42.462 46.213 -3.751 25342 1063 1 2 . 1 1 41 41 GLY H H 41 8.780 8.780 8.908 -0.128 25342 1064 1 2 . 1 1 42 42 THR N N 42 118.631 118.631 115.239 3.392 25342 1065 1 2 . 1 1 42 42 THR HA H 42 3.582 3.582 3.938 -0.356 25342 1066 1 2 . 1 1 42 42 THR C C 42 171.225 171.225 173.812 -2.587 25342 1067 1 2 . 1 1 42 42 THR CA C 42 64.104 64.104 64.088 0.016 25342 1068 1 2 . 1 1 42 42 THR CB C 42 65.914 65.914 68.933 -3.019 25342 1069 1 2 . 1 1 42 42 THR H H 42 7.737 7.737 7.947 -0.210 25342 1070 1 2 . 1 1 43 43 PHE N N 43 116.279 116.279 113.724 2.555 25342 1071 1 2 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.744 0.276 25342 1072 1 2 . 1 1 43 43 PHE C C 43 170.141 170.141 173.185 -3.044 25342 1073 1 2 . 1 1 43 43 PHE CA C 43 52.472 52.472 55.237 -2.765 25342 1074 1 2 . 1 1 43 43 PHE CB C 43 37.385 37.385 39.626 -2.241 25342 1075 1 2 . 1 1 43 43 PHE H H 43 8.114 8.114 7.257 0.857 25342 1076 1 2 . 1 1 44 44 ASP N N 44 121.513 121.513 119.556 1.957 25342 1077 1 2 . 1 1 44 44 ASP HA H 44 4.851 4.851 5.041 -0.190 25342 1078 1 2 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.378 -2.166 25342 1079 1 2 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.422 -0.037 25342 1080 1 2 . 1 1 44 44 ASP H H 44 7.774 7.774 8.644 -0.870 25342 1081 1 2 . 1 1 45 45 ALA N N 45 125.663 125.663 123.117 2.546 25342 1082 1 2 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.438 -0.227 25342 1083 1 2 . 1 1 45 45 ALA C C 45 175.139 175.139 176.946 -1.807 25342 1084 1 2 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.332 -0.896 25342 1085 1 2 . 1 1 45 45 ALA CB C 45 16.232 16.232 18.469 -2.237 25342 1086 1 2 . 1 1 45 45 ALA H H 45 8.324 8.324 8.330 -0.006 25342 1087 1 2 . 1 1 46 46 ASP N N 46 119.288 119.288 118.764 0.524 25342 1088 1 2 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.507 0.318 25342 1089 1 2 . 1 1 46 46 ASP C C 46 175.013 175.013 176.992 -1.979 25342 1090 1 2 . 1 1 46 46 ASP CA C 46 51.161 51.161 54.257 -3.096 25342 1091 1 2 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.362 -1.129 25342 1092 1 2 . 1 1 46 46 ASP H H 46 9.618 9.618 8.061 1.557 25342 1093 1 2 . 1 1 47 47 MET N N 47 127.347 127.347 114.817 12.530 25342 1094 1 2 . 1 1 47 47 MET HA H 47 3.456 3.456 4.877 -1.421 25342 1095 1 2 . 1 1 47 47 MET C C 47 173.605 173.605 175.227 -1.622 25342 1096 1 2 . 1 1 47 47 MET CA C 47 56.699 56.699 55.922 0.777 25342 1097 1 2 . 1 1 47 47 MET CB C 47 29.930 29.930 35.031 -5.101 25342 1098 1 2 . 1 1 47 47 MET H H 47 9.178 9.178 8.158 1.020 25342 1099 1 2 . 1 1 48 48 TYR N N 48 121.040 121.040 115.811 5.229 25342 1100 1 2 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.884 -1.012 25342 1101 1 2 . 1 1 48 48 TYR CA C 48 58.712 58.712 57.979 0.733 25342 1102 1 2 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.809 -5.171 25342 1103 1 2 . 1 1 48 48 TYR H H 48 7.881 7.881 8.398 -0.517 25342 1104 1 2 . 1 1 49 49 LYS N N 49 121.754 121.754 121.034 0.720 25342 1105 1 2 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.100 0.005 25342 1106 1 2 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.489 -3.104 25342 1107 1 2 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.251 -3.087 25342 1108 1 2 . 1 1 49 49 LYS H H 49 8.365 8.365 8.248 0.117 25342 1109 1 2 . 1 1 50 50 THR N N 50 117.557 117.557 109.783 7.774 25342 1110 1 2 . 1 1 50 50 THR HA H 50 3.586 3.586 4.050 -0.464 25342 1111 1 2 . 1 1 50 50 THR CA C 50 65.634 65.634 65.940 -0.306 25342 1112 1 2 . 1 1 50 50 THR CB C 50 65.904 65.904 68.143 -2.239 25342 1113 1 2 . 1 1 50 50 THR H H 50 8.007 8.007 8.530 -0.523 25342 1114 1 2 . 1 1 51 51 SER N N 51 115.110 115.110 117.757 -2.647 25342 1115 1 2 . 1 1 51 51 SER HA H 51 3.974 3.974 4.177 -0.203 25342 1116 1 2 . 1 1 51 51 SER CA C 51 59.042 59.042 61.083 -2.041 25342 1117 1 2 . 1 1 51 51 SER CB C 51 59.835 59.835 62.871 -3.036 25342 1118 1 2 . 1 1 51 51 SER H H 51 7.606 7.606 8.667 -1.061 25342 1119 1 2 . 1 1 52 52 ASP N N 52 119.713 119.713 122.099 -2.386 25342 1120 1 2 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.557 -0.249 25342 1121 1 2 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.255 -2.728 25342 1122 1 2 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.043 -3.355 25342 1123 1 2 . 1 1 52 52 ASP H H 52 7.552 7.552 7.755 -0.203 25342 1124 1 2 . 1 1 53 53 ILE N N 53 121.982 121.982 120.747 1.235 25342 1125 1 2 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.539 0.183 25342 1126 1 2 . 1 1 53 53 ILE C C 53 175.325 175.325 178.088 -2.763 25342 1127 1 2 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.427 -2.883 25342 1128 1 2 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.847 -1.149 25342 1129 1 2 . 1 1 53 53 ILE H H 53 7.815 7.815 7.355 0.460 25342 1130 1 2 . 1 1 54 54 ALA N N 54 121.552 121.552 121.581 -0.029 25342 1131 1 2 . 1 1 54 54 ALA HA H 54 4.317 4.317 3.982 0.335 25342 1132 1 2 . 1 1 54 54 ALA C C 54 177.475 177.475 179.946 -2.471 25342 1133 1 2 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.866 -2.844 25342 1134 1 2 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.536 -2.552 25342 1135 1 2 . 1 1 54 54 ALA H H 54 8.332 8.332 8.159 0.173 25342 1136 1 2 . 1 1 55 55 LEU N N 55 117.176 117.176 120.169 -2.993 25342 1137 1 2 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.015 -0.081 25342 1138 1 2 . 1 1 55 55 LEU C C 55 176.532 176.532 178.318 -1.786 25342 1139 1 2 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.927 -2.596 25342 1140 1 2 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.849 -3.421 25342 1141 1 2 . 1 1 55 55 LEU H H 55 8.195 8.195 7.708 0.487 25342 1142 1 2 . 1 1 56 56 ASP N N 56 120.056 120.056 118.858 1.198 25342 1143 1 2 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.310 0.157 25342 1144 1 2 . 1 1 56 56 ASP C C 56 176.585 176.585 178.347 -1.762 25342 1145 1 2 . 1 1 56 56 ASP CA C 56 54.550 54.550 58.288 -3.738 25342 1146 1 2 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.823 -2.518 25342 1147 1 2 . 1 1 56 56 ASP H H 56 7.806 7.806 8.558 -0.752 25342 1148 1 2 . 1 1 57 57 GLN N N 57 120.020 120.020 115.363 4.657 25342 1149 1 2 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.446 -0.323 25342 1150 1 2 . 1 1 57 57 GLN C C 57 175.689 175.689 176.198 -0.509 25342 1151 1 2 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.057 -1.652 25342 1152 1 2 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.668 -4.899 25342 1153 1 2 . 1 1 57 57 GLN H H 57 7.661 7.661 7.643 0.018 25342 1154 1 2 . 1 1 58 58 ILE N N 58 120.644 120.644 118.536 2.108 25342 1155 1 2 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.365 -0.789 25342 1156 1 2 . 1 1 58 58 ILE C C 58 176.237 176.237 177.097 -0.860 25342 1157 1 2 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.029 0.477 25342 1158 1 2 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.624 -3.595 25342 1159 1 2 . 1 1 58 58 ILE H H 58 8.228 8.228 7.505 0.723 25342 1160 1 2 . 1 1 59 59 GLN N N 59 115.498 115.498 118.823 -3.325 25342 1161 1 2 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.290 -0.148 25342 1162 1 2 . 1 1 59 59 GLN C C 59 173.781 173.781 177.081 -3.300 25342 1163 1 2 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.922 -2.940 25342 1164 1 2 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.422 -2.811 25342 1165 1 2 . 1 1 59 59 GLN H H 59 8.331 8.331 8.382 -0.051 25342 1166 1 2 . 1 1 60 60 GLY N N 60 106.623 106.623 106.507 0.116 25342 1167 1 2 . 1 1 60 60 GLY C C 60 172.068 172.068 175.269 -3.201 25342 1168 1 2 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.231 -2.358 25342 1169 1 2 . 1 1 60 60 GLY H H 60 7.611 7.611 8.312 -0.701 25342 1170 1 2 . 1 1 61 61 ASN N N 61 117.691 117.691 118.954 -1.263 25342 1171 1 2 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.639 -0.095 25342 1172 1 2 . 1 1 61 61 ASN C C 61 171.946 171.946 175.876 -3.930 25342 1173 1 2 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.507 -2.938 25342 1174 1 2 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.980 -2.620 25342 1175 1 2 . 1 1 61 61 ASN H H 61 8.151 8.151 8.298 -0.147 25342 1176 1 2 . 1 1 62 62 LYS N N 62 118.289 118.289 118.257 0.032 25342 1177 1 2 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.554 -0.226 25342 1178 1 2 . 1 1 62 62 LYS C C 62 171.773 171.773 175.457 -3.684 25342 1179 1 2 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.716 -3.420 25342 1180 1 2 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.276 -0.593 25342 1181 1 2 . 1 1 62 62 LYS H H 62 7.242 7.242 7.889 -0.647 25342 1182 1 2 . 1 1 63 63 ASP N N 63 119.888 119.888 119.746 0.142 25342 1183 1 2 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.621 -0.205 25342 1184 1 2 . 1 1 63 63 ASP C C 63 174.476 174.476 175.411 -0.935 25342 1185 1 2 . 1 1 63 63 ASP CA C 63 51.461 51.461 51.947 -0.486 25342 1186 1 2 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.822 -3.307 25342 1187 1 2 . 1 1 63 63 ASP H H 63 8.230 8.230 8.062 0.168 25342 1188 1 2 . 1 1 64 64 PHE N N 64 119.789 119.789 116.295 3.494 25342 1189 1 2 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.426 -0.610 25342 1190 1 2 . 1 1 64 64 PHE CA C 64 56.250 56.250 55.131 1.119 25342 1191 1 2 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.050 -3.016 25342 1192 1 2 . 1 1 64 64 PHE H H 64 8.428 8.428 7.774 0.654 25342 1193 1 2 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.451 -0.138 25342 1194 1 2 . 1 1 65 65 PRO C C 65 173.975 173.975 176.342 -2.367 25342 1195 1 2 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.654 -2.598 25342 1196 1 2 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.503 -2.983 25342 1197 1 2 . 1 1 66 66 GLU N N 66 121.326 121.326 121.777 -0.451 25342 1198 1 2 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.456 -0.223 25342 1199 1 2 . 1 1 66 66 GLU C C 66 173.978 173.978 175.435 -1.457 25342 1200 1 2 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.459 -2.928 25342 1201 1 2 . 1 1 66 66 GLU CB C 66 27.700 27.700 30.774 -3.074 25342 1202 1 2 . 1 1 66 66 GLU H H 66 8.225 8.225 8.689 -0.464 25342 1203 1 2 . 1 1 67 67 ILE N N 67 113.897 113.897 116.590 -2.693 25342 1204 1 2 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.778 0.391 25342 1205 1 2 . 1 1 67 67 ILE C C 67 172.791 172.791 175.350 -2.559 25342 1206 1 2 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.977 -2.702 25342 1207 1 2 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.436 -2.420 25342 1208 1 2 . 1 1 67 67 ILE H H 67 8.366 8.366 8.195 0.171 25342 1209 1 2 . 1 1 68 68 GLN N N 68 121.654 121.654 122.399 -0.745 25342 1210 1 2 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.457 0.062 25342 1211 1 2 . 1 1 68 68 GLN C C 68 171.562 171.562 175.813 -4.251 25342 1212 1 2 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.149 -1.836 25342 1213 1 2 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.355 -1.570 25342 1214 1 2 . 1 1 68 68 GLN H H 68 8.763 8.763 8.572 0.191 25342 1215 1 2 . 1 1 69 69 LEU N N 69 125.289 125.289 119.935 5.354 25342 1216 1 2 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.320 0.199 25342 1217 1 2 . 1 1 69 69 LEU C C 69 172.567 172.567 176.760 -4.193 25342 1218 1 2 . 1 1 69 69 LEU CA C 69 51.797 51.797 55.238 -3.441 25342 1219 1 2 . 1 1 69 69 LEU CB C 69 42.742 42.742 42.696 0.046 25342 1220 1 2 . 1 1 69 69 LEU H H 69 7.996 7.996 7.418 0.578 25342 1221 1 2 . 1 1 70 70 ASP N N 70 123.170 123.170 122.752 0.418 25342 1222 1 2 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.659 -0.253 25342 1223 1 2 . 1 1 70 70 ASP C C 70 171.978 171.978 175.176 -3.198 25342 1224 1 2 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.917 -2.235 25342 1225 1 2 . 1 1 70 70 ASP CB C 70 38.729 38.729 42.086 -3.357 25342 1226 1 2 . 1 1 70 70 ASP H H 70 8.278 8.278 8.399 -0.121 25342 1227 1 2 . 1 1 71 71 ASN N N 71 117.524 117.524 118.090 -0.566 25342 1228 1 2 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.628 -0.301 25342 1229 1 2 . 1 1 71 71 ASN C C 71 171.825 171.825 174.617 -2.792 25342 1230 1 2 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.669 -2.012 25342 1231 1 2 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.915 -3.685 25342 1232 1 2 . 1 1 71 71 ASN H H 71 8.372 8.372 8.487 -0.115 25342 1233 1 2 . 1 1 72 72 ILE N N 72 124.515 124.515 124.341 0.174 25342 1234 1 2 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.045 -0.116 25342 1235 1 2 . 1 1 72 72 ILE C C 72 171.607 171.607 173.913 -2.306 25342 1236 1 2 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.795 -2.506 25342 1237 1 2 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.352 -2.592 25342 1238 1 2 . 1 1 72 72 ILE H H 72 7.653 7.653 8.173 -0.520 25342 1239 1 2 . 1 1 73 73 ASP N N 73 125.182 125.182 126.904 -1.722 25342 1240 1 2 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.342 0.286 25342 1241 1 2 . 1 1 73 73 ASP C C 73 173.980 173.980 176.323 -2.343 25342 1242 1 2 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.969 -5.755 25342 1243 1 2 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.892 -3.990 25342 1244 1 2 . 1 1 73 73 ASP H H 73 8.382 8.382 8.423 -0.041 25342 1245 1 2 . 1 1 74 74 TYR N N 74 123.092 123.092 123.845 -0.753 25342 1246 1 2 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.593 -0.729 25342 1247 1 2 . 1 1 74 74 TYR C C 74 173.582 173.582 176.696 -3.114 25342 1248 1 2 . 1 1 74 74 TYR CA C 74 59.486 59.486 58.267 1.219 25342 1249 1 2 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.136 -3.328 25342 1250 1 2 . 1 1 74 74 TYR H H 74 7.348 7.348 8.117 -0.769 25342 1251 1 2 . 1 1 75 75 ASN N N 75 109.447 109.447 117.346 -7.899 25342 1252 1 2 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.912 0.013 25342 1253 1 2 . 1 1 75 75 ASN C C 75 172.570 172.570 175.278 -2.708 25342 1254 1 2 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.773 -2.155 25342 1255 1 2 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.297 -2.763 25342 1256 1 2 . 1 1 75 75 ASN H H 75 8.040 8.040 8.679 -0.639 25342 1257 1 2 . 1 1 76 76 ASN N N 76 117.411 117.411 115.832 1.579 25342 1258 1 2 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.680 -0.226 25342 1259 1 2 . 1 1 76 76 ASN C C 76 171.155 171.155 174.924 -3.769 25342 1260 1 2 . 1 1 76 76 ASN CA C 76 50.934 50.934 52.981 -2.047 25342 1261 1 2 . 1 1 76 76 ASN CB C 76 35.658 35.658 39.166 -3.508 25342 1262 1 2 . 1 1 76 76 ASN H H 76 7.750 7.750 7.707 0.043 25342 1263 1 2 . 1 1 77 77 TYR N N 77 116.878 116.878 119.500 -2.622 25342 1264 1 2 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.501 -0.147 25342 1265 1 2 . 1 1 77 77 TYR C C 77 172.224 172.224 176.075 -3.851 25342 1266 1 2 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.568 -3.328 25342 1267 1 2 . 1 1 77 77 TYR CB C 77 37.113 37.113 38.653 -1.540 25342 1268 1 2 . 1 1 77 77 TYR H H 77 7.789 7.789 7.678 0.111 25342 1269 1 2 . 1 1 78 78 ASP N N 78 121.352 121.352 122.435 -1.083 25342 1270 1 2 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.798 -0.001 25342 1271 1 2 . 1 1 78 78 ASP C C 78 172.623 172.623 175.235 -2.612 25342 1272 1 2 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.230 -3.040 25342 1273 1 2 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.138 -2.103 25342 1274 1 2 . 1 1 78 78 ASP H H 78 9.036 9.036 8.867 0.169 25342 1275 1 2 . 1 1 79 79 LEU N N 79 123.073 123.073 118.298 4.775 25342 1276 1 2 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.263 -0.155 25342 1277 1 2 . 1 1 79 79 LEU C C 79 170.730 170.730 174.262 -3.532 25342 1278 1 2 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.326 -3.069 25342 1279 1 2 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.290 -4.006 25342 1280 1 2 . 1 1 79 79 LEU H H 79 7.877 7.877 7.787 0.090 25342 1281 1 2 . 1 1 80 80 ILE N N 80 126.348 126.348 124.457 1.891 25342 1282 1 2 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.838 0.231 25342 1283 1 2 . 1 1 80 80 ILE C C 80 171.584 171.584 174.284 -2.700 25342 1284 1 2 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.056 -2.641 25342 1285 1 2 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.339 -2.341 25342 1286 1 2 . 1 1 80 80 ILE H H 80 8.704 8.704 8.834 -0.130 25342 1287 1 2 . 1 1 81 81 LEU N N 81 126.303 126.303 128.395 -2.092 25342 1288 1 2 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.658 0.465 25342 1289 1 2 . 1 1 81 81 LEU C C 81 172.779 172.779 175.360 -2.581 25342 1290 1 2 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.469 -4.960 25342 1291 1 2 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.925 -2.210 25342 1292 1 2 . 1 1 81 81 LEU H H 81 9.202 9.202 8.766 0.436 25342 1293 1 2 . 1 1 82 82 ILE N N 82 120.931 120.931 121.603 -0.672 25342 1294 1 2 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.106 -0.259 25342 1295 1 2 . 1 1 82 82 ILE C C 82 172.796 172.796 174.588 -1.792 25342 1296 1 2 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.366 -2.485 25342 1297 1 2 . 1 1 82 82 ILE CB C 82 37.797 37.797 41.971 -4.174 25342 1298 1 2 . 1 1 82 82 ILE H H 82 8.846 8.846 8.629 0.217 25342 1299 1 2 . 1 1 83 83 GLY N N 83 120.905 120.905 110.634 10.271 25342 1300 1 2 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.738 -2.181 25342 1301 1 2 . 1 1 83 83 GLY H H 83 9.558 9.558 7.918 1.640 25342 1302 1 2 . 1 1 84 84 SER N N 84 116.601 116.601 114.422 2.179 25342 1303 1 2 . 1 1 84 84 SER HA H 84 5.476 5.476 5.233 0.243 25342 1304 1 2 . 1 1 84 84 SER CA C 84 51.324 51.324 55.586 -4.262 25342 1305 1 2 . 1 1 84 84 SER CB C 84 64.271 64.271 64.822 -0.551 25342 1306 1 2 . 1 1 84 84 SER H H 84 7.533 7.533 7.976 -0.444 25342 1307 1 2 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.492 0.671 25342 1308 1 2 . 1 1 85 85 PRO C C 85 175.590 175.590 176.469 -0.879 25342 1309 1 2 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.655 -3.772 25342 1310 1 2 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.560 -2.087 25342 1311 1 2 . 1 1 86 86 VAL N N 86 116.295 116.295 118.655 -2.360 25342 1312 1 2 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.265 -0.444 25342 1313 1 2 . 1 1 86 86 VAL C C 86 172.692 172.692 175.440 -2.748 25342 1314 1 2 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.642 -1.830 25342 1315 1 2 . 1 1 86 86 VAL CB C 86 30.083 30.083 33.291 -3.208 25342 1316 1 2 . 1 1 86 86 VAL H H 86 7.246 7.246 8.134 -0.888 25342 1317 1 2 . 1 1 87 87 TRP N N 87 131.042 131.042 125.545 5.497 25342 1318 1 2 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.818 -0.507 25342 1319 1 2 . 1 1 87 87 TRP C C 87 173.323 173.323 176.343 -3.020 25342 1320 1 2 . 1 1 87 87 TRP CA C 87 50.887 50.887 56.037 -5.150 25342 1321 1 2 . 1 1 87 87 TRP CB C 87 27.310 27.310 32.530 -5.220 25342 1322 1 2 . 1 1 87 87 TRP H H 87 9.555 9.555 8.333 1.222 25342 1323 1 2 . 1 1 88 88 SER N N 88 122.660 122.660 116.794 5.866 25342 1324 1 2 . 1 1 88 88 SER HA H 88 4.582 4.582 4.322 0.260 25342 1325 1 2 . 1 1 88 88 SER C C 88 172.096 172.096 175.752 -3.656 25342 1326 1 2 . 1 1 88 88 SER CA C 88 55.391 55.391 60.545 -5.154 25342 1327 1 2 . 1 1 88 88 SER CB C 88 57.813 57.813 62.098 -4.285 25342 1328 1 2 . 1 1 88 88 SER H H 88 10.257 10.257 9.124 1.133 25342 1329 1 2 . 1 1 89 89 GLY N N 89 128.381 128.381 112.265 16.116 25342 1330 1 2 . 1 1 89 89 GLY CA C 89 42.629 42.629 46.148 -3.519 25342 1331 1 2 . 1 1 89 89 GLY H H 89 6.372 6.372 8.640 -2.268 25342 1332 1 2 . 1 1 90 90 TYR N N 90 120.345 120.345 118.455 1.890 25342 1333 1 2 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.787 -0.598 25342 1334 1 2 . 1 1 90 90 TYR CA C 90 53.549 53.549 55.042 -1.493 25342 1335 1 2 . 1 1 90 90 TYR CB C 90 37.195 37.195 40.548 -3.353 25342 1336 1 2 . 1 1 90 90 TYR H H 90 8.113 8.113 7.454 0.659 25342 1337 1 2 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.630 0.204 25342 1338 1 2 . 1 1 91 91 PRO C C 91 170.911 170.911 177.110 -6.199 25342 1339 1 2 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.281 -3.446 25342 1340 1 2 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.561 -6.491 25342 1341 1 2 . 1 1 92 92 ALA N N 92 120.629 120.629 123.728 -3.099 25342 1342 1 2 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.966 -0.347 25342 1343 1 2 . 1 1 92 92 ALA C C 92 176.782 176.782 176.532 0.250 25342 1344 1 2 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.516 -2.099 25342 1345 1 2 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.845 -1.329 25342 1346 1 2 . 1 1 92 92 ALA H H 92 7.554 7.554 8.790 -1.236 25342 1347 1 2 . 1 1 93 93 THR N N 93 112.558 112.558 109.565 2.993 25342 1348 1 2 . 1 1 93 93 THR CB C 93 64.173 64.173 67.311 -3.138 25342 1349 1 2 . 1 1 93 93 THR H H 93 6.730 6.730 7.847 -1.117 25342 1350 1 2 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.527 -0.668 25342 1351 1 2 . 1 1 94 94 PRO C C 94 173.309 173.309 176.195 -2.886 25342 1352 1 2 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.078 -1.015 25342 1353 1 2 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.078 -2.800 25342 1354 1 2 . 1 1 95 95 ILE N N 95 111.014 111.014 117.074 -6.060 25342 1355 1 2 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.423 -0.818 25342 1356 1 2 . 1 1 95 95 ILE C C 95 174.302 174.302 177.518 -3.216 25342 1357 1 2 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.815 -2.634 25342 1358 1 2 . 1 1 95 95 ILE CB C 95 31.783 31.783 37.532 -5.748 25342 1359 1 2 . 1 1 95 95 ILE H H 95 7.995 7.995 7.879 0.116 25342 1360 1 2 . 1 1 96 96 LYS N N 96 123.208 123.208 122.503 0.705 25342 1361 1 2 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.210 -1.118 25342 1362 1 2 . 1 1 96 96 LYS C C 96 174.451 174.451 178.269 -3.818 25342 1363 1 2 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.252 -2.211 25342 1364 1 2 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.734 -2.987 25342 1365 1 2 . 1 1 96 96 LYS H H 96 6.928 6.928 7.652 -0.724 25342 1366 1 2 . 1 1 97 97 THR N N 97 113.320 113.320 112.350 0.970 25342 1367 1 2 . 1 1 97 97 THR HA H 97 3.436 3.436 3.700 -0.264 25342 1368 1 2 . 1 1 97 97 THR C C 97 173.221 173.221 175.338 -2.117 25342 1369 1 2 . 1 1 97 97 THR CA C 97 62.710 62.710 64.312 -1.602 25342 1370 1 2 . 1 1 97 97 THR CB C 97 65.562 65.562 68.447 -2.885 25342 1371 1 2 . 1 1 97 97 THR H H 97 6.325 6.325 8.051 -1.726 25342 1372 1 2 . 1 1 98 98 LEU N N 98 120.963 120.963 121.087 -0.124 25342 1373 1 2 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.341 -0.716 25342 1374 1 2 . 1 1 98 98 LEU C C 98 174.713 174.713 177.407 -2.694 25342 1375 1 2 . 1 1 98 98 LEU CA C 98 55.514 55.514 56.413 -0.898 25342 1376 1 2 . 1 1 98 98 LEU CB C 98 39.728 39.728 42.851 -3.123 25342 1377 1 2 . 1 1 98 98 LEU H H 98 7.536 7.536 7.420 0.116 25342 1378 1 2 . 1 1 99 99 LEU N N 99 118.859 118.859 118.695 0.164 25342 1379 1 2 . 1 1 99 99 LEU HA H 99 3.672 3.672 4.013 -0.341 25342 1380 1 2 . 1 1 99 99 LEU C C 99 177.458 177.458 178.468 -1.010 25342 1381 1 2 . 1 1 99 99 LEU CA C 99 55.145 55.145 57.678 -2.533 25342 1382 1 2 . 1 1 99 99 LEU CB C 99 38.857 38.857 40.583 -1.726 25342 1383 1 2 . 1 1 99 99 LEU H H 99 8.179 8.179 8.371 -0.192 25342 1384 1 2 . 1 1 100 100 ASP N N 100 118.703 118.703 118.111 0.592 25342 1385 1 2 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.470 -0.249 25342 1386 1 2 . 1 1 100 100 ASP C C 100 176.472 176.472 177.846 -1.374 25342 1387 1 2 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.623 -2.316 25342 1388 1 2 . 1 1 100 100 ASP CB C 100 37.358 37.358 41.734 -4.376 25342 1389 1 2 . 1 1 100 100 ASP H H 100 7.867 7.867 7.619 0.248 25342 1390 1 2 . 1 1 101 101 GLN N N 101 117.829 117.829 118.575 -0.746 25342 1391 1 2 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.109 0.091 25342 1392 1 2 . 1 1 101 101 GLN C C 101 174.508 174.508 178.616 -4.108 25342 1393 1 2 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.346 -3.658 25342 1394 1 2 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.117 -3.520 25342 1395 1 2 . 1 1 101 101 GLN H H 101 7.597 7.597 7.841 -0.244 25342 1396 1 2 . 1 1 102 102 MET N N 102 118.406 118.406 116.553 1.853 25342 1397 1 2 . 1 1 102 102 MET HA H 102 3.864 3.864 4.400 -0.536 25342 1398 1 2 . 1 1 102 102 MET C C 102 172.820 172.820 177.272 -4.452 25342 1399 1 2 . 1 1 102 102 MET CA C 102 53.298 53.298 57.057 -3.759 25342 1400 1 2 . 1 1 102 102 MET CB C 102 31.207 31.207 31.660 -0.453 25342 1401 1 2 . 1 1 102 102 MET H H 102 7.434 7.434 7.765 -0.331 25342 1402 1 2 . 1 1 103 103 LYS N N 103 115.889 115.889 119.498 -3.609 25342 1403 1 2 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.106 -0.187 25342 1404 1 2 . 1 1 103 103 LYS C C 103 173.938 173.938 177.674 -3.736 25342 1405 1 2 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.746 -2.309 25342 1406 1 2 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.817 -2.554 25342 1407 1 2 . 1 1 103 103 LYS H H 103 6.881 6.881 8.078 -1.197 25342 1408 1 2 . 1 1 104 104 ASN N N 104 114.951 114.951 114.733 0.218 25342 1409 1 2 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.787 -0.056 25342 1410 1 2 . 1 1 104 104 ASN C C 104 172.617 172.617 174.997 -2.380 25342 1411 1 2 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.559 -3.293 25342 1412 1 2 . 1 1 104 104 ASN CB C 104 35.783 35.783 39.197 -3.414 25342 1413 1 2 . 1 1 104 104 ASN H H 104 8.493 8.493 7.980 0.513 25342 1414 1 2 . 1 1 105 105 TYR N N 105 122.680 122.680 122.823 -0.143 25342 1415 1 2 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.566 -0.004 25342 1416 1 2 . 1 1 105 105 TYR CA C 105 55.433 55.433 58.053 -2.620 25342 1417 1 2 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.593 -3.761 25342 1418 1 2 . 1 1 105 105 TYR H H 105 8.217 8.217 7.735 0.482 25342 1419 1 2 . 1 1 106 106 ARG N N 106 128.872 128.872 127.151 1.721 25342 1420 1 2 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.460 -0.195 25342 1421 1 2 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.244 -1.262 25342 1422 1 2 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.411 -4.281 25342 1423 1 2 . 1 1 106 106 ARG H H 106 8.801 8.801 8.239 0.562 25342 1424 1 2 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.569 -2.167 25342 1425 1 2 . 1 1 108 108 GLU N N 108 117.000 117.000 121.226 -4.226 25342 1426 1 2 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.564 0.062 25342 1427 1 2 . 1 1 108 108 GLU C C 108 174.125 174.125 175.810 -1.685 25342 1428 1 2 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.332 -2.544 25342 1429 1 2 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.275 -0.835 25342 1430 1 2 . 1 1 108 108 GLU H H 108 7.514 7.514 8.256 -0.742 25342 1431 1 2 . 1 1 109 109 VAL N N 109 123.398 123.398 122.957 0.441 25342 1432 1 2 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.263 0.074 25342 1433 1 2 . 1 1 109 109 VAL C C 109 170.606 170.606 174.149 -3.543 25342 1434 1 2 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.729 -3.449 25342 1435 1 2 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.594 -2.937 25342 1436 1 2 . 1 1 109 109 VAL H H 109 8.942 8.942 8.580 0.362 25342 1437 1 2 . 1 1 110 110 ALA N N 110 127.905 127.905 128.341 -0.436 25342 1438 1 2 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.095 -0.468 25342 1439 1 2 . 1 1 110 110 ALA C C 110 173.195 173.195 175.356 -2.161 25342 1440 1 2 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.954 -2.608 25342 1441 1 2 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.564 -4.239 25342 1442 1 2 . 1 1 110 110 ALA H H 110 8.776 8.776 8.601 0.175 25342 1443 1 2 . 1 1 111 111 SER N N 111 110.523 110.523 115.104 -4.581 25342 1444 1 2 . 1 1 111 111 SER HA H 111 5.562 5.562 5.077 0.485 25342 1445 1 2 . 1 1 111 111 SER C C 111 170.719 170.719 173.789 -3.070 25342 1446 1 2 . 1 1 111 111 SER CA C 111 51.314 51.314 57.242 -5.928 25342 1447 1 2 . 1 1 111 111 SER CB C 111 61.907 61.907 62.921 -1.014 25342 1448 1 2 . 1 1 111 111 SER H H 111 7.480 7.480 8.152 -0.672 25342 1449 1 2 . 1 1 112 112 PHE N N 112 125.567 125.567 121.259 4.308 25342 1450 1 2 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.856 0.500 25342 1451 1 2 . 1 1 112 112 PHE C C 112 169.536 169.536 174.818 -5.282 25342 1452 1 2 . 1 1 112 112 PHE CA C 112 50.371 50.371 56.557 -6.186 25342 1453 1 2 . 1 1 112 112 PHE CB C 112 39.788 39.788 40.755 -0.967 25342 1454 1 2 . 1 1 112 112 PHE H H 112 7.848 7.848 8.316 -0.468 25342 1455 1 2 . 1 1 113 113 PHE N N 113 115.065 115.065 114.173 0.892 25342 1456 1 2 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.476 0.628 25342 1457 1 2 . 1 1 113 113 PHE C C 113 173.006 173.006 173.782 -0.776 25342 1458 1 2 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.328 -6.066 25342 1459 1 2 . 1 1 113 113 PHE CB C 113 38.749 38.749 41.096 -2.347 25342 1460 1 2 . 1 1 113 113 PHE H H 113 7.361 7.361 8.543 -1.182 25342 1461 1 2 . 1 1 114 114 THR N N 114 108.014 108.014 110.920 -2.906 25342 1462 1 2 . 1 1 114 114 THR HA H 114 4.999 4.999 4.880 0.119 25342 1463 1 2 . 1 1 114 114 THR C C 114 169.874 169.874 173.464 -3.590 25342 1464 1 2 . 1 1 114 114 THR CA C 114 56.500 56.500 60.640 -4.140 25342 1465 1 2 . 1 1 114 114 THR CB C 114 68.809 68.809 71.610 -2.801 25342 1466 1 2 . 1 1 114 114 THR H H 114 7.867 7.867 8.049 -0.182 25342 1467 1 2 . 1 1 115 115 SER N N 115 115.049 115.049 119.424 -4.375 25342 1468 1 2 . 1 1 115 115 SER HA H 115 5.613 5.613 4.777 0.836 25342 1469 1 2 . 1 1 115 115 SER C C 115 171.247 171.247 174.392 -3.145 25342 1470 1 2 . 1 1 115 115 SER CA C 115 54.830 54.830 56.949 -2.119 25342 1471 1 2 . 1 1 115 115 SER CB C 115 63.992 63.992 65.521 -1.529 25342 1472 1 2 . 1 1 115 115 SER H H 115 8.970 8.970 8.312 0.658 25342 1473 1 2 . 1 1 116 116 ALA N N 116 122.671 122.671 122.705 -0.034 25342 1474 1 2 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.598 0.387 25342 1475 1 2 . 1 1 116 116 ALA C C 116 176.180 176.180 177.948 -1.768 25342 1476 1 2 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.324 -3.124 25342 1477 1 2 . 1 1 116 116 ALA CB C 116 15.995 15.995 19.176 -3.181 25342 1478 1 2 . 1 1 116 116 ALA H H 116 8.963 8.963 8.871 0.092 25342 1479 1 2 . 1 1 117 117 GLY N N 117 107.387 107.387 107.649 -0.262 25342 1480 1 2 . 1 1 117 117 GLY C C 117 172.528 172.528 174.580 -2.052 25342 1481 1 2 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.198 -1.466 25342 1482 1 2 . 1 1 117 117 GLY H H 117 9.340 9.340 8.569 0.771 25342 1483 1 2 . 1 1 118 118 THR N N 118 113.481 113.481 112.168 1.313 25342 1484 1 2 . 1 1 118 118 THR HA H 118 4.651 4.651 4.494 0.157 25342 1485 1 2 . 1 1 118 118 THR C C 118 172.067 172.067 173.566 -1.499 25342 1486 1 2 . 1 1 118 118 THR CA C 118 57.357 57.357 59.864 -2.507 25342 1487 1 2 . 1 1 118 118 THR CB C 118 69.475 69.475 70.984 -1.509 25342 1488 1 2 . 1 1 118 118 THR H H 118 9.373 9.373 7.532 1.841 25342 1489 1 2 . 1 1 119 119 ASN N N 119 113.202 113.202 116.070 -2.868 25342 1490 1 2 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.140 0.478 25342 1491 1 2 . 1 1 119 119 ASN C C 119 173.114 173.114 175.566 -2.452 25342 1492 1 2 . 1 1 119 119 ASN CA C 119 51.684 51.684 53.771 -2.087 25342 1493 1 2 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.087 -3.357 25342 1494 1 2 . 1 1 119 119 ASN H H 119 8.908 8.908 8.649 0.259 25342 1495 1 2 . 1 1 120 120 HIS N N 120 117.315 117.315 118.870 -1.555 25342 1496 1 2 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.031 -0.245 25342 1497 1 2 . 1 1 120 120 HIS C C 120 174.381 174.381 176.582 -2.201 25342 1498 1 2 . 1 1 120 120 HIS CA C 120 54.516 54.516 59.245 -4.729 25342 1499 1 2 . 1 1 120 120 HIS CB C 120 26.504 26.504 30.133 -3.629 25342 1500 1 2 . 1 1 120 120 HIS H H 120 8.074 8.074 8.397 -0.323 25342 1501 1 2 . 1 1 121 121 LYS N N 121 118.678 118.678 118.094 0.584 25342 1502 1 2 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.864 -0.030 25342 1503 1 2 . 1 1 121 121 LYS C C 121 176.564 176.564 178.528 -1.964 25342 1504 1 2 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.017 -1.722 25342 1505 1 2 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.205 -3.263 25342 1506 1 2 . 1 1 121 121 LYS H H 121 8.336 8.336 8.464 -0.128 25342 1507 1 2 . 1 1 122 122 ALA N N 122 122.146 122.146 122.462 -0.316 25342 1508 1 2 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.156 -0.461 25342 1509 1 2 . 1 1 122 122 ALA C C 122 175.163 175.163 179.914 -4.751 25342 1510 1 2 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.939 -3.247 25342 1511 1 2 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.818 -2.100 25342 1512 1 2 . 1 1 122 122 ALA H H 122 7.584 7.584 7.347 0.237 25342 1513 1 2 . 1 1 123 123 TYR N N 123 119.730 119.730 117.257 2.473 25342 1514 1 2 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.314 -1.161 25342 1515 1 2 . 1 1 123 123 TYR C C 123 174.340 174.340 178.904 -4.564 25342 1516 1 2 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.129 0.269 25342 1517 1 2 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.323 -2.660 25342 1518 1 2 . 1 1 123 123 TYR H H 123 7.317 7.317 7.550 -0.233 25342 1519 1 2 . 1 1 124 124 VAL N N 124 118.649 118.649 117.855 0.794 25342 1520 1 2 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.690 -0.488 25342 1521 1 2 . 1 1 124 124 VAL C C 124 175.603 175.603 178.374 -2.771 25342 1522 1 2 . 1 1 124 124 VAL CA C 124 64.680 64.680 65.935 -1.255 25342 1523 1 2 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.710 -1.421 25342 1524 1 2 . 1 1 124 124 VAL H H 124 7.799 7.799 7.870 -0.071 25342 1525 1 2 . 1 1 125 125 SER N N 125 114.475 114.475 115.473 -0.998 25342 1526 1 2 . 1 1 125 125 SER HA H 125 4.032 4.032 4.199 -0.167 25342 1527 1 2 . 1 1 125 125 SER C C 125 174.849 174.849 176.650 -1.801 25342 1528 1 2 . 1 1 125 125 SER CA C 125 59.002 59.002 61.675 -2.673 25342 1529 1 2 . 1 1 125 125 SER CB C 125 59.613 59.613 63.270 -3.658 25342 1530 1 2 . 1 1 125 125 SER H H 125 7.766 7.766 8.358 -0.592 25342 1531 1 2 . 1 1 126 126 HIS N N 126 119.326 119.326 121.055 -1.729 25342 1532 1 2 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.416 -0.289 25342 1533 1 2 . 1 1 126 126 HIS C C 126 172.865 172.865 177.682 -4.817 25342 1534 1 2 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.527 -3.821 25342 1535 1 2 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.704 -4.711 25342 1536 1 2 . 1 1 126 126 HIS H H 126 8.569 8.569 8.405 0.164 25342 1537 1 2 . 1 1 127 127 PHE N N 127 121.044 121.044 121.343 -0.299 25342 1538 1 2 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.217 -1.043 25342 1539 1 2 . 1 1 127 127 PHE C C 127 173.378 173.378 177.633 -4.255 25342 1540 1 2 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.494 -0.627 25342 1541 1 2 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.129 -3.075 25342 1542 1 2 . 1 1 127 127 PHE H H 127 9.139 9.139 8.918 0.221 25342 1543 1 2 . 1 1 128 128 ASN N N 128 114.893 114.893 117.639 -2.746 25342 1544 1 2 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.190 -0.150 25342 1545 1 2 . 1 1 128 128 ASN C C 128 175.230 175.230 177.706 -2.476 25342 1546 1 2 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.648 -2.348 25342 1547 1 2 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.121 -1.950 25342 1548 1 2 . 1 1 128 128 ASN H H 128 7.774 7.774 7.776 -0.002 25342 1549 1 2 . 1 1 129 129 GLU N N 129 119.804 119.804 119.106 0.698 25342 1550 1 2 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.732 0.308 25342 1551 1 2 . 1 1 129 129 GLU C C 129 177.052 177.052 178.042 -0.990 25342 1552 1 2 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.984 -2.254 25342 1553 1 2 . 1 1 129 129 GLU CB C 129 27.196 27.196 28.819 -1.623 25342 1554 1 2 . 1 1 129 129 GLU H H 129 7.577 7.577 7.519 0.058 25342 1555 1 2 . 1 1 130 130 TRP N N 130 120.979 120.979 117.015 3.964 25342 1556 1 2 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.597 -0.140 25342 1557 1 2 . 1 1 130 130 TRP C C 130 174.329 174.329 174.625 -0.296 25342 1558 1 2 . 1 1 130 130 TRP CA C 130 54.688 54.688 55.819 -1.131 25342 1559 1 2 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.875 -2.884 25342 1560 1 2 . 1 1 130 130 TRP H H 130 8.225 8.225 7.134 1.091 25342 1561 1 2 . 1 1 131 131 ALA N N 131 120.450 120.450 118.942 1.508 25342 1562 1 2 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.411 -0.475 25342 1563 1 2 . 1 1 131 131 ALA C C 131 172.487 172.487 175.628 -3.141 25342 1564 1 2 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.874 -3.440 25342 1565 1 2 . 1 1 131 131 ALA CB C 131 16.288 16.288 18.677 -2.389 25342 1566 1 2 . 1 1 131 131 ALA H H 131 8.081 8.081 7.416 0.665 25342 1567 1 2 . 1 1 132 132 ASP N N 132 117.813 117.813 120.236 -2.423 25342 1568 1 2 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.725 -0.517 25342 1569 1 2 . 1 1 132 132 ASP C C 132 173.804 173.804 177.113 -3.309 25342 1570 1 2 . 1 1 132 132 ASP CA C 132 54.181 54.181 54.267 -0.086 25342 1571 1 2 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.243 -0.922 25342 1572 1 2 . 1 1 132 132 ASP H H 132 6.772 6.772 8.409 -1.637 25342 1573 1 2 . 1 1 133 133 GLY N N 133 115.052 115.052 107.397 7.655 25342 1574 1 2 . 1 1 133 133 GLY C C 133 172.078 172.078 174.037 -1.959 25342 1575 1 2 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.406 -2.986 25342 1576 1 2 . 1 1 133 133 GLY H H 133 8.626 8.626 8.008 0.618 25342 1577 1 2 . 1 1 134 134 LEU N N 134 120.063 120.063 119.637 0.426 25342 1578 1 2 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.670 -0.198 25342 1579 1 2 . 1 1 134 134 LEU C C 134 174.079 174.079 175.665 -1.586 25342 1580 1 2 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.580 -2.616 25342 1581 1 2 . 1 1 134 134 LEU CB C 134 40.370 40.370 44.200 -3.830 25342 1582 1 2 . 1 1 134 134 LEU H H 134 8.094 8.094 7.605 0.489 25342 1583 1 2 . 1 1 135 135 ASN N N 135 119.292 119.292 118.788 0.504 25342 1584 1 2 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.546 0.076 25342 1585 1 2 . 1 1 135 135 ASN C C 135 170.527 170.527 174.243 -3.716 25342 1586 1 2 . 1 1 135 135 ASN CA C 135 49.002 49.002 54.109 -5.107 25342 1587 1 2 . 1 1 135 135 ASN CB C 135 33.560 33.560 39.072 -5.512 25342 1588 1 2 . 1 1 135 135 ASN H H 135 8.513 8.513 8.520 -0.007 25342 1589 1 2 . 1 1 136 136 VAL N N 136 125.412 125.412 125.195 0.217 25342 1590 1 2 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.785 -0.179 25342 1591 1 2 . 1 1 136 136 VAL C C 136 175.420 175.420 175.941 -0.521 25342 1592 1 2 . 1 1 136 136 VAL CA C 136 58.382 58.382 61.709 -3.327 25342 1593 1 2 . 1 1 136 136 VAL CB C 136 29.247 29.247 34.603 -5.356 25342 1594 1 2 . 1 1 136 136 VAL H H 136 7.648 7.648 8.321 -0.673 25342 1595 1 2 . 1 1 137 137 ILE N N 137 121.881 121.881 121.389 0.492 25342 1596 1 2 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.707 -0.274 25342 1597 1 2 . 1 1 137 137 ILE C C 137 173.906 173.906 175.608 -1.702 25342 1598 1 2 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.978 -2.000 25342 1599 1 2 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.768 -2.572 25342 1600 1 2 . 1 1 137 137 ILE H H 137 9.139 9.139 8.966 0.173 25342 1601 1 2 . 1 1 138 138 GLY N N 138 108.226 108.226 107.621 0.605 25342 1602 1 2 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.566 -2.175 25342 1603 1 2 . 1 1 138 138 GLY H H 138 6.645 6.645 7.668 -1.023 25342 1604 1 2 . 1 1 139 139 VAL N N 139 119.408 119.408 120.861 -1.453 25342 1605 1 2 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.878 0.479 25342 1606 1 2 . 1 1 139 139 VAL C C 139 172.327 172.327 174.629 -2.302 25342 1607 1 2 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.157 -2.889 25342 1608 1 2 . 1 1 139 139 VAL CB C 139 32.743 32.743 33.360 -0.617 25342 1609 1 2 . 1 1 139 139 VAL H H 139 8.092 8.092 8.768 -0.676 25342 1610 1 2 . 1 1 140 140 ALA N N 140 127.415 127.415 129.649 -2.234 25342 1611 1 2 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.119 -0.674 25342 1612 1 2 . 1 1 140 140 ALA C C 140 170.718 170.718 176.286 -5.568 25342 1613 1 2 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.549 -2.649 25342 1614 1 2 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.426 -1.367 25342 1615 1 2 . 1 1 140 140 ALA H H 140 9.093 9.093 8.163 0.930 25342 1616 1 2 . 1 1 141 141 ARG N N 141 119.287 119.287 120.242 -0.955 25342 1617 1 2 . 1 1 141 141 ARG HA H 141 2.487 2.487 3.851 -1.364 25342 1618 1 2 . 1 1 141 141 ARG C C 141 173.375 173.375 174.852 -1.477 25342 1619 1 2 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.585 -3.701 25342 1620 1 2 . 1 1 141 141 ARG CB C 141 28.684 28.684 30.344 -1.660 25342 1621 1 2 . 1 1 141 141 ARG H H 141 7.620 7.620 8.683 -1.063 25342 1622 1 2 . 1 1 142 142 ASP N N 142 125.999 125.999 117.985 8.014 25342 1623 1 2 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.664 -0.940 25342 1624 1 2 . 1 1 142 142 ASP C C 142 169.292 169.292 175.201 -5.909 25342 1625 1 2 . 1 1 142 142 ASP CA C 142 53.338 53.338 54.050 -0.712 25342 1626 1 2 . 1 1 142 142 ASP CB C 142 36.677 36.677 43.567 -6.890 25342 1627 1 2 . 1 1 142 142 ASP H H 142 9.482 9.482 7.822 1.660 25342 1628 1 2 . 1 1 143 143 ASP N N 143 119.293 119.293 119.138 0.155 25342 1629 1 2 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.560 -0.254 25342 1630 1 2 . 1 1 143 143 ASP C C 143 175.686 175.686 177.363 -1.677 25342 1631 1 2 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.800 -5.895 25342 1632 1 2 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.298 -3.986 25342 1633 1 2 . 1 1 143 143 ASP H H 143 8.108 8.108 8.475 -0.367 25342 1634 1 2 . 1 1 144 144 SER N N 144 115.303 115.303 114.807 0.496 25342 1635 1 2 . 1 1 144 144 SER HA H 144 3.740 3.740 4.164 -0.424 25342 1636 1 2 . 1 1 144 144 SER C C 144 172.925 172.925 175.336 -2.411 25342 1637 1 2 . 1 1 144 144 SER CA C 144 59.213 59.213 60.278 -1.065 25342 1638 1 2 . 1 1 144 144 SER CB C 144 60.806 60.806 62.814 -2.008 25342 1639 1 2 . 1 1 144 144 SER H H 144 7.642 7.642 8.077 -0.435 25342 1640 1 2 . 1 1 145 145 GLU N N 145 119.523 119.523 119.573 -0.050 25342 1641 1 2 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.175 0.131 25342 1642 1 2 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.429 -3.390 25342 1643 1 2 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.352 -2.552 25342 1644 1 2 . 1 1 145 145 GLU H H 145 7.771 7.771 7.939 -0.168 25342 1645 1 2 . 1 1 146 146 VAL N N 146 118.683 118.683 120.262 -1.579 25342 1646 1 2 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.419 -0.478 25342 1647 1 2 . 1 1 146 146 VAL C C 146 174.591 174.591 177.291 -2.700 25342 1648 1 2 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.198 -2.266 25342 1649 1 2 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.399 -2.353 25342 1650 1 2 . 1 1 146 146 VAL H H 146 6.352 6.352 7.101 -0.749 25342 1651 1 2 . 1 1 147 147 ASP N N 147 119.312 119.312 119.381 -0.069 25342 1652 1 2 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.346 -0.291 25342 1653 1 2 . 1 1 147 147 ASP C C 147 174.783 174.783 177.474 -2.691 25342 1654 1 2 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.989 -2.748 25342 1655 1 2 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.596 -3.363 25342 1656 1 2 . 1 1 147 147 ASP H H 147 8.370 8.370 8.583 -0.213 25342 1657 1 2 . 1 1 148 148 LYS N N 148 119.342 119.342 117.594 1.748 25342 1658 1 2 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.342 -0.405 25342 1659 1 2 . 1 1 148 148 LYS C C 148 176.384 176.384 177.792 -1.408 25342 1660 1 2 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.685 -1.979 25342 1661 1 2 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.047 -2.536 25342 1662 1 2 . 1 1 148 148 LYS H H 148 7.040 7.040 7.577 -0.537 25342 1663 1 2 . 1 1 149 149 TRP N N 149 118.258 118.258 119.705 -1.447 25342 1664 1 2 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.999 -0.408 25342 1665 1 2 . 1 1 149 149 TRP C C 149 174.212 174.212 176.371 -2.159 25342 1666 1 2 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.311 -1.566 25342 1667 1 2 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.898 -1.958 25342 1668 1 2 . 1 1 149 149 TRP H H 149 7.811 7.811 7.716 0.095 25342 1669 1 2 . 1 1 150 150 SER N N 150 109.618 109.618 113.551 -3.933 25342 1670 1 2 . 1 1 150 150 SER HA H 150 4.234 4.234 4.684 -0.450 25342 1671 1 2 . 1 1 150 150 SER C C 150 170.189 170.189 174.084 -3.895 25342 1672 1 2 . 1 1 150 150 SER CA C 150 56.695 56.695 56.877 -0.181 25342 1673 1 2 . 1 1 150 150 SER CB C 150 61.935 61.935 63.490 -1.555 25342 1674 1 2 . 1 1 150 150 SER H H 150 7.793 7.793 7.596 0.197 25342 1675 1 3 . 1 1 3 3 ALA N N 3 125.638 125.638 128.473 -2.835 25342 1676 1 3 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.630 -0.265 25342 1677 1 3 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.298 -3.000 25342 1678 1 3 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.287 -2.428 25342 1679 1 3 . 1 1 3 3 ALA H H 3 8.325 8.325 8.573 -0.248 25342 1680 1 3 . 1 1 4 4 LYS N N 4 121.813 121.813 118.624 3.189 25342 1681 1 3 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.588 -0.361 25342 1682 1 3 . 1 1 4 4 LYS C C 4 174.574 174.574 174.343 0.231 25342 1683 1 3 . 1 1 4 4 LYS CA C 4 53.781 53.781 56.143 -2.362 25342 1684 1 3 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.765 -1.275 25342 1685 1 3 . 1 1 4 4 LYS H H 4 8.486 8.486 7.624 0.862 25342 1686 1 3 . 1 1 5 5 LYS N N 5 129.722 129.722 124.886 4.836 25342 1687 1 3 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.746 -0.228 25342 1688 1 3 . 1 1 5 5 LYS C C 5 174.720 174.720 174.912 -0.192 25342 1689 1 3 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.183 -0.461 25342 1690 1 3 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.990 -7.205 25342 1691 1 3 . 1 1 5 5 LYS H H 5 10.015 10.015 8.127 1.888 25342 1692 1 3 . 1 1 6 6 THR N N 6 126.254 126.254 116.733 9.521 25342 1693 1 3 . 1 1 6 6 THR HA H 6 5.654 5.654 5.281 0.373 25342 1694 1 3 . 1 1 6 6 THR C C 6 169.926 169.926 172.673 -2.747 25342 1695 1 3 . 1 1 6 6 THR CA C 6 60.598 60.598 62.061 -1.463 25342 1696 1 3 . 1 1 6 6 THR CB C 6 68.041 68.041 71.139 -3.098 25342 1697 1 3 . 1 1 6 6 THR H H 6 8.538 8.538 8.728 -0.190 25342 1698 1 3 . 1 1 7 7 LEU N N 7 130.775 130.775 128.364 2.411 25342 1699 1 3 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.526 0.068 25342 1700 1 3 . 1 1 7 7 LEU C C 7 170.404 170.404 173.882 -3.478 25342 1701 1 3 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.242 -3.309 25342 1702 1 3 . 1 1 7 7 LEU CB C 7 40.728 40.728 44.976 -4.248 25342 1703 1 3 . 1 1 7 7 LEU H H 7 8.575 8.575 8.482 0.093 25342 1704 1 3 . 1 1 8 8 ILE N N 8 127.242 127.242 126.062 1.180 25342 1705 1 3 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.326 0.522 25342 1706 1 3 . 1 1 8 8 ILE C C 8 170.936 170.936 174.532 -3.596 25342 1707 1 3 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.671 -3.419 25342 1708 1 3 . 1 1 8 8 ILE CB C 8 36.935 36.935 38.398 -1.463 25342 1709 1 3 . 1 1 8 8 ILE H H 8 9.217 9.217 8.016 1.201 25342 1710 1 3 . 1 1 9 9 LEU N N 9 127.183 127.183 129.131 -1.948 25342 1711 1 3 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.747 0.947 25342 1712 1 3 . 1 1 9 9 LEU C C 9 173.824 173.824 175.094 -1.270 25342 1713 1 3 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.743 -3.904 25342 1714 1 3 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.293 1.670 25342 1715 1 3 . 1 1 9 9 LEU H H 9 9.248 9.248 8.798 0.450 25342 1716 1 3 . 1 1 10 10 TYR N N 10 113.330 113.330 122.284 -8.954 25342 1717 1 3 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.198 0.316 25342 1718 1 3 . 1 1 10 10 TYR C C 10 167.898 167.898 175.900 -8.002 25342 1719 1 3 . 1 1 10 10 TYR CA C 10 52.875 52.875 54.880 -2.005 25342 1720 1 3 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.349 -1.913 25342 1721 1 3 . 1 1 10 10 TYR H H 10 7.306 7.306 8.047 -0.741 25342 1722 1 3 . 1 1 11 11 TYR N N 11 121.297 121.297 123.893 -2.596 25342 1723 1 3 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.921 -0.159 25342 1724 1 3 . 1 1 11 11 TYR C C 11 169.698 169.698 175.194 -5.496 25342 1725 1 3 . 1 1 11 11 TYR CA C 11 54.047 54.047 57.333 -3.286 25342 1726 1 3 . 1 1 11 11 TYR CB C 11 40.538 40.538 40.401 0.137 25342 1727 1 3 . 1 1 11 11 TYR H H 11 7.891 7.891 8.743 -0.852 25342 1728 1 3 . 1 1 12 12 SER N N 12 117.763 117.763 114.503 3.260 25342 1729 1 3 . 1 1 12 12 SER HA H 12 4.679 4.679 4.419 0.260 25342 1730 1 3 . 1 1 12 12 SER C C 12 170.075 170.075 172.587 -2.512 25342 1731 1 3 . 1 1 12 12 SER CA C 12 53.619 53.619 56.906 -3.287 25342 1732 1 3 . 1 1 12 12 SER CB C 12 62.847 62.847 64.691 -1.844 25342 1733 1 3 . 1 1 12 12 SER H H 12 7.557 7.557 7.386 0.171 25342 1734 1 3 . 1 1 13 13 TRP N N 13 135.232 135.232 129.526 5.706 25342 1735 1 3 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.248 0.388 25342 1736 1 3 . 1 1 13 13 TRP C C 13 175.708 175.708 176.042 -0.334 25342 1737 1 3 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.201 -2.085 25342 1738 1 3 . 1 1 13 13 TRP CB C 13 27.635 27.635 30.023 -2.388 25342 1739 1 3 . 1 1 13 13 TRP H H 13 9.755 9.755 8.097 1.658 25342 1740 1 3 . 1 1 14 14 SER N N 14 113.789 113.789 112.671 1.118 25342 1741 1 3 . 1 1 14 14 SER HA H 14 4.223 4.223 4.436 -0.213 25342 1742 1 3 . 1 1 14 14 SER C C 14 172.747 172.747 174.035 -1.288 25342 1743 1 3 . 1 1 14 14 SER CA C 14 53.828 53.828 57.665 -3.837 25342 1744 1 3 . 1 1 14 14 SER CB C 14 60.037 60.037 63.325 -3.288 25342 1745 1 3 . 1 1 14 14 SER H H 14 10.026 10.026 8.102 1.924 25342 1746 1 3 . 1 1 15 15 GLY N N 15 110.489 110.489 110.809 -0.320 25342 1747 1 3 . 1 1 15 15 GLY CA C 15 44.659 44.659 46.067 -1.408 25342 1748 1 3 . 1 1 15 15 GLY H H 15 7.391 7.391 8.095 -0.704 25342 1749 1 3 . 1 1 16 16 GLU N N 16 129.005 129.005 120.995 8.010 25342 1750 1 3 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.024 0.039 25342 1751 1 3 . 1 1 16 16 GLU CA C 16 56.761 56.761 59.410 -2.649 25342 1752 1 3 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.466 -3.054 25342 1753 1 3 . 1 1 16 16 GLU H H 16 11.550 11.550 8.638 2.912 25342 1754 1 3 . 1 1 17 17 THR N N 17 123.016 123.016 114.402 8.614 25342 1755 1 3 . 1 1 17 17 THR HA H 17 4.035 4.035 3.976 0.059 25342 1756 1 3 . 1 1 17 17 THR C C 17 173.360 173.360 176.433 -3.073 25342 1757 1 3 . 1 1 17 17 THR CA C 17 64.303 64.303 66.519 -2.216 25342 1758 1 3 . 1 1 17 17 THR CB C 17 63.999 63.999 68.234 -4.235 25342 1759 1 3 . 1 1 17 17 THR H H 17 11.293 11.293 8.312 2.981 25342 1760 1 3 . 1 1 18 18 LYS N N 18 120.156 120.156 121.059 -0.903 25342 1761 1 3 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.036 -1.180 25342 1762 1 3 . 1 1 18 18 LYS C C 18 173.901 173.901 178.522 -4.621 25342 1763 1 3 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.047 -2.213 25342 1764 1 3 . 1 1 18 18 LYS CB C 18 29.481 29.481 31.897 -2.416 25342 1765 1 3 . 1 1 18 18 LYS H H 18 6.940 6.940 8.098 -1.158 25342 1766 1 3 . 1 1 19 19 LYS N N 19 117.237 117.237 118.913 -1.676 25342 1767 1 3 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.030 -0.107 25342 1768 1 3 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.082 -2.758 25342 1769 1 3 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.168 -2.807 25342 1770 1 3 . 1 1 19 19 LYS H H 19 7.212 7.212 8.057 -0.845 25342 1771 1 3 . 1 1 20 20 MET N N 20 119.268 119.268 117.154 2.114 25342 1772 1 3 . 1 1 20 20 MET HA H 20 4.413 4.413 4.260 0.153 25342 1773 1 3 . 1 1 20 20 MET C C 20 173.625 173.625 177.446 -3.821 25342 1774 1 3 . 1 1 20 20 MET CA C 20 52.261 52.261 56.785 -4.524 25342 1775 1 3 . 1 1 20 20 MET CB C 20 26.680 26.680 32.238 -5.558 25342 1776 1 3 . 1 1 20 20 MET H H 20 7.600 7.600 7.713 -0.113 25342 1777 1 3 . 1 1 21 21 ALA N N 21 123.669 123.669 121.781 1.888 25342 1778 1 3 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.932 -0.450 25342 1779 1 3 . 1 1 21 21 ALA C C 21 176.628 176.628 179.608 -2.980 25342 1780 1 3 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.174 -2.800 25342 1781 1 3 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.875 -1.380 25342 1782 1 3 . 1 1 21 21 ALA H H 21 8.738 8.738 7.808 0.930 25342 1783 1 3 . 1 1 22 22 GLU N N 22 117.242 117.242 117.054 0.188 25342 1784 1 3 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.924 -0.251 25342 1785 1 3 . 1 1 22 22 GLU C C 22 176.698 176.698 178.412 -1.714 25342 1786 1 3 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.191 -2.651 25342 1787 1 3 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.505 -3.071 25342 1788 1 3 . 1 1 22 22 GLU H H 22 7.959 7.959 7.871 0.088 25342 1789 1 3 . 1 1 23 23 LYS N N 23 123.302 123.302 120.052 3.250 25342 1790 1 3 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.099 -0.278 25342 1791 1 3 . 1 1 23 23 LYS C C 23 177.389 177.389 179.459 -2.070 25342 1792 1 3 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.008 -2.086 25342 1793 1 3 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.334 -2.820 25342 1794 1 3 . 1 1 23 23 LYS H H 23 7.703 7.703 7.286 0.417 25342 1795 1 3 . 1 1 24 24 ILE N N 24 122.208 122.208 119.971 2.237 25342 1796 1 3 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.812 -0.529 25342 1797 1 3 . 1 1 24 24 ILE C C 24 174.934 174.934 177.582 -2.648 25342 1798 1 3 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.182 -1.890 25342 1799 1 3 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.766 -3.028 25342 1800 1 3 . 1 1 24 24 ILE H H 24 8.535 8.535 7.785 0.750 25342 1801 1 3 . 1 1 25 25 ASN N N 25 118.640 118.640 116.989 1.651 25342 1802 1 3 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.346 -0.119 25342 1803 1 3 . 1 1 25 25 ASN C C 25 173.530 173.530 176.905 -3.375 25342 1804 1 3 . 1 1 25 25 ASN CA C 25 52.211 52.211 55.635 -3.424 25342 1805 1 3 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.729 -0.625 25342 1806 1 3 . 1 1 25 25 ASN H H 25 8.317 8.317 8.411 -0.094 25342 1807 1 3 . 1 1 26 26 SER N N 26 111.990 111.990 114.338 -2.348 25342 1808 1 3 . 1 1 26 26 SER HA H 26 4.153 4.153 4.363 -0.210 25342 1809 1 3 . 1 1 26 26 SER C C 26 172.110 172.110 175.260 -3.150 25342 1810 1 3 . 1 1 26 26 SER CA C 26 57.905 57.905 60.468 -2.563 25342 1811 1 3 . 1 1 26 26 SER CB C 26 60.655 60.655 63.507 -2.852 25342 1812 1 3 . 1 1 26 26 SER H H 26 7.369 7.369 7.680 -0.311 25342 1813 1 3 . 1 1 27 27 GLU N N 27 120.201 120.201 119.493 0.708 25342 1814 1 3 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.300 -0.199 25342 1815 1 3 . 1 1 27 27 GLU C C 27 173.673 173.673 176.759 -3.086 25342 1816 1 3 . 1 1 27 27 GLU CA C 27 54.235 54.235 57.061 -2.826 25342 1817 1 3 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.189 -3.588 25342 1818 1 3 . 1 1 27 27 GLU H H 27 7.451 7.451 7.585 -0.134 25342 1819 1 3 . 1 1 28 28 ILE N N 28 118.762 118.762 118.358 0.404 25342 1820 1 3 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.190 0.009 25342 1821 1 3 . 1 1 28 28 ILE C C 28 172.487 172.487 176.912 -4.425 25342 1822 1 3 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.381 -2.649 25342 1823 1 3 . 1 1 28 28 ILE CB C 28 35.738 35.738 39.170 -3.432 25342 1824 1 3 . 1 1 28 28 ILE H H 28 7.255 7.255 7.281 -0.026 25342 1825 1 3 . 1 1 29 29 LYS N N 29 130.563 130.563 122.571 7.992 25342 1826 1 3 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.132 -0.130 25342 1827 1 3 . 1 1 29 29 LYS C C 29 174.386 174.386 177.218 -2.832 25342 1828 1 3 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.115 -1.580 25342 1829 1 3 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.205 -3.619 25342 1830 1 3 . 1 1 29 29 LYS H H 29 8.564 8.564 8.760 -0.196 25342 1831 1 3 . 1 1 30 30 ASP N N 30 119.357 119.357 120.320 -0.963 25342 1832 1 3 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.654 -0.252 25342 1833 1 3 . 1 1 30 30 ASP C C 30 172.570 172.570 176.083 -3.513 25342 1834 1 3 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.054 -0.618 25342 1835 1 3 . 1 1 30 30 ASP CB C 30 36.744 36.744 38.488 -1.744 25342 1836 1 3 . 1 1 30 30 ASP H H 30 8.920 8.920 8.638 0.282 25342 1837 1 3 . 1 1 31 31 SER N N 31 114.019 114.019 114.718 -0.699 25342 1838 1 3 . 1 1 31 31 SER HA H 31 4.782 4.782 4.447 0.335 25342 1839 1 3 . 1 1 31 31 SER C C 31 171.150 171.150 174.509 -3.359 25342 1840 1 3 . 1 1 31 31 SER CA C 31 55.551 55.551 58.405 -2.854 25342 1841 1 3 . 1 1 31 31 SER CB C 31 62.259 62.259 65.155 -2.896 25342 1842 1 3 . 1 1 31 31 SER H H 31 8.006 8.006 8.094 -0.088 25342 1843 1 3 . 1 1 32 32 GLU N N 32 121.455 121.455 119.142 2.313 25342 1844 1 3 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.540 0.200 25342 1845 1 3 . 1 1 32 32 GLU C C 32 171.185 171.185 174.330 -3.145 25342 1846 1 3 . 1 1 32 32 GLU CA C 32 52.081 52.081 54.761 -2.680 25342 1847 1 3 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.373 -1.546 25342 1848 1 3 . 1 1 32 32 GLU H H 32 8.145 8.145 8.647 -0.502 25342 1849 1 3 . 1 1 33 33 LEU N N 33 126.176 126.176 124.274 1.902 25342 1850 1 3 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.440 0.866 25342 1851 1 3 . 1 1 33 33 LEU C C 33 173.365 173.365 174.931 -1.566 25342 1852 1 3 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.321 -2.881 25342 1853 1 3 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.253 0.382 25342 1854 1 3 . 1 1 33 33 LEU H H 33 8.589 8.589 8.582 0.007 25342 1855 1 3 . 1 1 34 34 LYS N N 34 127.200 127.200 125.717 1.483 25342 1856 1 3 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.662 -0.066 25342 1857 1 3 . 1 1 34 34 LYS C C 34 169.622 169.622 175.292 -5.670 25342 1858 1 3 . 1 1 34 34 LYS CA C 34 52.329 52.329 53.501 -1.172 25342 1859 1 3 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.040 -1.840 25342 1860 1 3 . 1 1 34 34 LYS H H 34 9.380 9.380 8.756 0.624 25342 1861 1 3 . 1 1 35 35 GLU N N 35 122.324 122.324 117.027 5.297 25342 1862 1 3 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.327 -1.994 25342 1863 1 3 . 1 1 35 35 GLU C C 35 172.734 172.734 174.650 -1.916 25342 1864 1 3 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.912 -2.300 25342 1865 1 3 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.248 -3.929 25342 1866 1 3 . 1 1 35 35 GLU H H 35 8.094 8.094 8.414 -0.320 25342 1867 1 3 . 1 1 36 36 VAL N N 36 126.781 126.781 117.673 9.108 25342 1868 1 3 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.583 -0.744 25342 1869 1 3 . 1 1 36 36 VAL C C 36 171.482 171.482 174.763 -3.281 25342 1870 1 3 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.394 -0.989 25342 1871 1 3 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.970 -6.622 25342 1872 1 3 . 1 1 36 36 VAL H H 36 8.660 8.660 8.805 -0.145 25342 1873 1 3 . 1 1 37 37 LYS N N 37 126.065 126.065 120.593 5.472 25342 1874 1 3 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.592 0.373 25342 1875 1 3 . 1 1 37 37 LYS C C 37 173.187 173.187 174.369 -1.182 25342 1876 1 3 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.851 -2.571 25342 1877 1 3 . 1 1 37 37 LYS CB C 37 32.921 32.921 34.857 -1.936 25342 1878 1 3 . 1 1 37 37 LYS H H 37 7.809 7.809 8.283 -0.474 25342 1879 1 3 . 1 1 38 38 VAL N N 38 111.020 111.020 115.829 -4.809 25342 1880 1 3 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.704 0.120 25342 1881 1 3 . 1 1 38 38 VAL C C 38 173.604 173.604 175.944 -2.340 25342 1882 1 3 . 1 1 38 38 VAL CA C 38 56.383 56.383 60.189 -3.806 25342 1883 1 3 . 1 1 38 38 VAL CB C 38 32.376 32.376 32.842 -0.466 25342 1884 1 3 . 1 1 38 38 VAL H H 38 8.305 8.305 7.884 0.421 25342 1885 1 3 . 1 1 39 39 SER N N 39 117.887 117.887 115.179 2.708 25342 1886 1 3 . 1 1 39 39 SER HA H 39 4.183 4.183 4.495 -0.312 25342 1887 1 3 . 1 1 39 39 SER C C 39 173.538 173.538 174.665 -1.127 25342 1888 1 3 . 1 1 39 39 SER CA C 39 56.279 56.279 57.972 -1.693 25342 1889 1 3 . 1 1 39 39 SER CB C 39 60.537 60.537 63.982 -3.445 25342 1890 1 3 . 1 1 39 39 SER H H 39 8.847 8.847 8.485 0.362 25342 1891 1 3 . 1 1 40 40 GLU N N 40 126.316 126.316 120.710 5.606 25342 1892 1 3 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.362 -0.208 25342 1893 1 3 . 1 1 40 40 GLU C C 40 174.586 174.586 177.071 -2.485 25342 1894 1 3 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.027 -1.215 25342 1895 1 3 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.914 -3.194 25342 1896 1 3 . 1 1 40 40 GLU H H 40 9.049 9.049 8.423 0.626 25342 1897 1 3 . 1 1 41 41 GLY N N 41 112.494 112.494 110.696 1.798 25342 1898 1 3 . 1 1 41 41 GLY C C 41 171.994 171.994 175.386 -3.392 25342 1899 1 3 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.874 -3.412 25342 1900 1 3 . 1 1 41 41 GLY H H 41 8.780 8.780 8.731 0.049 25342 1901 1 3 . 1 1 42 42 THR N N 42 118.631 118.631 114.684 3.947 25342 1902 1 3 . 1 1 42 42 THR HA H 42 3.582 3.582 3.723 -0.141 25342 1903 1 3 . 1 1 42 42 THR C C 42 171.225 171.225 173.888 -2.663 25342 1904 1 3 . 1 1 42 42 THR CA C 42 64.104 64.104 64.115 -0.011 25342 1905 1 3 . 1 1 42 42 THR CB C 42 65.914 65.914 68.940 -3.026 25342 1906 1 3 . 1 1 42 42 THR H H 42 7.737 7.737 7.868 -0.131 25342 1907 1 3 . 1 1 43 43 PHE N N 43 116.279 116.279 117.779 -1.500 25342 1908 1 3 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.658 0.362 25342 1909 1 3 . 1 1 43 43 PHE C C 43 170.141 170.141 173.857 -3.716 25342 1910 1 3 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.500 -4.028 25342 1911 1 3 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.149 -3.764 25342 1912 1 3 . 1 1 43 43 PHE H H 43 8.114 8.114 7.723 0.391 25342 1913 1 3 . 1 1 44 44 ASP N N 44 121.513 121.513 119.579 1.934 25342 1914 1 3 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.974 -0.123 25342 1915 1 3 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.610 -2.398 25342 1916 1 3 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.253 0.132 25342 1917 1 3 . 1 1 44 44 ASP H H 44 7.774 7.774 8.512 -0.738 25342 1918 1 3 . 1 1 45 45 ALA N N 45 125.663 125.663 122.517 3.146 25342 1919 1 3 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.705 -0.494 25342 1920 1 3 . 1 1 45 45 ALA C C 45 175.139 175.139 176.131 -0.992 25342 1921 1 3 . 1 1 45 45 ALA CA C 45 51.436 51.436 51.730 -0.294 25342 1922 1 3 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.427 -3.195 25342 1923 1 3 . 1 1 45 45 ALA H H 45 8.324 8.324 8.131 0.193 25342 1924 1 3 . 1 1 46 46 ASP N N 46 119.288 119.288 119.655 -0.367 25342 1925 1 3 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.633 0.192 25342 1926 1 3 . 1 1 46 46 ASP C C 46 175.013 175.013 175.916 -0.903 25342 1927 1 3 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.498 -2.337 25342 1928 1 3 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.346 -1.113 25342 1929 1 3 . 1 1 46 46 ASP H H 46 9.618 9.618 7.941 1.677 25342 1930 1 3 . 1 1 47 47 MET N N 47 127.347 127.347 117.435 9.912 25342 1931 1 3 . 1 1 47 47 MET HA H 47 3.456 3.456 4.536 -1.080 25342 1932 1 3 . 1 1 47 47 MET C C 47 173.605 173.605 175.244 -1.639 25342 1933 1 3 . 1 1 47 47 MET CA C 47 56.699 56.699 56.469 0.230 25342 1934 1 3 . 1 1 47 47 MET CB C 47 29.930 29.930 34.579 -4.649 25342 1935 1 3 . 1 1 47 47 MET H H 47 9.178 9.178 7.884 1.294 25342 1936 1 3 . 1 1 48 48 TYR N N 48 121.040 121.040 112.937 8.103 25342 1937 1 3 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.973 -1.101 25342 1938 1 3 . 1 1 48 48 TYR CA C 48 58.712 58.712 56.651 2.061 25342 1939 1 3 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.468 -4.830 25342 1940 1 3 . 1 1 48 48 TYR H H 48 7.881 7.881 8.015 -0.134 25342 1941 1 3 . 1 1 49 49 LYS N N 49 121.754 121.754 121.113 0.641 25342 1942 1 3 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.039 0.066 25342 1943 1 3 . 1 1 49 49 LYS CA C 49 56.385 56.385 60.827 -4.441 25342 1944 1 3 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.315 -3.151 25342 1945 1 3 . 1 1 49 49 LYS H H 49 8.365 8.365 8.299 0.066 25342 1946 1 3 . 1 1 50 50 THR N N 50 117.557 117.557 110.565 6.992 25342 1947 1 3 . 1 1 50 50 THR HA H 50 3.586 3.586 4.231 -0.645 25342 1948 1 3 . 1 1 50 50 THR CA C 50 65.634 65.634 66.056 -0.422 25342 1949 1 3 . 1 1 50 50 THR CB C 50 65.904 65.904 68.134 -2.230 25342 1950 1 3 . 1 1 50 50 THR H H 50 8.007 8.007 8.378 -0.371 25342 1951 1 3 . 1 1 51 51 SER N N 51 115.110 115.110 119.661 -4.551 25342 1952 1 3 . 1 1 51 51 SER HA H 51 3.974 3.974 4.335 -0.361 25342 1953 1 3 . 1 1 51 51 SER CA C 51 59.042 59.042 61.661 -2.619 25342 1954 1 3 . 1 1 51 51 SER CB C 51 59.835 59.835 62.832 -2.997 25342 1955 1 3 . 1 1 51 51 SER H H 51 7.606 7.606 8.215 -0.609 25342 1956 1 3 . 1 1 52 52 ASP N N 52 119.713 119.713 122.671 -2.958 25342 1957 1 3 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.491 -0.183 25342 1958 1 3 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.263 -2.737 25342 1959 1 3 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.972 -3.284 25342 1960 1 3 . 1 1 52 52 ASP H H 52 7.552 7.552 7.940 -0.388 25342 1961 1 3 . 1 1 53 53 ILE N N 53 121.982 121.982 120.127 1.855 25342 1962 1 3 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.541 0.181 25342 1963 1 3 . 1 1 53 53 ILE C C 53 175.325 175.325 177.846 -2.521 25342 1964 1 3 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.757 -3.213 25342 1965 1 3 . 1 1 53 53 ILE CB C 53 36.699 36.699 38.102 -1.403 25342 1966 1 3 . 1 1 53 53 ILE H H 53 7.815 7.815 8.004 -0.189 25342 1967 1 3 . 1 1 54 54 ALA N N 54 121.552 121.552 118.906 2.646 25342 1968 1 3 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.090 0.227 25342 1969 1 3 . 1 1 54 54 ALA C C 54 177.475 177.475 178.297 -0.822 25342 1970 1 3 . 1 1 54 54 ALA CA C 54 52.022 52.022 53.931 -1.909 25342 1971 1 3 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.517 -2.533 25342 1972 1 3 . 1 1 54 54 ALA H H 54 8.332 8.332 7.470 0.862 25342 1973 1 3 . 1 1 55 55 LEU N N 55 117.176 117.176 118.991 -1.815 25342 1974 1 3 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.066 -0.132 25342 1975 1 3 . 1 1 55 55 LEU C C 55 176.532 176.532 178.223 -1.691 25342 1976 1 3 . 1 1 55 55 LEU CA C 55 55.331 55.331 56.694 -1.363 25342 1977 1 3 . 1 1 55 55 LEU CB C 55 38.428 38.428 42.285 -3.857 25342 1978 1 3 . 1 1 55 55 LEU H H 55 8.195 8.195 7.175 1.020 25342 1979 1 3 . 1 1 56 56 ASP N N 56 120.056 120.056 119.500 0.556 25342 1980 1 3 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.298 0.169 25342 1981 1 3 . 1 1 56 56 ASP C C 56 176.585 176.585 178.555 -1.970 25342 1982 1 3 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.582 -3.032 25342 1983 1 3 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.732 -2.427 25342 1984 1 3 . 1 1 56 56 ASP H H 56 7.806 7.806 8.054 -0.248 25342 1985 1 3 . 1 1 57 57 GLN N N 57 120.020 120.020 115.828 4.192 25342 1986 1 3 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.380 -0.257 25342 1987 1 3 . 1 1 57 57 GLN C C 57 175.689 175.689 177.507 -1.818 25342 1988 1 3 . 1 1 57 57 GLN CA C 57 54.405 54.405 57.491 -3.086 25342 1989 1 3 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.965 -5.197 25342 1990 1 3 . 1 1 57 57 GLN H H 57 7.661 7.661 7.538 0.123 25342 1991 1 3 . 1 1 58 58 ILE N N 58 120.644 120.644 119.398 1.246 25342 1992 1 3 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.280 -0.704 25342 1993 1 3 . 1 1 58 58 ILE C C 58 176.237 176.237 177.430 -1.193 25342 1994 1 3 . 1 1 58 58 ILE CA C 58 62.506 62.506 63.294 -0.788 25342 1995 1 3 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.702 -2.673 25342 1996 1 3 . 1 1 58 58 ILE H H 58 8.228 8.228 7.581 0.647 25342 1997 1 3 . 1 1 59 59 GLN N N 59 115.498 115.498 118.581 -3.083 25342 1998 1 3 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.232 -0.090 25342 1999 1 3 . 1 1 59 59 GLN C C 59 173.781 173.781 176.858 -3.077 25342 2000 1 3 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.215 -3.233 25342 2001 1 3 . 1 1 59 59 GLN CB C 59 26.611 26.611 28.707 -2.096 25342 2002 1 3 . 1 1 59 59 GLN H H 59 8.331 8.331 8.169 0.162 25342 2003 1 3 . 1 1 60 60 GLY N N 60 106.623 106.623 106.139 0.484 25342 2004 1 3 . 1 1 60 60 GLY C C 60 172.068 172.068 175.294 -3.226 25342 2005 1 3 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.511 -2.638 25342 2006 1 3 . 1 1 60 60 GLY H H 60 7.611 7.611 8.402 -0.791 25342 2007 1 3 . 1 1 61 61 ASN N N 61 117.691 117.691 118.446 -0.755 25342 2008 1 3 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.683 -0.139 25342 2009 1 3 . 1 1 61 61 ASN C C 61 171.946 171.946 175.873 -3.927 25342 2010 1 3 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.236 -2.667 25342 2011 1 3 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.009 -2.649 25342 2012 1 3 . 1 1 61 61 ASN H H 61 8.151 8.151 8.192 -0.041 25342 2013 1 3 . 1 1 62 62 LYS N N 62 118.289 118.289 119.151 -0.862 25342 2014 1 3 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.635 -0.307 25342 2015 1 3 . 1 1 62 62 LYS C C 62 171.773 171.773 175.513 -3.740 25342 2016 1 3 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.506 -3.210 25342 2017 1 3 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.157 -0.474 25342 2018 1 3 . 1 1 62 62 LYS H H 62 7.242 7.242 7.608 -0.366 25342 2019 1 3 . 1 1 63 63 ASP N N 63 119.888 119.888 120.460 -0.572 25342 2020 1 3 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.492 -0.076 25342 2021 1 3 . 1 1 63 63 ASP C C 63 174.476 174.476 175.335 -0.859 25342 2022 1 3 . 1 1 63 63 ASP CA C 63 51.461 51.461 54.133 -2.672 25342 2023 1 3 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.161 -2.646 25342 2024 1 3 . 1 1 63 63 ASP H H 63 8.230 8.230 8.326 -0.096 25342 2025 1 3 . 1 1 64 64 PHE N N 64 119.789 119.789 113.911 5.878 25342 2026 1 3 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.964 -1.148 25342 2027 1 3 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.834 1.415 25342 2028 1 3 . 1 1 64 64 PHE CB C 64 35.034 35.034 39.086 -4.052 25342 2029 1 3 . 1 1 64 64 PHE H H 64 8.428 8.428 7.372 1.056 25342 2030 1 3 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.461 -0.148 25342 2031 1 3 . 1 1 65 65 PRO C C 65 173.975 173.975 175.559 -1.584 25342 2032 1 3 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.289 -2.233 25342 2033 1 3 . 1 1 65 65 PRO CB C 65 29.520 29.520 33.008 -3.488 25342 2034 1 3 . 1 1 66 66 GLU N N 66 121.326 121.326 117.617 3.709 25342 2035 1 3 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.643 -0.410 25342 2036 1 3 . 1 1 66 66 GLU C C 66 173.978 173.978 176.581 -2.603 25342 2037 1 3 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.188 -1.657 25342 2038 1 3 . 1 1 66 66 GLU CB C 66 27.700 27.700 32.252 -4.552 25342 2039 1 3 . 1 1 66 66 GLU H H 66 8.225 8.225 8.300 -0.075 25342 2040 1 3 . 1 1 67 67 ILE N N 67 113.897 113.897 114.187 -0.290 25342 2041 1 3 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.827 0.342 25342 2042 1 3 . 1 1 67 67 ILE C C 67 172.791 172.791 175.739 -2.948 25342 2043 1 3 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.010 -2.735 25342 2044 1 3 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.835 -2.819 25342 2045 1 3 . 1 1 67 67 ILE H H 67 8.366 8.366 8.190 0.176 25342 2046 1 3 . 1 1 68 68 GLN N N 68 121.654 121.654 119.426 2.228 25342 2047 1 3 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.452 0.067 25342 2048 1 3 . 1 1 68 68 GLN C C 68 171.562 171.562 175.140 -3.578 25342 2049 1 3 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.698 -2.385 25342 2050 1 3 . 1 1 68 68 GLN CB C 68 26.785 26.785 29.088 -2.303 25342 2051 1 3 . 1 1 68 68 GLN H H 68 8.763 8.763 8.445 0.318 25342 2052 1 3 . 1 1 69 69 LEU N N 69 125.289 125.289 121.604 3.685 25342 2053 1 3 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.474 0.045 25342 2054 1 3 . 1 1 69 69 LEU C C 69 172.567 172.567 176.822 -4.255 25342 2055 1 3 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.866 -3.069 25342 2056 1 3 . 1 1 69 69 LEU CB C 69 42.742 42.742 42.759 -0.017 25342 2057 1 3 . 1 1 69 69 LEU H H 69 7.996 7.996 7.662 0.334 25342 2058 1 3 . 1 1 70 70 ASP N N 70 123.170 123.170 123.891 -0.721 25342 2059 1 3 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.648 -0.242 25342 2060 1 3 . 1 1 70 70 ASP C C 70 171.978 171.978 175.688 -3.710 25342 2061 1 3 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.972 -2.290 25342 2062 1 3 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.812 -3.083 25342 2063 1 3 . 1 1 70 70 ASP H H 70 8.278 8.278 8.314 -0.036 25342 2064 1 3 . 1 1 71 71 ASN N N 71 117.524 117.524 118.545 -1.021 25342 2065 1 3 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.588 -0.261 25342 2066 1 3 . 1 1 71 71 ASN C C 71 171.825 171.825 173.999 -2.174 25342 2067 1 3 . 1 1 71 71 ASN CA C 71 51.657 51.657 54.208 -2.551 25342 2068 1 3 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.883 -3.653 25342 2069 1 3 . 1 1 71 71 ASN H H 71 8.372 8.372 8.562 -0.190 25342 2070 1 3 . 1 1 72 72 ILE N N 72 124.515 124.515 122.989 1.526 25342 2071 1 3 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.286 -0.357 25342 2072 1 3 . 1 1 72 72 ILE C C 72 171.607 171.607 173.808 -2.201 25342 2073 1 3 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.865 -2.576 25342 2074 1 3 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.235 -2.475 25342 2075 1 3 . 1 1 72 72 ILE H H 72 7.653 7.653 8.055 -0.402 25342 2076 1 3 . 1 1 73 73 ASP N N 73 125.182 125.182 123.204 1.978 25342 2077 1 3 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.604 0.024 25342 2078 1 3 . 1 1 73 73 ASP C C 73 173.980 173.980 174.863 -0.883 25342 2079 1 3 . 1 1 73 73 ASP CA C 73 49.214 49.214 53.337 -4.123 25342 2080 1 3 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.830 -4.928 25342 2081 1 3 . 1 1 73 73 ASP H H 73 8.382 8.382 8.531 -0.149 25342 2082 1 3 . 1 1 74 74 TYR N N 74 123.092 123.092 124.996 -1.904 25342 2083 1 3 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.914 -1.049 25342 2084 1 3 . 1 1 74 74 TYR C C 74 173.582 173.582 174.218 -0.636 25342 2085 1 3 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.233 2.253 25342 2086 1 3 . 1 1 74 74 TYR CB C 74 34.808 34.808 37.349 -2.542 25342 2087 1 3 . 1 1 74 74 TYR H H 74 7.348 7.348 8.545 -1.197 25342 2088 1 3 . 1 1 75 75 ASN N N 75 109.447 109.447 122.036 -12.589 25342 2089 1 3 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.827 0.098 25342 2090 1 3 . 1 1 75 75 ASN C C 75 172.570 172.570 175.272 -2.702 25342 2091 1 3 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.529 -1.911 25342 2092 1 3 . 1 1 75 75 ASN CB C 75 35.534 35.534 40.385 -4.851 25342 2093 1 3 . 1 1 75 75 ASN H H 75 8.040 8.040 7.984 0.056 25342 2094 1 3 . 1 1 76 76 ASN N N 76 117.411 117.411 119.889 -2.478 25342 2095 1 3 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.452 0.002 25342 2096 1 3 . 1 1 76 76 ASN C C 76 171.155 171.155 175.012 -3.857 25342 2097 1 3 . 1 1 76 76 ASN CA C 76 50.934 50.934 54.093 -3.159 25342 2098 1 3 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.773 -3.115 25342 2099 1 3 . 1 1 76 76 ASN H H 76 7.750 7.750 7.901 -0.151 25342 2100 1 3 . 1 1 77 77 TYR N N 77 116.878 116.878 116.771 0.107 25342 2101 1 3 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.466 -0.112 25342 2102 1 3 . 1 1 77 77 TYR C C 77 172.224 172.224 175.410 -3.186 25342 2103 1 3 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.118 -2.878 25342 2104 1 3 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.514 -2.401 25342 2105 1 3 . 1 1 77 77 TYR H H 77 7.789 7.789 7.340 0.449 25342 2106 1 3 . 1 1 78 78 ASP N N 78 121.352 121.352 119.669 1.683 25342 2107 1 3 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.825 -0.028 25342 2108 1 3 . 1 1 78 78 ASP C C 78 172.623 172.623 175.177 -2.554 25342 2109 1 3 . 1 1 78 78 ASP CA C 78 53.190 53.190 54.627 -1.437 25342 2110 1 3 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.873 -2.838 25342 2111 1 3 . 1 1 78 78 ASP H H 78 9.036 9.036 8.800 0.236 25342 2112 1 3 . 1 1 79 79 LEU N N 79 123.073 123.073 119.383 3.690 25342 2113 1 3 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.420 -0.312 25342 2114 1 3 . 1 1 79 79 LEU C C 79 170.730 170.730 174.385 -3.655 25342 2115 1 3 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.044 -2.787 25342 2116 1 3 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.023 -3.739 25342 2117 1 3 . 1 1 79 79 LEU H H 79 7.877 7.877 7.953 -0.076 25342 2118 1 3 . 1 1 80 80 ILE N N 80 126.348 126.348 124.162 2.186 25342 2119 1 3 . 1 1 80 80 ILE HA H 80 5.069 5.069 5.057 0.012 25342 2120 1 3 . 1 1 80 80 ILE C C 80 171.584 171.584 174.190 -2.606 25342 2121 1 3 . 1 1 80 80 ILE CA C 80 57.415 57.415 59.967 -2.552 25342 2122 1 3 . 1 1 80 80 ILE CB C 80 37.998 37.998 41.522 -3.524 25342 2123 1 3 . 1 1 80 80 ILE H H 80 8.704 8.704 8.430 0.274 25342 2124 1 3 . 1 1 81 81 LEU N N 81 126.303 126.303 127.269 -0.966 25342 2125 1 3 . 1 1 81 81 LEU HA H 81 5.123 5.123 5.457 -0.334 25342 2126 1 3 . 1 1 81 81 LEU C C 81 172.779 172.779 175.501 -2.722 25342 2127 1 3 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.747 -4.238 25342 2128 1 3 . 1 1 81 81 LEU CB C 81 41.715 41.715 45.082 -3.367 25342 2129 1 3 . 1 1 81 81 LEU H H 81 9.202 9.202 8.592 0.610 25342 2130 1 3 . 1 1 82 82 ILE N N 82 120.931 120.931 122.356 -1.425 25342 2131 1 3 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.163 -0.316 25342 2132 1 3 . 1 1 82 82 ILE C C 82 172.796 172.796 174.719 -1.923 25342 2133 1 3 . 1 1 82 82 ILE CA C 82 56.881 56.881 60.157 -3.276 25342 2134 1 3 . 1 1 82 82 ILE CB C 82 37.797 37.797 41.783 -3.986 25342 2135 1 3 . 1 1 82 82 ILE H H 82 8.846 8.846 8.700 0.146 25342 2136 1 3 . 1 1 83 83 GLY N N 83 120.905 120.905 113.537 7.368 25342 2137 1 3 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.913 -2.356 25342 2138 1 3 . 1 1 83 83 GLY H H 83 9.558 9.558 8.086 1.472 25342 2139 1 3 . 1 1 84 84 SER N N 84 116.601 116.601 115.901 0.700 25342 2140 1 3 . 1 1 84 84 SER HA H 84 5.476 5.476 5.191 0.285 25342 2141 1 3 . 1 1 84 84 SER CA C 84 51.324 51.324 55.600 -4.276 25342 2142 1 3 . 1 1 84 84 SER CB C 84 64.271 64.271 64.433 -0.162 25342 2143 1 3 . 1 1 84 84 SER H H 84 7.533 7.533 7.758 -0.225 25342 2144 1 3 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.553 0.610 25342 2145 1 3 . 1 1 85 85 PRO C C 85 175.590 175.590 176.306 -0.716 25342 2146 1 3 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.752 -3.869 25342 2147 1 3 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.660 -2.186 25342 2148 1 3 . 1 1 86 86 VAL N N 86 116.295 116.295 117.207 -0.912 25342 2149 1 3 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.408 -0.587 25342 2150 1 3 . 1 1 86 86 VAL C C 86 172.692 172.692 175.913 -3.221 25342 2151 1 3 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.520 -1.708 25342 2152 1 3 . 1 1 86 86 VAL CB C 86 30.083 30.083 33.755 -3.671 25342 2153 1 3 . 1 1 86 86 VAL H H 86 7.246 7.246 7.878 -0.632 25342 2154 1 3 . 1 1 87 87 TRP N N 87 131.042 131.042 128.268 2.774 25342 2155 1 3 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.645 -0.334 25342 2156 1 3 . 1 1 87 87 TRP C C 87 173.323 173.323 177.868 -4.545 25342 2157 1 3 . 1 1 87 87 TRP CA C 87 50.887 50.887 57.145 -6.258 25342 2158 1 3 . 1 1 87 87 TRP CB C 87 27.310 27.310 30.910 -3.600 25342 2159 1 3 . 1 1 87 87 TRP H H 87 9.555 9.555 9.019 0.536 25342 2160 1 3 . 1 1 88 88 SER N N 88 122.660 122.660 115.709 6.951 25342 2161 1 3 . 1 1 88 88 SER HA H 88 4.582 4.582 4.165 0.417 25342 2162 1 3 . 1 1 88 88 SER C C 88 172.096 172.096 174.067 -1.971 25342 2163 1 3 . 1 1 88 88 SER CA C 88 55.391 55.391 59.660 -4.269 25342 2164 1 3 . 1 1 88 88 SER CB C 88 57.813 57.813 62.497 -4.684 25342 2165 1 3 . 1 1 88 88 SER H H 88 10.257 10.257 8.872 1.385 25342 2166 1 3 . 1 1 89 89 GLY N N 89 128.381 128.381 106.423 21.958 25342 2167 1 3 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.955 -2.326 25342 2168 1 3 . 1 1 89 89 GLY H H 89 6.372 6.372 7.769 -1.397 25342 2169 1 3 . 1 1 90 90 TYR N N 90 120.345 120.345 116.641 3.704 25342 2170 1 3 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.906 -0.717 25342 2171 1 3 . 1 1 90 90 TYR CA C 90 53.549 53.549 52.673 0.875 25342 2172 1 3 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.089 0.106 25342 2173 1 3 . 1 1 90 90 TYR H H 90 8.113 8.113 6.886 1.227 25342 2174 1 3 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.718 0.116 25342 2175 1 3 . 1 1 91 91 PRO C C 91 170.911 170.911 177.395 -6.484 25342 2176 1 3 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.533 -3.698 25342 2177 1 3 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.374 -6.304 25342 2178 1 3 . 1 1 92 92 ALA N N 92 120.629 120.629 125.252 -4.623 25342 2179 1 3 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.586 0.033 25342 2180 1 3 . 1 1 92 92 ALA C C 92 176.782 176.782 176.782 0.000 25342 2181 1 3 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.702 -1.285 25342 2182 1 3 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.043 -1.527 25342 2183 1 3 . 1 1 92 92 ALA H H 92 7.554 7.554 8.741 -1.187 25342 2184 1 3 . 1 1 93 93 THR N N 93 112.558 112.558 109.837 2.721 25342 2185 1 3 . 1 1 93 93 THR CB C 93 64.173 64.173 67.435 -3.262 25342 2186 1 3 . 1 1 93 93 THR H H 93 6.730 6.730 7.711 -0.981 25342 2187 1 3 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.561 -0.702 25342 2188 1 3 . 1 1 94 94 PRO C C 94 173.309 173.309 176.708 -3.399 25342 2189 1 3 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.017 -0.954 25342 2190 1 3 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.370 -3.091 25342 2191 1 3 . 1 1 95 95 ILE N N 95 111.014 111.014 117.078 -6.064 25342 2192 1 3 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.367 -0.762 25342 2193 1 3 . 1 1 95 95 ILE C C 95 174.302 174.302 177.301 -2.999 25342 2194 1 3 . 1 1 95 95 ILE CA C 95 57.181 57.181 60.044 -2.862 25342 2195 1 3 . 1 1 95 95 ILE CB C 95 31.783 31.783 37.662 -5.879 25342 2196 1 3 . 1 1 95 95 ILE H H 95 7.995 7.995 8.045 -0.050 25342 2197 1 3 . 1 1 96 96 LYS N N 96 123.208 123.208 122.705 0.503 25342 2198 1 3 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.033 -0.941 25342 2199 1 3 . 1 1 96 96 LYS C C 96 174.451 174.451 178.576 -4.125 25342 2200 1 3 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.723 -2.682 25342 2201 1 3 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.801 -3.054 25342 2202 1 3 . 1 1 96 96 LYS H H 96 6.928 6.928 8.171 -1.243 25342 2203 1 3 . 1 1 97 97 THR N N 97 113.320 113.320 114.756 -1.436 25342 2204 1 3 . 1 1 97 97 THR HA H 97 3.436 3.436 4.083 -0.647 25342 2205 1 3 . 1 1 97 97 THR C C 97 173.221 173.221 176.234 -3.013 25342 2206 1 3 . 1 1 97 97 THR CA C 97 62.710 62.710 66.057 -3.347 25342 2207 1 3 . 1 1 97 97 THR CB C 97 65.562 65.562 68.852 -3.290 25342 2208 1 3 . 1 1 97 97 THR H H 97 6.325 6.325 8.373 -2.048 25342 2209 1 3 . 1 1 98 98 LEU N N 98 120.963 120.963 121.690 -0.727 25342 2210 1 3 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.241 -0.616 25342 2211 1 3 . 1 1 98 98 LEU C C 98 174.713 174.713 178.246 -3.533 25342 2212 1 3 . 1 1 98 98 LEU CA C 98 55.514 55.514 56.714 -1.200 25342 2213 1 3 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.848 -2.120 25342 2214 1 3 . 1 1 98 98 LEU H H 98 7.536 7.536 7.473 0.063 25342 2215 1 3 . 1 1 99 99 LEU N N 99 118.859 118.859 120.724 -1.865 25342 2216 1 3 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.797 -0.125 25342 2217 1 3 . 1 1 99 99 LEU C C 99 177.458 177.458 179.299 -1.841 25342 2218 1 3 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.315 -3.170 25342 2219 1 3 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.536 -2.679 25342 2220 1 3 . 1 1 99 99 LEU H H 99 8.179 8.179 8.600 -0.421 25342 2221 1 3 . 1 1 100 100 ASP N N 100 118.703 118.703 118.486 0.217 25342 2222 1 3 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.359 -0.138 25342 2223 1 3 . 1 1 100 100 ASP C C 100 176.472 176.472 177.831 -1.359 25342 2224 1 3 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.424 -3.117 25342 2225 1 3 . 1 1 100 100 ASP CB C 100 37.358 37.358 41.034 -3.676 25342 2226 1 3 . 1 1 100 100 ASP H H 100 7.867 7.867 8.054 -0.187 25342 2227 1 3 . 1 1 101 101 GLN N N 101 117.829 117.829 115.181 2.648 25342 2228 1 3 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.492 -0.292 25342 2229 1 3 . 1 1 101 101 GLN C C 101 174.508 174.508 176.814 -2.306 25342 2230 1 3 . 1 1 101 101 GLN CA C 101 54.688 54.688 56.577 -1.889 25342 2231 1 3 . 1 1 101 101 GLN CB C 101 25.597 25.597 28.784 -3.187 25342 2232 1 3 . 1 1 101 101 GLN H H 101 7.597 7.597 7.464 0.133 25342 2233 1 3 . 1 1 102 102 MET N N 102 118.406 118.406 118.708 -0.302 25342 2234 1 3 . 1 1 102 102 MET HA H 102 3.864 3.864 4.788 -0.924 25342 2235 1 3 . 1 1 102 102 MET C C 102 172.820 172.820 176.537 -3.717 25342 2236 1 3 . 1 1 102 102 MET CA C 102 53.298 53.298 55.547 -2.249 25342 2237 1 3 . 1 1 102 102 MET CB C 102 31.207 31.207 33.298 -2.091 25342 2238 1 3 . 1 1 102 102 MET H H 102 7.434 7.434 7.582 -0.148 25342 2239 1 3 . 1 1 103 103 LYS N N 103 115.889 115.889 119.798 -3.909 25342 2240 1 3 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.132 -0.213 25342 2241 1 3 . 1 1 103 103 LYS C C 103 173.938 173.938 177.675 -3.737 25342 2242 1 3 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.643 -2.206 25342 2243 1 3 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.917 -2.654 25342 2244 1 3 . 1 1 103 103 LYS H H 103 6.881 6.881 8.094 -1.213 25342 2245 1 3 . 1 1 104 104 ASN N N 104 114.951 114.951 115.545 -0.594 25342 2246 1 3 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.854 -0.123 25342 2247 1 3 . 1 1 104 104 ASN C C 104 172.617 172.617 175.650 -3.033 25342 2248 1 3 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.331 -3.066 25342 2249 1 3 . 1 1 104 104 ASN CB C 104 35.783 35.783 39.120 -3.337 25342 2250 1 3 . 1 1 104 104 ASN H H 104 8.493 8.493 8.406 0.087 25342 2251 1 3 . 1 1 105 105 TYR N N 105 122.680 122.680 120.265 2.415 25342 2252 1 3 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.464 0.098 25342 2253 1 3 . 1 1 105 105 TYR CA C 105 55.433 55.433 57.361 -1.927 25342 2254 1 3 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.001 -3.169 25342 2255 1 3 . 1 1 105 105 TYR H H 105 8.217 8.217 8.036 0.181 25342 2256 1 3 . 1 1 106 106 ARG N N 106 128.872 128.872 121.648 7.224 25342 2257 1 3 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.152 0.113 25342 2258 1 3 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.177 -2.195 25342 2259 1 3 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.972 -3.842 25342 2260 1 3 . 1 1 106 106 ARG H H 106 8.801 8.801 8.851 -0.050 25342 2261 1 3 . 1 1 107 107 GLY CA C 107 42.401 42.401 45.386 -2.985 25342 2262 1 3 . 1 1 108 108 GLU N N 108 117.000 117.000 119.546 -2.546 25342 2263 1 3 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.844 -0.218 25342 2264 1 3 . 1 1 108 108 GLU C C 108 174.125 174.125 175.650 -1.525 25342 2265 1 3 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.351 -1.563 25342 2266 1 3 . 1 1 108 108 GLU CB C 108 30.440 30.440 32.615 -2.175 25342 2267 1 3 . 1 1 108 108 GLU H H 108 7.514 7.514 8.077 -0.563 25342 2268 1 3 . 1 1 109 109 VAL N N 109 123.398 123.398 122.087 1.311 25342 2269 1 3 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.908 0.429 25342 2270 1 3 . 1 1 109 109 VAL C C 109 170.606 170.606 174.703 -4.097 25342 2271 1 3 . 1 1 109 109 VAL CA C 109 57.280 57.280 61.147 -3.866 25342 2272 1 3 . 1 1 109 109 VAL CB C 109 32.657 32.657 32.426 0.231 25342 2273 1 3 . 1 1 109 109 VAL H H 109 8.942 8.942 8.708 0.234 25342 2274 1 3 . 1 1 110 110 ALA N N 110 127.905 127.905 128.654 -0.749 25342 2275 1 3 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.536 0.091 25342 2276 1 3 . 1 1 110 110 ALA C C 110 173.195 173.195 175.665 -2.470 25342 2277 1 3 . 1 1 110 110 ALA CA C 110 47.346 47.346 50.670 -3.324 25342 2278 1 3 . 1 1 110 110 ALA CB C 110 18.325 18.325 20.388 -2.063 25342 2279 1 3 . 1 1 110 110 ALA H H 110 8.776 8.776 7.988 0.788 25342 2280 1 3 . 1 1 111 111 SER N N 111 110.523 110.523 114.262 -3.739 25342 2281 1 3 . 1 1 111 111 SER HA H 111 5.562 5.562 5.333 0.229 25342 2282 1 3 . 1 1 111 111 SER C C 111 170.719 170.719 172.768 -2.049 25342 2283 1 3 . 1 1 111 111 SER CA C 111 51.314 51.314 56.807 -5.493 25342 2284 1 3 . 1 1 111 111 SER CB C 111 61.907 61.907 65.643 -3.736 25342 2285 1 3 . 1 1 111 111 SER H H 111 7.480 7.480 8.087 -0.607 25342 2286 1 3 . 1 1 112 112 PHE N N 112 125.567 125.567 119.803 5.764 25342 2287 1 3 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.715 0.641 25342 2288 1 3 . 1 1 112 112 PHE C C 112 169.536 169.536 174.329 -4.793 25342 2289 1 3 . 1 1 112 112 PHE CA C 112 50.371 50.371 56.439 -6.068 25342 2290 1 3 . 1 1 112 112 PHE CB C 112 39.788 39.788 42.905 -3.117 25342 2291 1 3 . 1 1 112 112 PHE H H 112 7.848 7.848 8.794 -0.946 25342 2292 1 3 . 1 1 113 113 PHE N N 113 115.065 115.065 118.184 -3.119 25342 2293 1 3 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.556 0.548 25342 2294 1 3 . 1 1 113 113 PHE C C 113 173.006 173.006 174.456 -1.450 25342 2295 1 3 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.430 -6.168 25342 2296 1 3 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.844 -5.095 25342 2297 1 3 . 1 1 113 113 PHE H H 113 7.361 7.361 8.530 -1.169 25342 2298 1 3 . 1 1 114 114 THR N N 114 108.014 108.014 111.831 -3.817 25342 2299 1 3 . 1 1 114 114 THR HA H 114 4.999 4.999 4.668 0.331 25342 2300 1 3 . 1 1 114 114 THR C C 114 169.874 169.874 172.776 -2.902 25342 2301 1 3 . 1 1 114 114 THR CA C 114 56.500 56.500 61.224 -4.724 25342 2302 1 3 . 1 1 114 114 THR CB C 114 68.809 68.809 71.707 -2.897 25342 2303 1 3 . 1 1 114 114 THR H H 114 7.867 7.867 8.543 -0.676 25342 2304 1 3 . 1 1 115 115 SER N N 115 115.049 115.049 117.700 -2.651 25342 2305 1 3 . 1 1 115 115 SER HA H 115 5.613 5.613 4.481 1.132 25342 2306 1 3 . 1 1 115 115 SER C C 115 171.247 171.247 174.394 -3.147 25342 2307 1 3 . 1 1 115 115 SER CA C 115 54.830 54.830 57.629 -2.799 25342 2308 1 3 . 1 1 115 115 SER CB C 115 63.992 63.992 65.338 -1.346 25342 2309 1 3 . 1 1 115 115 SER H H 115 8.970 8.970 8.255 0.715 25342 2310 1 3 . 1 1 116 116 ALA N N 116 122.671 122.671 124.188 -1.517 25342 2311 1 3 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.544 0.441 25342 2312 1 3 . 1 1 116 116 ALA C C 116 176.180 176.180 177.687 -1.507 25342 2313 1 3 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.044 -2.844 25342 2314 1 3 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.157 -2.162 25342 2315 1 3 . 1 1 116 116 ALA H H 116 8.963 8.963 8.668 0.295 25342 2316 1 3 . 1 1 117 117 GLY N N 117 107.387 107.387 107.169 0.218 25342 2317 1 3 . 1 1 117 117 GLY C C 117 172.528 172.528 174.646 -2.118 25342 2318 1 3 . 1 1 117 117 GLY CA C 117 43.732 43.732 44.904 -1.172 25342 2319 1 3 . 1 1 117 117 GLY H H 117 9.340 9.340 7.956 1.384 25342 2320 1 3 . 1 1 118 118 THR N N 118 113.481 113.481 110.126 3.355 25342 2321 1 3 . 1 1 118 118 THR HA H 118 4.651 4.651 4.425 0.226 25342 2322 1 3 . 1 1 118 118 THR C C 118 172.067 172.067 174.902 -2.835 25342 2323 1 3 . 1 1 118 118 THR CA C 118 57.357 57.357 61.071 -3.714 25342 2324 1 3 . 1 1 118 118 THR CB C 118 69.475 69.475 69.939 -0.464 25342 2325 1 3 . 1 1 118 118 THR H H 118 9.373 9.373 7.439 1.934 25342 2326 1 3 . 1 1 119 119 ASN N N 119 113.202 113.202 117.830 -4.628 25342 2327 1 3 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.399 0.219 25342 2328 1 3 . 1 1 119 119 ASN C C 119 173.114 173.114 175.637 -2.523 25342 2329 1 3 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.439 -2.755 25342 2330 1 3 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.290 -3.560 25342 2331 1 3 . 1 1 119 119 ASN H H 119 8.908 8.908 8.935 -0.027 25342 2332 1 3 . 1 1 120 120 HIS N N 120 117.315 117.315 115.340 1.975 25342 2333 1 3 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.505 -0.719 25342 2334 1 3 . 1 1 120 120 HIS C C 120 174.381 174.381 174.868 -0.487 25342 2335 1 3 . 1 1 120 120 HIS CA C 120 54.516 54.516 57.908 -3.392 25342 2336 1 3 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.694 -3.190 25342 2337 1 3 . 1 1 120 120 HIS H H 120 8.074 8.074 8.805 -0.731 25342 2338 1 3 . 1 1 121 121 LYS N N 121 118.678 118.678 119.111 -0.433 25342 2339 1 3 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.086 -0.252 25342 2340 1 3 . 1 1 121 121 LYS C C 121 176.564 176.564 177.766 -1.202 25342 2341 1 3 . 1 1 121 121 LYS CA C 121 57.295 57.295 57.012 0.283 25342 2342 1 3 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.281 -3.339 25342 2343 1 3 . 1 1 121 121 LYS H H 121 8.336 8.336 7.770 0.566 25342 2344 1 3 . 1 1 122 122 ALA N N 122 122.146 122.146 123.830 -1.684 25342 2345 1 3 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.019 -0.324 25342 2346 1 3 . 1 1 122 122 ALA C C 122 175.163 175.163 179.411 -4.248 25342 2347 1 3 . 1 1 122 122 ALA CA C 122 51.692 51.692 55.019 -3.327 25342 2348 1 3 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.310 -2.592 25342 2349 1 3 . 1 1 122 122 ALA H H 122 7.584 7.584 8.297 -0.713 25342 2350 1 3 . 1 1 123 123 TYR N N 123 119.730 119.730 117.601 2.129 25342 2351 1 3 . 1 1 123 123 TYR HA H 123 3.153 3.153 3.975 -0.822 25342 2352 1 3 . 1 1 123 123 TYR C C 123 174.340 174.340 177.546 -3.206 25342 2353 1 3 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.849 -0.451 25342 2354 1 3 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.300 -2.637 25342 2355 1 3 . 1 1 123 123 TYR H H 123 7.317 7.317 8.311 -0.994 25342 2356 1 3 . 1 1 124 124 VAL N N 124 118.649 118.649 119.113 -0.464 25342 2357 1 3 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.034 0.168 25342 2358 1 3 . 1 1 124 124 VAL C C 124 175.603 175.603 178.166 -2.563 25342 2359 1 3 . 1 1 124 124 VAL CA C 124 64.680 64.680 65.393 -0.713 25342 2360 1 3 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.191 -0.902 25342 2361 1 3 . 1 1 124 124 VAL H H 124 7.799 7.799 7.289 0.510 25342 2362 1 3 . 1 1 125 125 SER N N 125 114.475 114.475 114.906 -0.431 25342 2363 1 3 . 1 1 125 125 SER HA H 125 4.032 4.032 4.091 -0.059 25342 2364 1 3 . 1 1 125 125 SER C C 125 174.849 174.849 176.464 -1.615 25342 2365 1 3 . 1 1 125 125 SER CA C 125 59.002 59.002 61.706 -2.704 25342 2366 1 3 . 1 1 125 125 SER CB C 125 59.613 59.613 63.320 -3.707 25342 2367 1 3 . 1 1 125 125 SER H H 125 7.766 7.766 7.738 0.028 25342 2368 1 3 . 1 1 126 126 HIS N N 126 119.326 119.326 121.434 -2.108 25342 2369 1 3 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.571 -0.444 25342 2370 1 3 . 1 1 126 126 HIS C C 126 172.865 172.865 177.284 -4.419 25342 2371 1 3 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.090 -3.384 25342 2372 1 3 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.282 -4.289 25342 2373 1 3 . 1 1 126 126 HIS H H 126 8.569 8.569 8.451 0.118 25342 2374 1 3 . 1 1 127 127 PHE N N 127 121.044 121.044 121.598 -0.554 25342 2375 1 3 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.399 -1.225 25342 2376 1 3 . 1 1 127 127 PHE C C 127 173.378 173.378 176.878 -3.500 25342 2377 1 3 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.680 0.187 25342 2378 1 3 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.570 -3.516 25342 2379 1 3 . 1 1 127 127 PHE H H 127 9.139 9.139 8.141 0.998 25342 2380 1 3 . 1 1 128 128 ASN N N 128 114.893 114.893 119.031 -4.138 25342 2381 1 3 . 1 1 128 128 ASN HA H 128 4.040 4.040 3.937 0.103 25342 2382 1 3 . 1 1 128 128 ASN C C 128 175.230 175.230 177.249 -2.019 25342 2383 1 3 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.950 -2.650 25342 2384 1 3 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.222 -2.051 25342 2385 1 3 . 1 1 128 128 ASN H H 128 7.774 7.774 8.013 -0.239 25342 2386 1 3 . 1 1 129 129 GLU N N 129 119.804 119.804 118.962 0.842 25342 2387 1 3 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.850 0.190 25342 2388 1 3 . 1 1 129 129 GLU C C 129 177.052 177.052 178.088 -1.036 25342 2389 1 3 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.890 -2.160 25342 2390 1 3 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.345 -2.149 25342 2391 1 3 . 1 1 129 129 GLU H H 129 7.577 7.577 8.243 -0.666 25342 2392 1 3 . 1 1 130 130 TRP N N 130 120.979 120.979 116.157 4.822 25342 2393 1 3 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.536 -0.079 25342 2394 1 3 . 1 1 130 130 TRP C C 130 174.329 174.329 175.361 -1.032 25342 2395 1 3 . 1 1 130 130 TRP CA C 130 54.688 54.688 57.410 -2.722 25342 2396 1 3 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.800 -2.809 25342 2397 1 3 . 1 1 130 130 TRP H H 130 8.225 8.225 7.590 0.635 25342 2398 1 3 . 1 1 131 131 ALA N N 131 120.450 120.450 119.884 0.566 25342 2399 1 3 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.329 -0.393 25342 2400 1 3 . 1 1 131 131 ALA C C 131 172.487 172.487 175.588 -3.101 25342 2401 1 3 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.033 -2.599 25342 2402 1 3 . 1 1 131 131 ALA CB C 131 16.288 16.288 20.018 -3.730 25342 2403 1 3 . 1 1 131 131 ALA H H 131 8.081 8.081 7.210 0.871 25342 2404 1 3 . 1 1 132 132 ASP N N 132 117.813 117.813 119.578 -1.765 25342 2405 1 3 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.290 -0.082 25342 2406 1 3 . 1 1 132 132 ASP C C 132 173.804 173.804 176.804 -3.000 25342 2407 1 3 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.486 -1.305 25342 2408 1 3 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.900 -1.579 25342 2409 1 3 . 1 1 132 132 ASP H H 132 6.772 6.772 7.666 -0.894 25342 2410 1 3 . 1 1 133 133 GLY N N 133 115.052 115.052 112.478 2.574 25342 2411 1 3 . 1 1 133 133 GLY C C 133 172.078 172.078 173.495 -1.417 25342 2412 1 3 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.659 -2.239 25342 2413 1 3 . 1 1 133 133 GLY H H 133 8.626 8.626 8.241 0.385 25342 2414 1 3 . 1 1 134 134 LEU N N 134 120.063 120.063 120.665 -0.602 25342 2415 1 3 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.357 0.115 25342 2416 1 3 . 1 1 134 134 LEU C C 134 174.079 174.079 174.672 -0.593 25342 2417 1 3 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.513 -2.549 25342 2418 1 3 . 1 1 134 134 LEU CB C 134 40.370 40.370 43.845 -3.475 25342 2419 1 3 . 1 1 134 134 LEU H H 134 8.094 8.094 7.613 0.481 25342 2420 1 3 . 1 1 135 135 ASN N N 135 119.292 119.292 123.411 -4.119 25342 2421 1 3 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.707 -0.084 25342 2422 1 3 . 1 1 135 135 ASN C C 135 170.527 170.527 174.247 -3.720 25342 2423 1 3 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.269 -4.267 25342 2424 1 3 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.482 -4.922 25342 2425 1 3 . 1 1 135 135 ASN H H 135 8.513 8.513 8.549 -0.036 25342 2426 1 3 . 1 1 136 136 VAL N N 136 125.412 125.412 126.553 -1.141 25342 2427 1 3 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.370 0.236 25342 2428 1 3 . 1 1 136 136 VAL C C 136 175.420 175.420 175.849 -0.429 25342 2429 1 3 . 1 1 136 136 VAL CA C 136 58.382 58.382 60.300 -1.918 25342 2430 1 3 . 1 1 136 136 VAL CB C 136 29.247 29.247 32.486 -3.239 25342 2431 1 3 . 1 1 136 136 VAL H H 136 7.648 7.648 7.947 -0.299 25342 2432 1 3 . 1 1 137 137 ILE N N 137 121.881 121.881 121.288 0.593 25342 2433 1 3 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.077 0.356 25342 2434 1 3 . 1 1 137 137 ILE C C 137 173.906 173.906 175.243 -1.337 25342 2435 1 3 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.863 -2.885 25342 2436 1 3 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.041 -1.845 25342 2437 1 3 . 1 1 137 137 ILE H H 137 9.139 9.139 7.966 1.173 25342 2438 1 3 . 1 1 138 138 GLY N N 138 108.226 108.226 105.222 3.004 25342 2439 1 3 . 1 1 138 138 GLY CA C 138 43.391 43.391 44.576 -1.185 25342 2440 1 3 . 1 1 138 138 GLY H H 138 6.645 6.645 6.892 -0.247 25342 2441 1 3 . 1 1 139 139 VAL N N 139 119.408 119.408 119.859 -0.451 25342 2442 1 3 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.229 0.128 25342 2443 1 3 . 1 1 139 139 VAL C C 139 172.327 172.327 173.835 -1.508 25342 2444 1 3 . 1 1 139 139 VAL CA C 139 58.267 58.267 59.727 -1.460 25342 2445 1 3 . 1 1 139 139 VAL CB C 139 32.743 32.743 34.356 -1.613 25342 2446 1 3 . 1 1 139 139 VAL H H 139 8.092 8.092 8.516 -0.424 25342 2447 1 3 . 1 1 140 140 ALA N N 140 127.415 127.415 130.332 -2.917 25342 2448 1 3 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.205 -0.760 25342 2449 1 3 . 1 1 140 140 ALA C C 140 170.718 170.718 175.075 -4.357 25342 2450 1 3 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.144 -2.244 25342 2451 1 3 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.717 -1.658 25342 2452 1 3 . 1 1 140 140 ALA H H 140 9.093 9.093 8.670 0.423 25342 2453 1 3 . 1 1 141 141 ARG N N 141 119.287 119.287 118.150 1.137 25342 2454 1 3 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.431 -2.944 25342 2455 1 3 . 1 1 141 141 ARG C C 141 173.375 173.375 175.775 -2.400 25342 2456 1 3 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.792 -2.908 25342 2457 1 3 . 1 1 141 141 ARG CB C 141 28.684 28.684 32.330 -3.646 25342 2458 1 3 . 1 1 141 141 ARG H H 141 7.620 7.620 8.573 -0.953 25342 2459 1 3 . 1 1 142 142 ASP N N 142 125.999 125.999 118.069 7.930 25342 2460 1 3 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.325 -0.601 25342 2461 1 3 . 1 1 142 142 ASP C C 142 169.292 169.292 176.006 -6.714 25342 2462 1 3 . 1 1 142 142 ASP CA C 142 53.338 53.338 55.808 -2.470 25342 2463 1 3 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.995 -4.318 25342 2464 1 3 . 1 1 142 142 ASP H H 142 9.482 9.482 8.481 1.001 25342 2465 1 3 . 1 1 143 143 ASP N N 143 119.293 119.293 122.301 -3.008 25342 2466 1 3 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.715 -0.409 25342 2467 1 3 . 1 1 143 143 ASP C C 143 175.686 175.686 175.724 -0.038 25342 2468 1 3 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.968 -5.063 25342 2469 1 3 . 1 1 143 143 ASP CB C 143 36.312 36.312 39.289 -2.977 25342 2470 1 3 . 1 1 143 143 ASP H H 143 8.108 8.108 8.675 -0.567 25342 2471 1 3 . 1 1 144 144 SER N N 144 115.303 115.303 115.630 -0.327 25342 2472 1 3 . 1 1 144 144 SER HA H 144 3.740 3.740 4.578 -0.838 25342 2473 1 3 . 1 1 144 144 SER C C 144 172.925 172.925 174.889 -1.964 25342 2474 1 3 . 1 1 144 144 SER CA C 144 59.213 59.213 58.710 0.503 25342 2475 1 3 . 1 1 144 144 SER CB C 144 60.806 60.806 64.642 -3.836 25342 2476 1 3 . 1 1 144 144 SER H H 144 7.642 7.642 7.948 -0.306 25342 2477 1 3 . 1 1 145 145 GLU N N 145 119.523 119.523 120.012 -0.489 25342 2478 1 3 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.169 0.137 25342 2479 1 3 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.776 -3.737 25342 2480 1 3 . 1 1 145 145 GLU CB C 145 26.800 26.800 30.204 -3.404 25342 2481 1 3 . 1 1 145 145 GLU H H 145 7.771 7.771 8.102 -0.331 25342 2482 1 3 . 1 1 146 146 VAL N N 146 118.683 118.683 120.631 -1.948 25342 2483 1 3 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.739 -0.798 25342 2484 1 3 . 1 1 146 146 VAL C C 146 174.591 174.591 177.107 -2.516 25342 2485 1 3 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.379 -2.447 25342 2486 1 3 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.351 -2.304 25342 2487 1 3 . 1 1 146 146 VAL H H 146 6.352 6.352 7.900 -1.548 25342 2488 1 3 . 1 1 147 147 ASP N N 147 119.312 119.312 114.672 4.640 25342 2489 1 3 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.377 -0.322 25342 2490 1 3 . 1 1 147 147 ASP C C 147 174.783 174.783 176.322 -1.539 25342 2491 1 3 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.014 -1.773 25342 2492 1 3 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.540 -3.307 25342 2493 1 3 . 1 1 147 147 ASP H H 147 8.370 8.370 8.570 -0.200 25342 2494 1 3 . 1 1 148 148 LYS N N 148 119.342 119.342 115.042 4.300 25342 2495 1 3 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.482 -0.545 25342 2496 1 3 . 1 1 148 148 LYS C C 148 176.384 176.384 179.409 -3.025 25342 2497 1 3 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.240 -1.534 25342 2498 1 3 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.590 -3.079 25342 2499 1 3 . 1 1 148 148 LYS H H 148 7.040 7.040 7.505 -0.465 25342 2500 1 3 . 1 1 149 149 TRP N N 149 118.258 118.258 120.874 -2.616 25342 2501 1 3 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.767 -0.176 25342 2502 1 3 . 1 1 149 149 TRP C C 149 174.212 174.212 177.103 -2.891 25342 2503 1 3 . 1 1 149 149 TRP CA C 149 53.745 53.745 57.426 -3.681 25342 2504 1 3 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.982 -2.042 25342 2505 1 3 . 1 1 149 149 TRP H H 149 7.811 7.811 7.616 0.195 25342 2506 1 3 . 1 1 150 150 SER N N 150 109.618 109.618 110.964 -1.346 25342 2507 1 3 . 1 1 150 150 SER HA H 150 4.234 4.234 4.772 -0.538 25342 2508 1 3 . 1 1 150 150 SER C C 150 170.189 170.189 174.662 -4.473 25342 2509 1 3 . 1 1 150 150 SER CA C 150 56.695 56.695 57.626 -0.931 25342 2510 1 3 . 1 1 150 150 SER CB C 150 61.935 61.935 63.686 -1.751 25342 2511 1 3 . 1 1 150 150 SER H H 150 7.793 7.793 7.824 -0.031 25342 2512 1 4 . 1 1 3 3 ALA N N 3 125.638 125.638 119.757 5.881 25342 2513 1 4 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.464 -0.099 25342 2514 1 4 . 1 1 3 3 ALA CA C 3 49.298 49.298 51.624 -2.326 25342 2515 1 4 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.310 -2.451 25342 2516 1 4 . 1 1 3 3 ALA H H 3 8.325 8.325 7.926 0.399 25342 2517 1 4 . 1 1 4 4 LYS N N 4 121.813 121.813 119.606 2.207 25342 2518 1 4 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.663 -0.436 25342 2519 1 4 . 1 1 4 4 LYS C C 4 174.574 174.574 175.249 -0.675 25342 2520 1 4 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.075 -1.294 25342 2521 1 4 . 1 1 4 4 LYS CB C 4 31.490 31.490 33.533 -2.043 25342 2522 1 4 . 1 1 4 4 LYS H H 4 8.486 8.486 7.909 0.577 25342 2523 1 4 . 1 1 5 5 LYS N N 5 129.722 129.722 120.706 9.016 25342 2524 1 4 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.630 -0.112 25342 2525 1 4 . 1 1 5 5 LYS C C 5 174.720 174.720 174.756 -0.036 25342 2526 1 4 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.533 -0.812 25342 2527 1 4 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.334 -6.548 25342 2528 1 4 . 1 1 5 5 LYS H H 5 10.015 10.015 8.470 1.545 25342 2529 1 4 . 1 1 6 6 THR N N 6 126.254 126.254 117.391 8.863 25342 2530 1 4 . 1 1 6 6 THR HA H 6 5.654 5.654 5.255 0.399 25342 2531 1 4 . 1 1 6 6 THR C C 6 169.926 169.926 173.303 -3.377 25342 2532 1 4 . 1 1 6 6 THR CA C 6 60.598 60.598 61.574 -0.976 25342 2533 1 4 . 1 1 6 6 THR CB C 6 68.041 68.041 70.753 -2.712 25342 2534 1 4 . 1 1 6 6 THR H H 6 8.538 8.538 8.618 -0.080 25342 2535 1 4 . 1 1 7 7 LEU N N 7 130.775 130.775 128.390 2.385 25342 2536 1 4 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.522 0.072 25342 2537 1 4 . 1 1 7 7 LEU C C 7 170.404 170.404 174.365 -3.961 25342 2538 1 4 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.620 -3.687 25342 2539 1 4 . 1 1 7 7 LEU CB C 7 40.728 40.728 43.743 -3.015 25342 2540 1 4 . 1 1 7 7 LEU H H 7 8.575 8.575 8.287 0.288 25342 2541 1 4 . 1 1 8 8 ILE N N 8 127.242 127.242 121.523 5.719 25342 2542 1 4 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.593 0.255 25342 2543 1 4 . 1 1 8 8 ILE C C 8 170.936 170.936 174.387 -3.451 25342 2544 1 4 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.130 -2.878 25342 2545 1 4 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.371 -3.436 25342 2546 1 4 . 1 1 8 8 ILE H H 8 9.217 9.217 7.389 1.828 25342 2547 1 4 . 1 1 9 9 LEU N N 9 127.183 127.183 124.639 2.544 25342 2548 1 4 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.828 0.866 25342 2549 1 4 . 1 1 9 9 LEU C C 9 173.824 173.824 174.616 -0.792 25342 2550 1 4 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.536 -3.697 25342 2551 1 4 . 1 1 9 9 LEU CB C 9 43.963 43.963 46.055 -2.092 25342 2552 1 4 . 1 1 9 9 LEU H H 9 9.248 9.248 8.513 0.735 25342 2553 1 4 . 1 1 10 10 TYR N N 10 113.330 113.330 114.267 -0.937 25342 2554 1 4 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.141 0.373 25342 2555 1 4 . 1 1 10 10 TYR C C 10 167.898 167.898 173.423 -5.525 25342 2556 1 4 . 1 1 10 10 TYR CA C 10 52.875 52.875 55.254 -2.379 25342 2557 1 4 . 1 1 10 10 TYR CB C 10 38.436 38.436 39.935 -1.499 25342 2558 1 4 . 1 1 10 10 TYR H H 10 7.306 7.306 8.106 -0.800 25342 2559 1 4 . 1 1 11 11 TYR N N 11 121.297 121.297 122.217 -0.920 25342 2560 1 4 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.262 -0.500 25342 2561 1 4 . 1 1 11 11 TYR C C 11 169.698 169.698 175.421 -5.723 25342 2562 1 4 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.377 -1.330 25342 2563 1 4 . 1 1 11 11 TYR CB C 11 40.538 40.538 41.005 -0.467 25342 2564 1 4 . 1 1 11 11 TYR H H 11 7.891 7.891 8.087 -0.196 25342 2565 1 4 . 1 1 12 12 SER N N 12 117.763 117.763 122.868 -5.105 25342 2566 1 4 . 1 1 12 12 SER HA H 12 4.679 4.679 4.278 0.401 25342 2567 1 4 . 1 1 12 12 SER C C 12 170.075 170.075 173.966 -3.891 25342 2568 1 4 . 1 1 12 12 SER CA C 12 53.619 53.619 57.927 -4.308 25342 2569 1 4 . 1 1 12 12 SER CB C 12 62.847 62.847 63.949 -1.102 25342 2570 1 4 . 1 1 12 12 SER H H 12 7.557 7.557 8.657 -1.100 25342 2571 1 4 . 1 1 13 13 TRP N N 13 135.232 135.232 122.062 13.170 25342 2572 1 4 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.454 0.182 25342 2573 1 4 . 1 1 13 13 TRP C C 13 175.708 175.708 175.152 0.556 25342 2574 1 4 . 1 1 13 13 TRP CA C 13 58.116 58.116 58.129 -0.013 25342 2575 1 4 . 1 1 13 13 TRP CB C 13 27.635 27.635 30.477 -2.842 25342 2576 1 4 . 1 1 13 13 TRP H H 13 9.755 9.755 7.999 1.756 25342 2577 1 4 . 1 1 14 14 SER N N 14 113.789 113.789 115.815 -2.026 25342 2578 1 4 . 1 1 14 14 SER HA H 14 4.223 4.223 4.510 -0.287 25342 2579 1 4 . 1 1 14 14 SER C C 14 172.747 172.747 174.495 -1.748 25342 2580 1 4 . 1 1 14 14 SER CA C 14 53.828 53.828 57.898 -4.070 25342 2581 1 4 . 1 1 14 14 SER CB C 14 60.037 60.037 62.557 -2.521 25342 2582 1 4 . 1 1 14 14 SER H H 14 10.026 10.026 8.504 1.522 25342 2583 1 4 . 1 1 15 15 GLY N N 15 110.489 110.489 109.309 1.180 25342 2584 1 4 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.230 -0.571 25342 2585 1 4 . 1 1 15 15 GLY H H 15 7.391 7.391 8.515 -1.124 25342 2586 1 4 . 1 1 16 16 GLU N N 16 129.005 129.005 120.910 8.095 25342 2587 1 4 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.116 -0.053 25342 2588 1 4 . 1 1 16 16 GLU CA C 16 56.761 56.761 57.912 -1.151 25342 2589 1 4 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.880 -3.468 25342 2590 1 4 . 1 1 16 16 GLU H H 16 11.550 11.550 8.154 3.396 25342 2591 1 4 . 1 1 17 17 THR N N 17 123.016 123.016 114.678 8.338 25342 2592 1 4 . 1 1 17 17 THR HA H 17 4.035 4.035 3.947 0.088 25342 2593 1 4 . 1 1 17 17 THR C C 17 173.360 173.360 176.206 -2.846 25342 2594 1 4 . 1 1 17 17 THR CA C 17 64.303 64.303 65.876 -1.573 25342 2595 1 4 . 1 1 17 17 THR CB C 17 63.999 63.999 67.768 -3.769 25342 2596 1 4 . 1 1 17 17 THR H H 17 11.293 11.293 8.387 2.906 25342 2597 1 4 . 1 1 18 18 LYS N N 18 120.156 120.156 122.147 -1.991 25342 2598 1 4 . 1 1 18 18 LYS HA H 18 2.856 2.856 3.773 -0.917 25342 2599 1 4 . 1 1 18 18 LYS C C 18 173.901 173.901 178.106 -4.205 25342 2600 1 4 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.511 -2.677 25342 2601 1 4 . 1 1 18 18 LYS CB C 18 29.481 29.481 31.891 -2.410 25342 2602 1 4 . 1 1 18 18 LYS H H 18 6.940 6.940 8.151 -1.211 25342 2603 1 4 . 1 1 19 19 LYS N N 19 117.237 117.237 118.356 -1.119 25342 2604 1 4 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.026 -0.103 25342 2605 1 4 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.585 -2.261 25342 2606 1 4 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.084 -2.723 25342 2607 1 4 . 1 1 19 19 LYS H H 19 7.212 7.212 7.818 -0.606 25342 2608 1 4 . 1 1 20 20 MET N N 20 119.268 119.268 117.256 2.012 25342 2609 1 4 . 1 1 20 20 MET HA H 20 4.413 4.413 4.192 0.221 25342 2610 1 4 . 1 1 20 20 MET C C 20 173.625 173.625 177.388 -3.763 25342 2611 1 4 . 1 1 20 20 MET CA C 20 52.261 52.261 56.784 -4.523 25342 2612 1 4 . 1 1 20 20 MET CB C 20 26.680 26.680 32.075 -5.395 25342 2613 1 4 . 1 1 20 20 MET H H 20 7.600 7.600 7.556 0.044 25342 2614 1 4 . 1 1 21 21 ALA N N 21 123.669 123.669 121.625 2.044 25342 2615 1 4 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.669 -0.187 25342 2616 1 4 . 1 1 21 21 ALA C C 21 176.628 176.628 179.427 -2.799 25342 2617 1 4 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.035 -2.661 25342 2618 1 4 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.576 -1.081 25342 2619 1 4 . 1 1 21 21 ALA H H 21 8.738 8.738 7.224 1.514 25342 2620 1 4 . 1 1 22 22 GLU N N 22 117.242 117.242 117.979 -0.737 25342 2621 1 4 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.955 -0.282 25342 2622 1 4 . 1 1 22 22 GLU C C 22 176.698 176.698 179.332 -2.634 25342 2623 1 4 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.049 -2.509 25342 2624 1 4 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.392 -2.958 25342 2625 1 4 . 1 1 22 22 GLU H H 22 7.959 7.959 7.782 0.177 25342 2626 1 4 . 1 1 23 23 LYS N N 23 123.302 123.302 119.800 3.502 25342 2627 1 4 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.047 -0.226 25342 2628 1 4 . 1 1 23 23 LYS C C 23 177.389 177.389 179.199 -1.810 25342 2629 1 4 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.257 -2.335 25342 2630 1 4 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.443 -2.929 25342 2631 1 4 . 1 1 23 23 LYS H H 23 7.703 7.703 7.369 0.334 25342 2632 1 4 . 1 1 24 24 ILE N N 24 122.208 122.208 119.576 2.632 25342 2633 1 4 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.622 -0.339 25342 2634 1 4 . 1 1 24 24 ILE C C 24 174.934 174.934 178.088 -3.154 25342 2635 1 4 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.324 -2.032 25342 2636 1 4 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.793 -3.055 25342 2637 1 4 . 1 1 24 24 ILE H H 24 8.535 8.535 7.887 0.648 25342 2638 1 4 . 1 1 25 25 ASN N N 25 118.640 118.640 117.700 0.940 25342 2639 1 4 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.432 -0.205 25342 2640 1 4 . 1 1 25 25 ASN C C 25 173.530 173.530 177.507 -3.977 25342 2641 1 4 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.309 -4.098 25342 2642 1 4 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.626 -0.521 25342 2643 1 4 . 1 1 25 25 ASN H H 25 8.317 8.317 8.465 -0.148 25342 2644 1 4 . 1 1 26 26 SER N N 26 111.990 111.990 114.180 -2.190 25342 2645 1 4 . 1 1 26 26 SER HA H 26 4.153 4.153 4.371 -0.218 25342 2646 1 4 . 1 1 26 26 SER C C 26 172.110 172.110 175.272 -3.162 25342 2647 1 4 . 1 1 26 26 SER CA C 26 57.905 57.905 60.097 -2.192 25342 2648 1 4 . 1 1 26 26 SER CB C 26 60.655 60.655 63.074 -2.419 25342 2649 1 4 . 1 1 26 26 SER H H 26 7.369 7.369 7.839 -0.470 25342 2650 1 4 . 1 1 27 27 GLU N N 27 120.201 120.201 119.708 0.493 25342 2651 1 4 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.383 -0.282 25342 2652 1 4 . 1 1 27 27 GLU C C 27 173.673 173.673 175.801 -2.128 25342 2653 1 4 . 1 1 27 27 GLU CA C 27 54.235 54.235 55.735 -1.500 25342 2654 1 4 . 1 1 27 27 GLU CB C 27 26.601 26.601 29.763 -3.162 25342 2655 1 4 . 1 1 27 27 GLU H H 27 7.451 7.451 7.658 -0.207 25342 2656 1 4 . 1 1 28 28 ILE N N 28 118.762 118.762 117.518 1.244 25342 2657 1 4 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.280 -0.081 25342 2658 1 4 . 1 1 28 28 ILE C C 28 172.487 172.487 175.551 -3.064 25342 2659 1 4 . 1 1 28 28 ILE CA C 28 57.732 57.732 59.619 -1.887 25342 2660 1 4 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.764 -5.026 25342 2661 1 4 . 1 1 28 28 ILE H H 28 7.255 7.255 7.235 0.020 25342 2662 1 4 . 1 1 29 29 LYS N N 29 130.563 130.563 122.077 8.486 25342 2663 1 4 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.198 -0.196 25342 2664 1 4 . 1 1 29 29 LYS C C 29 174.386 174.386 177.777 -3.391 25342 2665 1 4 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.933 -1.398 25342 2666 1 4 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.981 -3.396 25342 2667 1 4 . 1 1 29 29 LYS H H 29 8.564 8.564 8.706 -0.142 25342 2668 1 4 . 1 1 30 30 ASP N N 30 119.357 119.357 118.149 1.208 25342 2669 1 4 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.458 -0.056 25342 2670 1 4 . 1 1 30 30 ASP C C 30 172.570 172.570 175.637 -3.067 25342 2671 1 4 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.417 -0.981 25342 2672 1 4 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.016 -2.272 25342 2673 1 4 . 1 1 30 30 ASP H H 30 8.920 8.920 8.643 0.277 25342 2674 1 4 . 1 1 31 31 SER N N 31 114.019 114.019 116.431 -2.412 25342 2675 1 4 . 1 1 31 31 SER HA H 31 4.782 4.782 4.463 0.319 25342 2676 1 4 . 1 1 31 31 SER C C 31 171.150 171.150 175.167 -4.017 25342 2677 1 4 . 1 1 31 31 SER CA C 31 55.551 55.551 59.418 -3.867 25342 2678 1 4 . 1 1 31 31 SER CB C 31 62.259 62.259 63.962 -1.704 25342 2679 1 4 . 1 1 31 31 SER H H 31 8.006 8.006 8.007 -0.001 25342 2680 1 4 . 1 1 32 32 GLU N N 32 121.455 121.455 122.184 -0.729 25342 2681 1 4 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.264 0.476 25342 2682 1 4 . 1 1 32 32 GLU C C 32 171.185 171.185 175.691 -4.506 25342 2683 1 4 . 1 1 32 32 GLU CA C 32 52.081 52.081 56.860 -4.779 25342 2684 1 4 . 1 1 32 32 GLU CB C 32 30.827 30.827 30.624 0.203 25342 2685 1 4 . 1 1 32 32 GLU H H 32 8.145 8.145 8.326 -0.181 25342 2686 1 4 . 1 1 33 33 LEU N N 33 126.176 126.176 121.608 4.568 25342 2687 1 4 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.532 0.774 25342 2688 1 4 . 1 1 33 33 LEU C C 33 173.365 173.365 175.354 -1.989 25342 2689 1 4 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.673 -3.233 25342 2690 1 4 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.737 -0.102 25342 2691 1 4 . 1 1 33 33 LEU H H 33 8.589 8.589 8.448 0.141 25342 2692 1 4 . 1 1 34 34 LYS N N 34 127.200 127.200 125.581 1.619 25342 2693 1 4 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.883 -0.287 25342 2694 1 4 . 1 1 34 34 LYS C C 34 169.622 169.622 174.910 -5.288 25342 2695 1 4 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.268 -1.939 25342 2696 1 4 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.102 -1.902 25342 2697 1 4 . 1 1 34 34 LYS H H 34 9.380 9.380 8.574 0.806 25342 2698 1 4 . 1 1 35 35 GLU N N 35 122.324 122.324 119.389 2.935 25342 2699 1 4 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.293 -1.960 25342 2700 1 4 . 1 1 35 35 GLU C C 35 172.734 172.734 175.752 -3.018 25342 2701 1 4 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.813 -2.201 25342 2702 1 4 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.470 -3.151 25342 2703 1 4 . 1 1 35 35 GLU H H 35 8.094 8.094 8.460 -0.366 25342 2704 1 4 . 1 1 36 36 VAL N N 36 126.781 126.781 120.176 6.605 25342 2705 1 4 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.457 -0.618 25342 2706 1 4 . 1 1 36 36 VAL C C 36 171.482 171.482 175.652 -4.170 25342 2707 1 4 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.486 -1.081 25342 2708 1 4 . 1 1 36 36 VAL CB C 36 29.348 29.348 33.678 -4.330 25342 2709 1 4 . 1 1 36 36 VAL H H 36 8.660 8.660 8.991 -0.331 25342 2710 1 4 . 1 1 37 37 LYS N N 37 126.065 126.065 120.523 5.542 25342 2711 1 4 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.423 0.542 25342 2712 1 4 . 1 1 37 37 LYS C C 37 173.187 173.187 175.135 -1.948 25342 2713 1 4 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.939 -2.659 25342 2714 1 4 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.224 -2.303 25342 2715 1 4 . 1 1 37 37 LYS H H 37 7.809 7.809 8.285 -0.476 25342 2716 1 4 . 1 1 38 38 VAL N N 38 111.020 111.020 113.563 -2.543 25342 2717 1 4 . 1 1 38 38 VAL HA H 38 4.824 4.824 5.099 -0.275 25342 2718 1 4 . 1 1 38 38 VAL C C 38 173.604 173.604 175.310 -1.706 25342 2719 1 4 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.179 -2.796 25342 2720 1 4 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.879 -2.503 25342 2721 1 4 . 1 1 38 38 VAL H H 38 8.305 8.305 8.038 0.267 25342 2722 1 4 . 1 1 39 39 SER N N 39 117.887 117.887 116.388 1.499 25342 2723 1 4 . 1 1 39 39 SER HA H 39 4.183 4.183 4.486 -0.303 25342 2724 1 4 . 1 1 39 39 SER C C 39 173.538 173.538 174.418 -0.880 25342 2725 1 4 . 1 1 39 39 SER CA C 39 56.279 56.279 58.687 -2.408 25342 2726 1 4 . 1 1 39 39 SER CB C 39 60.537 60.537 64.195 -3.658 25342 2727 1 4 . 1 1 39 39 SER H H 39 8.847 8.847 8.227 0.620 25342 2728 1 4 . 1 1 40 40 GLU N N 40 126.316 126.316 122.724 3.592 25342 2729 1 4 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.167 -0.013 25342 2730 1 4 . 1 1 40 40 GLU C C 40 174.586 174.586 176.857 -2.271 25342 2731 1 4 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.914 -2.102 25342 2732 1 4 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.717 -2.997 25342 2733 1 4 . 1 1 40 40 GLU H H 40 9.049 9.049 8.703 0.346 25342 2734 1 4 . 1 1 41 41 GLY N N 41 112.494 112.494 113.367 -0.873 25342 2735 1 4 . 1 1 41 41 GLY C C 41 171.994 171.994 175.375 -3.381 25342 2736 1 4 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.684 -3.222 25342 2737 1 4 . 1 1 41 41 GLY H H 41 8.780 8.780 8.876 -0.096 25342 2738 1 4 . 1 1 42 42 THR N N 42 118.631 118.631 115.231 3.400 25342 2739 1 4 . 1 1 42 42 THR HA H 42 3.582 3.582 3.715 -0.133 25342 2740 1 4 . 1 1 42 42 THR C C 42 171.225 171.225 173.066 -1.841 25342 2741 1 4 . 1 1 42 42 THR CA C 42 64.104 64.104 64.552 -0.448 25342 2742 1 4 . 1 1 42 42 THR CB C 42 65.914 65.914 69.148 -3.234 25342 2743 1 4 . 1 1 42 42 THR H H 42 7.737 7.737 7.514 0.223 25342 2744 1 4 . 1 1 43 43 PHE N N 43 116.279 116.279 114.173 2.106 25342 2745 1 4 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.588 0.432 25342 2746 1 4 . 1 1 43 43 PHE C C 43 170.141 170.141 174.131 -3.990 25342 2747 1 4 . 1 1 43 43 PHE CA C 43 52.472 52.472 57.003 -4.531 25342 2748 1 4 . 1 1 43 43 PHE CB C 43 37.385 37.385 42.033 -4.648 25342 2749 1 4 . 1 1 43 43 PHE H H 43 8.114 8.114 7.441 0.673 25342 2750 1 4 . 1 1 44 44 ASP N N 44 121.513 121.513 121.514 -0.001 25342 2751 1 4 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.782 0.069 25342 2752 1 4 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.404 -3.192 25342 2753 1 4 . 1 1 44 44 ASP CB C 44 44.385 44.385 41.736 2.649 25342 2754 1 4 . 1 1 44 44 ASP H H 44 7.774 7.774 8.878 -1.104 25342 2755 1 4 . 1 1 45 45 ALA N N 45 125.663 125.663 121.934 3.729 25342 2756 1 4 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.381 -0.170 25342 2757 1 4 . 1 1 45 45 ALA C C 45 175.139 175.139 176.949 -1.810 25342 2758 1 4 . 1 1 45 45 ALA CA C 45 51.436 51.436 53.175 -1.739 25342 2759 1 4 . 1 1 45 45 ALA CB C 45 16.232 16.232 17.925 -1.693 25342 2760 1 4 . 1 1 45 45 ALA H H 45 8.324 8.324 8.236 0.088 25342 2761 1 4 . 1 1 46 46 ASP N N 46 119.288 119.288 118.270 1.018 25342 2762 1 4 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.579 0.246 25342 2763 1 4 . 1 1 46 46 ASP C C 46 175.013 175.013 177.337 -2.324 25342 2764 1 4 . 1 1 46 46 ASP CA C 46 51.161 51.161 54.600 -3.439 25342 2765 1 4 . 1 1 46 46 ASP CB C 46 41.233 41.233 41.053 0.180 25342 2766 1 4 . 1 1 46 46 ASP H H 46 9.618 9.618 8.465 1.153 25342 2767 1 4 . 1 1 47 47 MET N N 47 127.347 127.347 118.803 8.544 25342 2768 1 4 . 1 1 47 47 MET HA H 47 3.456 3.456 4.830 -1.374 25342 2769 1 4 . 1 1 47 47 MET C C 47 173.605 173.605 177.733 -4.128 25342 2770 1 4 . 1 1 47 47 MET CA C 47 56.699 56.699 59.103 -2.404 25342 2771 1 4 . 1 1 47 47 MET CB C 47 29.930 29.930 33.733 -3.803 25342 2772 1 4 . 1 1 47 47 MET H H 47 9.178 9.178 8.315 0.863 25342 2773 1 4 . 1 1 48 48 TYR N N 48 121.040 121.040 118.039 3.001 25342 2774 1 4 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.357 -0.485 25342 2775 1 4 . 1 1 48 48 TYR CA C 48 58.712 58.712 60.302 -1.590 25342 2776 1 4 . 1 1 48 48 TYR CB C 48 33.638 33.638 36.909 -3.271 25342 2777 1 4 . 1 1 48 48 TYR H H 48 7.881 7.881 8.098 -0.217 25342 2778 1 4 . 1 1 49 49 LYS N N 49 121.754 121.754 119.633 2.121 25342 2779 1 4 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.118 -0.013 25342 2780 1 4 . 1 1 49 49 LYS CA C 49 56.385 56.385 58.994 -2.609 25342 2781 1 4 . 1 1 49 49 LYS CB C 49 29.164 29.164 31.843 -2.679 25342 2782 1 4 . 1 1 49 49 LYS H H 49 8.365 8.365 7.270 1.095 25342 2783 1 4 . 1 1 50 50 THR N N 50 117.557 117.557 111.327 6.230 25342 2784 1 4 . 1 1 50 50 THR HA H 50 3.586 3.586 4.091 -0.505 25342 2785 1 4 . 1 1 50 50 THR CA C 50 65.634 65.634 65.117 0.517 25342 2786 1 4 . 1 1 50 50 THR CB C 50 65.904 65.904 67.400 -1.496 25342 2787 1 4 . 1 1 50 50 THR H H 50 8.007 8.007 8.062 -0.055 25342 2788 1 4 . 1 1 51 51 SER N N 51 115.110 115.110 117.832 -2.722 25342 2789 1 4 . 1 1 51 51 SER HA H 51 3.974 3.974 4.146 -0.172 25342 2790 1 4 . 1 1 51 51 SER CA C 51 59.042 59.042 62.274 -3.232 25342 2791 1 4 . 1 1 51 51 SER CB C 51 59.835 59.835 63.142 -3.307 25342 2792 1 4 . 1 1 51 51 SER H H 51 7.606 7.606 8.236 -0.630 25342 2793 1 4 . 1 1 52 52 ASP N N 52 119.713 119.713 120.601 -0.888 25342 2794 1 4 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.651 -0.343 25342 2795 1 4 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.454 -1.928 25342 2796 1 4 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.376 -3.688 25342 2797 1 4 . 1 1 52 52 ASP H H 52 7.552 7.552 7.787 -0.235 25342 2798 1 4 . 1 1 53 53 ILE N N 53 121.982 121.982 120.306 1.676 25342 2799 1 4 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.622 0.100 25342 2800 1 4 . 1 1 53 53 ILE C C 53 175.325 175.325 178.012 -2.687 25342 2801 1 4 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.400 -2.856 25342 2802 1 4 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.983 -1.284 25342 2803 1 4 . 1 1 53 53 ILE H H 53 7.815 7.815 7.412 0.403 25342 2804 1 4 . 1 1 54 54 ALA N N 54 121.552 121.552 121.750 -0.198 25342 2805 1 4 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.379 -0.062 25342 2806 1 4 . 1 1 54 54 ALA C C 54 177.475 177.475 179.632 -2.157 25342 2807 1 4 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.858 -2.837 25342 2808 1 4 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.563 -2.579 25342 2809 1 4 . 1 1 54 54 ALA H H 54 8.332 8.332 7.730 0.602 25342 2810 1 4 . 1 1 55 55 LEU N N 55 117.176 117.176 119.904 -2.728 25342 2811 1 4 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.048 -0.114 25342 2812 1 4 . 1 1 55 55 LEU C C 55 176.532 176.532 178.332 -1.800 25342 2813 1 4 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.801 -2.470 25342 2814 1 4 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.015 -2.587 25342 2815 1 4 . 1 1 55 55 LEU H H 55 8.195 8.195 7.954 0.241 25342 2816 1 4 . 1 1 56 56 ASP N N 56 120.056 120.056 118.504 1.552 25342 2817 1 4 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.313 0.154 25342 2818 1 4 . 1 1 56 56 ASP C C 56 176.585 176.585 178.546 -1.961 25342 2819 1 4 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.368 -2.818 25342 2820 1 4 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.775 -2.470 25342 2821 1 4 . 1 1 56 56 ASP H H 56 7.806 7.806 7.941 -0.135 25342 2822 1 4 . 1 1 57 57 GLN N N 57 120.020 120.020 118.984 1.036 25342 2823 1 4 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.185 -0.062 25342 2824 1 4 . 1 1 57 57 GLN C C 57 175.689 175.689 178.759 -3.070 25342 2825 1 4 . 1 1 57 57 GLN CA C 57 54.405 54.405 58.453 -4.048 25342 2826 1 4 . 1 1 57 57 GLN CB C 57 23.769 23.769 29.100 -5.331 25342 2827 1 4 . 1 1 57 57 GLN H H 57 7.661 7.661 7.564 0.097 25342 2828 1 4 . 1 1 58 58 ILE N N 58 120.644 120.644 120.429 0.215 25342 2829 1 4 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.195 -0.619 25342 2830 1 4 . 1 1 58 58 ILE C C 58 176.237 176.237 178.440 -2.203 25342 2831 1 4 . 1 1 58 58 ILE CA C 58 62.506 62.506 64.692 -2.186 25342 2832 1 4 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.263 -2.234 25342 2833 1 4 . 1 1 58 58 ILE H H 58 8.228 8.228 8.578 -0.350 25342 2834 1 4 . 1 1 59 59 GLN N N 59 115.498 115.498 118.014 -2.516 25342 2835 1 4 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.259 -0.117 25342 2836 1 4 . 1 1 59 59 GLN C C 59 173.781 173.781 176.526 -2.745 25342 2837 1 4 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.746 -2.764 25342 2838 1 4 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.323 -2.712 25342 2839 1 4 . 1 1 59 59 GLN H H 59 8.331 8.331 8.164 0.167 25342 2840 1 4 . 1 1 60 60 GLY N N 60 106.623 106.623 105.894 0.729 25342 2841 1 4 . 1 1 60 60 GLY C C 60 172.068 172.068 174.993 -2.925 25342 2842 1 4 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.185 -2.312 25342 2843 1 4 . 1 1 60 60 GLY H H 60 7.611 7.611 7.695 -0.084 25342 2844 1 4 . 1 1 61 61 ASN N N 61 117.691 117.691 118.421 -0.730 25342 2845 1 4 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.679 -0.135 25342 2846 1 4 . 1 1 61 61 ASN C C 61 171.946 171.946 176.131 -4.185 25342 2847 1 4 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.108 -2.539 25342 2848 1 4 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.001 -2.641 25342 2849 1 4 . 1 1 61 61 ASN H H 61 8.151 8.151 8.276 -0.125 25342 2850 1 4 . 1 1 62 62 LYS N N 62 118.289 118.289 119.990 -1.701 25342 2851 1 4 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.481 -0.153 25342 2852 1 4 . 1 1 62 62 LYS C C 62 171.773 171.773 174.675 -2.902 25342 2853 1 4 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.502 -3.206 25342 2854 1 4 . 1 1 62 62 LYS CB C 62 34.683 34.683 34.126 0.557 25342 2855 1 4 . 1 1 62 62 LYS H H 62 7.242 7.242 7.752 -0.510 25342 2856 1 4 . 1 1 63 63 ASP N N 63 119.888 119.888 117.930 1.958 25342 2857 1 4 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.683 -0.267 25342 2858 1 4 . 1 1 63 63 ASP C C 63 174.476 174.476 175.669 -1.193 25342 2859 1 4 . 1 1 63 63 ASP CA C 63 51.461 51.461 52.977 -1.516 25342 2860 1 4 . 1 1 63 63 ASP CB C 63 38.515 38.515 43.935 -5.420 25342 2861 1 4 . 1 1 63 63 ASP H H 63 8.230 8.230 8.376 -0.146 25342 2862 1 4 . 1 1 64 64 PHE N N 64 119.789 119.789 116.818 2.971 25342 2863 1 4 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.764 -0.948 25342 2864 1 4 . 1 1 64 64 PHE CA C 64 56.250 56.250 53.771 2.479 25342 2865 1 4 . 1 1 64 64 PHE CB C 64 35.034 35.034 37.889 -2.854 25342 2866 1 4 . 1 1 64 64 PHE H H 64 8.428 8.428 7.640 0.788 25342 2867 1 4 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.506 -0.193 25342 2868 1 4 . 1 1 65 65 PRO C C 65 173.975 173.975 176.186 -2.211 25342 2869 1 4 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.617 -2.561 25342 2870 1 4 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.675 -3.155 25342 2871 1 4 . 1 1 66 66 GLU N N 66 121.326 121.326 119.761 1.565 25342 2872 1 4 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.452 -0.219 25342 2873 1 4 . 1 1 66 66 GLU C C 66 173.978 173.978 175.956 -1.978 25342 2874 1 4 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.660 -3.129 25342 2875 1 4 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.134 -3.433 25342 2876 1 4 . 1 1 66 66 GLU H H 66 8.225 8.225 8.605 -0.380 25342 2877 1 4 . 1 1 67 67 ILE N N 67 113.897 113.897 117.309 -3.412 25342 2878 1 4 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.346 0.823 25342 2879 1 4 . 1 1 67 67 ILE C C 67 172.791 172.791 176.042 -3.251 25342 2880 1 4 . 1 1 67 67 ILE CA C 67 56.275 56.275 60.129 -3.854 25342 2881 1 4 . 1 1 67 67 ILE CB C 67 39.016 39.016 39.426 -0.410 25342 2882 1 4 . 1 1 67 67 ILE H H 67 8.366 8.366 8.373 -0.007 25342 2883 1 4 . 1 1 68 68 GLN N N 68 121.654 121.654 122.016 -0.362 25342 2884 1 4 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.509 0.010 25342 2885 1 4 . 1 1 68 68 GLN C C 68 171.562 171.562 174.403 -2.841 25342 2886 1 4 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.573 -2.260 25342 2887 1 4 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.472 -1.687 25342 2888 1 4 . 1 1 68 68 GLN H H 68 8.763 8.763 8.562 0.201 25342 2889 1 4 . 1 1 69 69 LEU N N 69 125.289 125.289 122.008 3.281 25342 2890 1 4 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.606 -0.087 25342 2891 1 4 . 1 1 69 69 LEU C C 69 172.567 172.567 176.486 -3.919 25342 2892 1 4 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.530 -2.733 25342 2893 1 4 . 1 1 69 69 LEU CB C 69 42.742 42.742 43.022 -0.280 25342 2894 1 4 . 1 1 69 69 LEU H H 69 7.996 7.996 7.613 0.383 25342 2895 1 4 . 1 1 70 70 ASP N N 70 123.170 123.170 125.075 -1.905 25342 2896 1 4 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.575 -0.169 25342 2897 1 4 . 1 1 70 70 ASP C C 70 171.978 171.978 175.860 -3.882 25342 2898 1 4 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.385 -2.703 25342 2899 1 4 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.957 -3.228 25342 2900 1 4 . 1 1 70 70 ASP H H 70 8.278 8.278 8.426 -0.148 25342 2901 1 4 . 1 1 71 71 ASN N N 71 117.524 117.524 118.634 -1.110 25342 2902 1 4 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.688 -0.361 25342 2903 1 4 . 1 1 71 71 ASN C C 71 171.825 171.825 174.358 -2.533 25342 2904 1 4 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.382 -1.725 25342 2905 1 4 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.372 -3.142 25342 2906 1 4 . 1 1 71 71 ASN H H 71 8.372 8.372 8.434 -0.062 25342 2907 1 4 . 1 1 72 72 ILE N N 72 124.515 124.515 124.570 -0.055 25342 2908 1 4 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.098 -0.169 25342 2909 1 4 . 1 1 72 72 ILE C C 72 171.607 171.607 174.318 -2.711 25342 2910 1 4 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.182 -2.893 25342 2911 1 4 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.197 -2.438 25342 2912 1 4 . 1 1 72 72 ILE H H 72 7.653 7.653 8.042 -0.389 25342 2913 1 4 . 1 1 73 73 ASP N N 73 125.182 125.182 127.353 -2.171 25342 2914 1 4 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.448 0.180 25342 2915 1 4 . 1 1 73 73 ASP C C 73 173.980 173.980 175.579 -1.599 25342 2916 1 4 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.318 -5.104 25342 2917 1 4 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.344 -4.442 25342 2918 1 4 . 1 1 73 73 ASP H H 73 8.382 8.382 8.472 -0.090 25342 2919 1 4 . 1 1 74 74 TYR N N 74 123.092 123.092 123.019 0.073 25342 2920 1 4 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.710 -0.845 25342 2921 1 4 . 1 1 74 74 TYR C C 74 173.582 173.582 176.556 -2.974 25342 2922 1 4 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.815 1.671 25342 2923 1 4 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.480 -3.672 25342 2924 1 4 . 1 1 74 74 TYR H H 74 7.348 7.348 8.432 -1.084 25342 2925 1 4 . 1 1 75 75 ASN N N 75 109.447 109.447 118.106 -8.659 25342 2926 1 4 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.863 0.062 25342 2927 1 4 . 1 1 75 75 ASN C C 75 172.570 172.570 176.265 -3.695 25342 2928 1 4 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.072 -2.454 25342 2929 1 4 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.621 -3.087 25342 2930 1 4 . 1 1 75 75 ASN H H 75 8.040 8.040 8.290 -0.250 25342 2931 1 4 . 1 1 76 76 ASN N N 76 117.411 117.411 115.720 1.691 25342 2932 1 4 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.670 -0.216 25342 2933 1 4 . 1 1 76 76 ASN C C 76 171.155 171.155 173.693 -2.538 25342 2934 1 4 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.065 -2.131 25342 2935 1 4 . 1 1 76 76 ASN CB C 76 35.658 35.658 37.051 -1.393 25342 2936 1 4 . 1 1 76 76 ASN H H 76 7.750 7.750 8.630 -0.880 25342 2937 1 4 . 1 1 77 77 TYR N N 77 116.878 116.878 118.147 -1.269 25342 2938 1 4 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.730 -0.376 25342 2939 1 4 . 1 1 77 77 TYR C C 77 172.224 172.224 174.711 -2.487 25342 2940 1 4 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.557 -2.317 25342 2941 1 4 . 1 1 77 77 TYR CB C 77 37.113 37.113 42.057 -4.944 25342 2942 1 4 . 1 1 77 77 TYR H H 77 7.789 7.789 7.532 0.257 25342 2943 1 4 . 1 1 78 78 ASP N N 78 121.352 121.352 119.479 1.873 25342 2944 1 4 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.859 -0.062 25342 2945 1 4 . 1 1 78 78 ASP C C 78 172.623 172.623 175.879 -3.256 25342 2946 1 4 . 1 1 78 78 ASP CA C 78 53.190 53.190 54.167 -0.977 25342 2947 1 4 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.767 -2.732 25342 2948 1 4 . 1 1 78 78 ASP H H 78 9.036 9.036 8.394 0.642 25342 2949 1 4 . 1 1 79 79 LEU N N 79 123.073 123.073 119.748 3.325 25342 2950 1 4 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.228 -0.120 25342 2951 1 4 . 1 1 79 79 LEU C C 79 170.730 170.730 175.105 -4.375 25342 2952 1 4 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.998 -2.741 25342 2953 1 4 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.062 -3.778 25342 2954 1 4 . 1 1 79 79 LEU H H 79 7.877 7.877 8.337 -0.460 25342 2955 1 4 . 1 1 80 80 ILE N N 80 126.348 126.348 121.841 4.507 25342 2956 1 4 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.577 0.492 25342 2957 1 4 . 1 1 80 80 ILE C C 80 171.584 171.584 174.591 -3.007 25342 2958 1 4 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.282 -2.867 25342 2959 1 4 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.024 -2.026 25342 2960 1 4 . 1 1 80 80 ILE H H 80 8.704 8.704 8.898 -0.194 25342 2961 1 4 . 1 1 81 81 LEU N N 81 126.303 126.303 128.407 -2.104 25342 2962 1 4 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.350 0.773 25342 2963 1 4 . 1 1 81 81 LEU C C 81 172.779 172.779 175.276 -2.497 25342 2964 1 4 . 1 1 81 81 LEU CA C 81 49.509 49.509 55.408 -5.899 25342 2965 1 4 . 1 1 81 81 LEU CB C 81 41.715 41.715 42.771 -1.056 25342 2966 1 4 . 1 1 81 81 LEU H H 81 9.202 9.202 8.393 0.809 25342 2967 1 4 . 1 1 82 82 ILE N N 82 120.931 120.931 123.865 -2.934 25342 2968 1 4 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.696 0.151 25342 2969 1 4 . 1 1 82 82 ILE C C 82 172.796 172.796 174.491 -1.695 25342 2970 1 4 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.922 -3.041 25342 2971 1 4 . 1 1 82 82 ILE CB C 82 37.797 37.797 40.996 -3.199 25342 2972 1 4 . 1 1 82 82 ILE H H 82 8.846 8.846 8.510 0.336 25342 2973 1 4 . 1 1 83 83 GLY N N 83 120.905 120.905 113.232 7.673 25342 2974 1 4 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.531 -1.974 25342 2975 1 4 . 1 1 83 83 GLY H H 83 9.558 9.558 8.609 0.949 25342 2976 1 4 . 1 1 84 84 SER N N 84 116.601 116.601 112.110 4.491 25342 2977 1 4 . 1 1 84 84 SER HA H 84 5.476 5.476 4.854 0.622 25342 2978 1 4 . 1 1 84 84 SER CA C 84 51.324 51.324 56.238 -4.914 25342 2979 1 4 . 1 1 84 84 SER CB C 84 64.271 64.271 64.214 0.057 25342 2980 1 4 . 1 1 84 84 SER H H 84 7.533 7.533 7.533 -0.000 25342 2981 1 4 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.481 0.682 25342 2982 1 4 . 1 1 85 85 PRO C C 85 175.590 175.590 175.806 -0.216 25342 2983 1 4 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.411 -3.529 25342 2984 1 4 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.627 -2.153 25342 2985 1 4 . 1 1 86 86 VAL N N 86 116.295 116.295 117.921 -1.626 25342 2986 1 4 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.415 -0.594 25342 2987 1 4 . 1 1 86 86 VAL C C 86 172.692 172.692 175.293 -2.601 25342 2988 1 4 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.231 -1.419 25342 2989 1 4 . 1 1 86 86 VAL CB C 86 30.083 30.083 34.818 -4.735 25342 2990 1 4 . 1 1 86 86 VAL H H 86 7.246 7.246 7.992 -0.746 25342 2991 1 4 . 1 1 87 87 TRP N N 87 131.042 131.042 126.684 4.358 25342 2992 1 4 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.582 -0.271 25342 2993 1 4 . 1 1 87 87 TRP C C 87 173.323 173.323 176.231 -2.908 25342 2994 1 4 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.918 -5.031 25342 2995 1 4 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.910 -4.600 25342 2996 1 4 . 1 1 87 87 TRP H H 87 9.555 9.555 8.384 1.171 25342 2997 1 4 . 1 1 88 88 SER N N 88 122.660 122.660 116.122 6.538 25342 2998 1 4 . 1 1 88 88 SER HA H 88 4.582 4.582 4.226 0.356 25342 2999 1 4 . 1 1 88 88 SER C C 88 172.096 172.096 175.871 -3.775 25342 3000 1 4 . 1 1 88 88 SER CA C 88 55.391 55.391 60.414 -5.023 25342 3001 1 4 . 1 1 88 88 SER CB C 88 57.813 57.813 61.736 -3.923 25342 3002 1 4 . 1 1 88 88 SER H H 88 10.257 10.257 8.948 1.309 25342 3003 1 4 . 1 1 89 89 GLY N N 89 128.381 128.381 113.600 14.781 25342 3004 1 4 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.869 -3.240 25342 3005 1 4 . 1 1 89 89 GLY H H 89 6.372 6.372 8.404 -2.032 25342 3006 1 4 . 1 1 90 90 TYR N N 90 120.345 120.345 119.110 1.235 25342 3007 1 4 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.674 -0.485 25342 3008 1 4 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.533 -0.984 25342 3009 1 4 . 1 1 90 90 TYR CB C 90 37.195 37.195 39.696 -2.501 25342 3010 1 4 . 1 1 90 90 TYR H H 90 8.113 8.113 7.513 0.600 25342 3011 1 4 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.485 0.349 25342 3012 1 4 . 1 1 91 91 PRO C C 91 170.911 170.911 176.137 -5.226 25342 3013 1 4 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.469 -3.634 25342 3014 1 4 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.570 -6.500 25342 3015 1 4 . 1 1 92 92 ALA N N 92 120.629 120.629 120.628 0.001 25342 3016 1 4 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.909 -0.290 25342 3017 1 4 . 1 1 92 92 ALA C C 92 176.782 176.782 176.963 -0.181 25342 3018 1 4 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.920 -2.503 25342 3019 1 4 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.732 -2.216 25342 3020 1 4 . 1 1 92 92 ALA H H 92 7.554 7.554 8.382 -0.828 25342 3021 1 4 . 1 1 93 93 THR N N 93 112.558 112.558 111.899 0.659 25342 3022 1 4 . 1 1 93 93 THR CB C 93 64.173 64.173 67.882 -3.709 25342 3023 1 4 . 1 1 93 93 THR H H 93 6.730 6.730 7.738 -1.008 25342 3024 1 4 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.347 -0.488 25342 3025 1 4 . 1 1 94 94 PRO C C 94 173.309 173.309 178.157 -4.848 25342 3026 1 4 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.978 -1.915 25342 3027 1 4 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.227 -2.948 25342 3028 1 4 . 1 1 95 95 ILE N N 95 111.014 111.014 116.234 -5.220 25342 3029 1 4 . 1 1 95 95 ILE HA H 95 3.605 3.605 3.937 -0.332 25342 3030 1 4 . 1 1 95 95 ILE C C 95 174.302 174.302 177.325 -3.023 25342 3031 1 4 . 1 1 95 95 ILE CA C 95 57.181 57.181 60.758 -3.576 25342 3032 1 4 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.519 -4.736 25342 3033 1 4 . 1 1 95 95 ILE H H 95 7.995 7.995 8.143 -0.148 25342 3034 1 4 . 1 1 96 96 LYS N N 96 123.208 123.208 121.928 1.280 25342 3035 1 4 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.896 -0.804 25342 3036 1 4 . 1 1 96 96 LYS C C 96 174.451 174.451 178.255 -3.804 25342 3037 1 4 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.983 -2.942 25342 3038 1 4 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.736 -2.989 25342 3039 1 4 . 1 1 96 96 LYS H H 96 6.928 6.928 8.257 -1.329 25342 3040 1 4 . 1 1 97 97 THR N N 97 113.320 113.320 115.235 -1.915 25342 3041 1 4 . 1 1 97 97 THR HA H 97 3.436 3.436 3.081 0.355 25342 3042 1 4 . 1 1 97 97 THR C C 97 173.221 173.221 176.328 -3.107 25342 3043 1 4 . 1 1 97 97 THR CA C 97 62.710 62.710 65.475 -2.765 25342 3044 1 4 . 1 1 97 97 THR CB C 97 65.562 65.562 68.320 -2.758 25342 3045 1 4 . 1 1 97 97 THR H H 97 6.325 6.325 7.661 -1.336 25342 3046 1 4 . 1 1 98 98 LEU N N 98 120.963 120.963 122.162 -1.199 25342 3047 1 4 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.038 -0.413 25342 3048 1 4 . 1 1 98 98 LEU C C 98 174.713 174.713 177.727 -3.014 25342 3049 1 4 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.815 -2.301 25342 3050 1 4 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.629 -1.901 25342 3051 1 4 . 1 1 98 98 LEU H H 98 7.536 7.536 7.581 -0.045 25342 3052 1 4 . 1 1 99 99 LEU N N 99 118.859 118.859 118.813 0.046 25342 3053 1 4 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.851 -0.179 25342 3054 1 4 . 1 1 99 99 LEU C C 99 177.458 177.458 178.411 -0.953 25342 3055 1 4 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.320 -3.175 25342 3056 1 4 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.103 -2.246 25342 3057 1 4 . 1 1 99 99 LEU H H 99 8.179 8.179 8.174 0.005 25342 3058 1 4 . 1 1 100 100 ASP N N 100 118.703 118.703 118.342 0.361 25342 3059 1 4 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.256 -0.035 25342 3060 1 4 . 1 1 100 100 ASP C C 100 176.472 176.472 178.868 -2.396 25342 3061 1 4 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.321 -3.014 25342 3062 1 4 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.831 -3.473 25342 3063 1 4 . 1 1 100 100 ASP H H 100 7.867 7.867 7.834 0.033 25342 3064 1 4 . 1 1 101 101 GLN N N 101 117.829 117.829 118.227 -0.398 25342 3065 1 4 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.102 0.098 25342 3066 1 4 . 1 1 101 101 GLN C C 101 174.508 174.508 178.670 -4.162 25342 3067 1 4 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.545 -3.857 25342 3068 1 4 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.204 -3.607 25342 3069 1 4 . 1 1 101 101 GLN H H 101 7.597 7.597 7.591 0.006 25342 3070 1 4 . 1 1 102 102 MET N N 102 118.406 118.406 115.357 3.049 25342 3071 1 4 . 1 1 102 102 MET HA H 102 3.864 3.864 4.654 -0.790 25342 3072 1 4 . 1 1 102 102 MET C C 102 172.820 172.820 177.451 -4.631 25342 3073 1 4 . 1 1 102 102 MET CA C 102 53.298 53.298 56.573 -3.275 25342 3074 1 4 . 1 1 102 102 MET CB C 102 31.207 31.207 31.753 -0.546 25342 3075 1 4 . 1 1 102 102 MET H H 102 7.434 7.434 8.033 -0.599 25342 3076 1 4 . 1 1 103 103 LYS N N 103 115.889 115.889 120.769 -4.880 25342 3077 1 4 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.948 -0.029 25342 3078 1 4 . 1 1 103 103 LYS C C 103 173.938 173.938 177.605 -3.667 25342 3079 1 4 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.454 -3.017 25342 3080 1 4 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.495 -2.232 25342 3081 1 4 . 1 1 103 103 LYS H H 103 6.881 6.881 7.660 -0.779 25342 3082 1 4 . 1 1 104 104 ASN N N 104 114.951 114.951 114.629 0.322 25342 3083 1 4 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.650 0.081 25342 3084 1 4 . 1 1 104 104 ASN C C 104 172.617 172.617 175.506 -2.889 25342 3085 1 4 . 1 1 104 104 ASN CA C 104 50.266 50.266 54.002 -3.736 25342 3086 1 4 . 1 1 104 104 ASN CB C 104 35.783 35.783 39.290 -3.507 25342 3087 1 4 . 1 1 104 104 ASN H H 104 8.493 8.493 8.105 0.388 25342 3088 1 4 . 1 1 105 105 TYR N N 105 122.680 122.680 123.009 -0.329 25342 3089 1 4 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.321 0.241 25342 3090 1 4 . 1 1 105 105 TYR CA C 105 55.433 55.433 59.470 -4.037 25342 3091 1 4 . 1 1 105 105 TYR CB C 105 35.832 35.832 38.961 -3.129 25342 3092 1 4 . 1 1 105 105 TYR H H 105 8.217 8.217 8.079 0.138 25342 3093 1 4 . 1 1 106 106 ARG N N 106 128.872 128.872 125.683 3.189 25342 3094 1 4 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.348 -0.083 25342 3095 1 4 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.786 -1.804 25342 3096 1 4 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.725 -4.595 25342 3097 1 4 . 1 1 106 106 ARG H H 106 8.801 8.801 7.829 0.972 25342 3098 1 4 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.545 -2.144 25342 3099 1 4 . 1 1 108 108 GLU N N 108 117.000 117.000 122.138 -5.138 25342 3100 1 4 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.754 -0.128 25342 3101 1 4 . 1 1 108 108 GLU C C 108 174.125 174.125 175.333 -1.208 25342 3102 1 4 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.570 -1.782 25342 3103 1 4 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.539 -1.099 25342 3104 1 4 . 1 1 108 108 GLU H H 108 7.514 7.514 8.440 -0.926 25342 3105 1 4 . 1 1 109 109 VAL N N 109 123.398 123.398 125.877 -2.479 25342 3106 1 4 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.772 0.565 25342 3107 1 4 . 1 1 109 109 VAL C C 109 170.606 170.606 174.709 -4.103 25342 3108 1 4 . 1 1 109 109 VAL CA C 109 57.280 57.280 59.893 -2.613 25342 3109 1 4 . 1 1 109 109 VAL CB C 109 32.657 32.657 32.391 0.266 25342 3110 1 4 . 1 1 109 109 VAL H H 109 8.942 8.942 7.856 1.086 25342 3111 1 4 . 1 1 110 110 ALA N N 110 127.905 127.905 130.190 -2.285 25342 3112 1 4 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.551 0.076 25342 3113 1 4 . 1 1 110 110 ALA C C 110 173.195 173.195 176.282 -3.087 25342 3114 1 4 . 1 1 110 110 ALA CA C 110 47.346 47.346 50.184 -2.838 25342 3115 1 4 . 1 1 110 110 ALA CB C 110 18.325 18.325 19.563 -1.238 25342 3116 1 4 . 1 1 110 110 ALA H H 110 8.776 8.776 8.417 0.359 25342 3117 1 4 . 1 1 111 111 SER N N 111 110.523 110.523 115.462 -4.939 25342 3118 1 4 . 1 1 111 111 SER HA H 111 5.562 5.562 5.545 0.017 25342 3119 1 4 . 1 1 111 111 SER C C 111 170.719 170.719 173.518 -2.799 25342 3120 1 4 . 1 1 111 111 SER CA C 111 51.314 51.314 55.831 -4.517 25342 3121 1 4 . 1 1 111 111 SER CB C 111 61.907 61.907 64.677 -2.770 25342 3122 1 4 . 1 1 111 111 SER H H 111 7.480 7.480 7.958 -0.478 25342 3123 1 4 . 1 1 112 112 PHE N N 112 125.567 125.567 119.137 6.430 25342 3124 1 4 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.944 0.412 25342 3125 1 4 . 1 1 112 112 PHE C C 112 169.536 169.536 172.995 -3.459 25342 3126 1 4 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.806 -5.436 25342 3127 1 4 . 1 1 112 112 PHE CB C 112 39.788 39.788 42.296 -2.508 25342 3128 1 4 . 1 1 112 112 PHE H H 112 7.848 7.848 7.832 0.016 25342 3129 1 4 . 1 1 113 113 PHE N N 113 115.065 115.065 115.637 -0.572 25342 3130 1 4 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.321 0.783 25342 3131 1 4 . 1 1 113 113 PHE C C 113 173.006 173.006 174.877 -1.871 25342 3132 1 4 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.646 -6.384 25342 3133 1 4 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.432 -4.683 25342 3134 1 4 . 1 1 113 113 PHE H H 113 7.361 7.361 8.276 -0.915 25342 3135 1 4 . 1 1 114 114 THR N N 114 108.014 108.014 113.622 -5.608 25342 3136 1 4 . 1 1 114 114 THR HA H 114 4.999 4.999 4.837 0.162 25342 3137 1 4 . 1 1 114 114 THR C C 114 169.874 169.874 174.221 -4.347 25342 3138 1 4 . 1 1 114 114 THR CA C 114 56.500 56.500 60.827 -4.327 25342 3139 1 4 . 1 1 114 114 THR CB C 114 68.809 68.809 68.112 0.696 25342 3140 1 4 . 1 1 114 114 THR H H 114 7.867 7.867 8.733 -0.866 25342 3141 1 4 . 1 1 115 115 SER N N 115 115.049 115.049 119.151 -4.102 25342 3142 1 4 . 1 1 115 115 SER HA H 115 5.613 5.613 4.329 1.284 25342 3143 1 4 . 1 1 115 115 SER C C 115 171.247 171.247 174.913 -3.666 25342 3144 1 4 . 1 1 115 115 SER CA C 115 54.830 54.830 57.592 -2.762 25342 3145 1 4 . 1 1 115 115 SER CB C 115 63.992 63.992 64.113 -0.121 25342 3146 1 4 . 1 1 115 115 SER H H 115 8.970 8.970 7.839 1.131 25342 3147 1 4 . 1 1 116 116 ALA N N 116 122.671 122.671 122.387 0.284 25342 3148 1 4 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.274 0.711 25342 3149 1 4 . 1 1 116 116 ALA C C 116 176.180 176.180 177.848 -1.668 25342 3150 1 4 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.349 -3.149 25342 3151 1 4 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.515 -2.520 25342 3152 1 4 . 1 1 116 116 ALA H H 116 8.963 8.963 8.385 0.578 25342 3153 1 4 . 1 1 117 117 GLY N N 117 107.387 107.387 106.281 1.106 25342 3154 1 4 . 1 1 117 117 GLY C C 117 172.528 172.528 174.561 -2.033 25342 3155 1 4 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.271 -1.539 25342 3156 1 4 . 1 1 117 117 GLY H H 117 9.340 9.340 8.345 0.995 25342 3157 1 4 . 1 1 118 118 THR N N 118 113.481 113.481 110.507 2.974 25342 3158 1 4 . 1 1 118 118 THR HA H 118 4.651 4.651 4.565 0.086 25342 3159 1 4 . 1 1 118 118 THR C C 118 172.067 172.067 174.078 -2.011 25342 3160 1 4 . 1 1 118 118 THR CA C 118 57.357 57.357 59.797 -2.440 25342 3161 1 4 . 1 1 118 118 THR CB C 118 69.475 69.475 70.871 -1.396 25342 3162 1 4 . 1 1 118 118 THR H H 118 9.373 9.373 7.388 1.985 25342 3163 1 4 . 1 1 119 119 ASN N N 119 113.202 113.202 117.816 -4.614 25342 3164 1 4 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.301 0.317 25342 3165 1 4 . 1 1 119 119 ASN C C 119 173.114 173.114 175.960 -2.846 25342 3166 1 4 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.072 -2.389 25342 3167 1 4 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.121 -3.391 25342 3168 1 4 . 1 1 119 119 ASN H H 119 8.908 8.908 8.966 -0.058 25342 3169 1 4 . 1 1 120 120 HIS N N 120 117.315 117.315 115.822 1.493 25342 3170 1 4 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.526 -0.740 25342 3171 1 4 . 1 1 120 120 HIS C C 120 174.381 174.381 176.711 -2.330 25342 3172 1 4 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.585 -4.069 25342 3173 1 4 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.934 -3.430 25342 3174 1 4 . 1 1 120 120 HIS H H 120 8.074 8.074 8.523 -0.449 25342 3175 1 4 . 1 1 121 121 LYS N N 121 118.678 118.678 120.024 -1.346 25342 3176 1 4 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.982 -0.148 25342 3177 1 4 . 1 1 121 121 LYS C C 121 176.564 176.564 178.920 -2.356 25342 3178 1 4 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.220 -0.925 25342 3179 1 4 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.605 -2.663 25342 3180 1 4 . 1 1 121 121 LYS H H 121 8.336 8.336 8.083 0.253 25342 3181 1 4 . 1 1 122 122 ALA N N 122 122.146 122.146 121.066 1.080 25342 3182 1 4 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.201 -0.506 25342 3183 1 4 . 1 1 122 122 ALA C C 122 175.163 175.163 179.289 -4.126 25342 3184 1 4 . 1 1 122 122 ALA CA C 122 51.692 51.692 55.003 -3.311 25342 3185 1 4 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.966 -2.248 25342 3186 1 4 . 1 1 122 122 ALA H H 122 7.584 7.584 8.184 -0.600 25342 3187 1 4 . 1 1 123 123 TYR N N 123 119.730 119.730 117.731 1.999 25342 3188 1 4 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.069 -0.916 25342 3189 1 4 . 1 1 123 123 TYR C C 123 174.340 174.340 177.421 -3.081 25342 3190 1 4 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.120 0.278 25342 3191 1 4 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.199 -2.536 25342 3192 1 4 . 1 1 123 123 TYR H H 123 7.317 7.317 7.526 -0.209 25342 3193 1 4 . 1 1 124 124 VAL N N 124 118.649 118.649 119.373 -0.724 25342 3194 1 4 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.287 -0.085 25342 3195 1 4 . 1 1 124 124 VAL C C 124 175.603 175.603 177.893 -2.290 25342 3196 1 4 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.286 -1.606 25342 3197 1 4 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.958 -1.669 25342 3198 1 4 . 1 1 124 124 VAL H H 124 7.799 7.799 6.773 1.026 25342 3199 1 4 . 1 1 125 125 SER N N 125 114.475 114.475 115.317 -0.842 25342 3200 1 4 . 1 1 125 125 SER HA H 125 4.032 4.032 4.115 -0.083 25342 3201 1 4 . 1 1 125 125 SER C C 125 174.849 174.849 176.453 -1.604 25342 3202 1 4 . 1 1 125 125 SER CA C 125 59.002 59.002 61.769 -2.767 25342 3203 1 4 . 1 1 125 125 SER CB C 125 59.613 59.613 63.157 -3.544 25342 3204 1 4 . 1 1 125 125 SER H H 125 7.766 7.766 7.668 0.098 25342 3205 1 4 . 1 1 126 126 HIS N N 126 119.326 119.326 121.559 -2.233 25342 3206 1 4 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.259 -0.132 25342 3207 1 4 . 1 1 126 126 HIS C C 126 172.865 172.865 177.386 -4.521 25342 3208 1 4 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.660 -3.954 25342 3209 1 4 . 1 1 126 126 HIS CB C 126 25.993 25.993 29.823 -3.830 25342 3210 1 4 . 1 1 126 126 HIS H H 126 8.569 8.569 8.425 0.144 25342 3211 1 4 . 1 1 127 127 PHE N N 127 121.044 121.044 120.424 0.620 25342 3212 1 4 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.252 -1.078 25342 3213 1 4 . 1 1 127 127 PHE C C 127 173.378 173.378 177.514 -4.136 25342 3214 1 4 . 1 1 127 127 PHE CA C 127 60.867 60.867 62.145 -1.278 25342 3215 1 4 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.266 -3.212 25342 3216 1 4 . 1 1 127 127 PHE H H 127 9.139 9.139 8.253 0.886 25342 3217 1 4 . 1 1 128 128 ASN N N 128 114.893 114.893 117.177 -2.284 25342 3218 1 4 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.524 -0.484 25342 3219 1 4 . 1 1 128 128 ASN C C 128 175.230 175.230 178.304 -3.074 25342 3220 1 4 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.331 -2.031 25342 3221 1 4 . 1 1 128 128 ASN CB C 128 36.171 36.171 37.866 -1.695 25342 3222 1 4 . 1 1 128 128 ASN H H 128 7.774 7.774 8.013 -0.239 25342 3223 1 4 . 1 1 129 129 GLU N N 129 119.804 119.804 119.645 0.159 25342 3224 1 4 . 1 1 129 129 GLU HA H 129 4.040 4.040 4.085 -0.045 25342 3225 1 4 . 1 1 129 129 GLU C C 129 177.052 177.052 177.850 -0.798 25342 3226 1 4 . 1 1 129 129 GLU CA C 129 56.730 56.730 59.146 -2.416 25342 3227 1 4 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.692 -2.496 25342 3228 1 4 . 1 1 129 129 GLU H H 129 7.577 7.577 7.936 -0.359 25342 3229 1 4 . 1 1 130 130 TRP N N 130 120.979 120.979 117.586 3.393 25342 3230 1 4 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.473 -0.016 25342 3231 1 4 . 1 1 130 130 TRP C C 130 174.329 174.329 175.070 -0.741 25342 3232 1 4 . 1 1 130 130 TRP CA C 130 54.688 54.688 57.297 -2.610 25342 3233 1 4 . 1 1 130 130 TRP CB C 130 26.991 26.991 28.764 -1.773 25342 3234 1 4 . 1 1 130 130 TRP H H 130 8.225 8.225 7.687 0.538 25342 3235 1 4 . 1 1 131 131 ALA N N 131 120.450 120.450 119.558 0.892 25342 3236 1 4 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.279 -0.343 25342 3237 1 4 . 1 1 131 131 ALA C C 131 172.487 172.487 175.877 -3.390 25342 3238 1 4 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.658 -3.224 25342 3239 1 4 . 1 1 131 131 ALA CB C 131 16.288 16.288 20.492 -4.204 25342 3240 1 4 . 1 1 131 131 ALA H H 131 8.081 8.081 7.660 0.421 25342 3241 1 4 . 1 1 132 132 ASP N N 132 117.813 117.813 120.630 -2.817 25342 3242 1 4 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.482 -0.274 25342 3243 1 4 . 1 1 132 132 ASP C C 132 173.804 173.804 176.540 -2.736 25342 3244 1 4 . 1 1 132 132 ASP CA C 132 54.181 54.181 56.045 -1.864 25342 3245 1 4 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.283 -0.962 25342 3246 1 4 . 1 1 132 132 ASP H H 132 6.772 6.772 7.828 -1.056 25342 3247 1 4 . 1 1 133 133 GLY N N 133 115.052 115.052 112.351 2.701 25342 3248 1 4 . 1 1 133 133 GLY C C 133 172.078 172.078 173.818 -1.740 25342 3249 1 4 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.380 -2.960 25342 3250 1 4 . 1 1 133 133 GLY H H 133 8.626 8.626 8.037 0.589 25342 3251 1 4 . 1 1 134 134 LEU N N 134 120.063 120.063 122.187 -2.124 25342 3252 1 4 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.491 -0.019 25342 3253 1 4 . 1 1 134 134 LEU C C 134 174.079 174.079 176.888 -2.809 25342 3254 1 4 . 1 1 134 134 LEU CA C 134 50.964 50.964 54.665 -3.701 25342 3255 1 4 . 1 1 134 134 LEU CB C 134 40.370 40.370 42.308 -1.938 25342 3256 1 4 . 1 1 134 134 LEU H H 134 8.094 8.094 8.048 0.046 25342 3257 1 4 . 1 1 135 135 ASN N N 135 119.292 119.292 118.646 0.646 25342 3258 1 4 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.793 -0.170 25342 3259 1 4 . 1 1 135 135 ASN C C 135 170.527 170.527 174.135 -3.608 25342 3260 1 4 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.033 -4.031 25342 3261 1 4 . 1 1 135 135 ASN CB C 135 33.560 33.560 39.949 -6.389 25342 3262 1 4 . 1 1 135 135 ASN H H 135 8.513 8.513 8.676 -0.163 25342 3263 1 4 . 1 1 136 136 VAL N N 136 125.412 125.412 123.804 1.608 25342 3264 1 4 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.636 -0.030 25342 3265 1 4 . 1 1 136 136 VAL C C 136 175.420 175.420 176.478 -1.058 25342 3266 1 4 . 1 1 136 136 VAL CA C 136 58.382 58.382 60.800 -2.418 25342 3267 1 4 . 1 1 136 136 VAL CB C 136 29.247 29.247 33.979 -4.732 25342 3268 1 4 . 1 1 136 136 VAL H H 136 7.648 7.648 8.430 -0.782 25342 3269 1 4 . 1 1 137 137 ILE N N 137 121.881 121.881 121.007 0.874 25342 3270 1 4 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.233 0.200 25342 3271 1 4 . 1 1 137 137 ILE C C 137 173.906 173.906 175.825 -1.919 25342 3272 1 4 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.304 -2.326 25342 3273 1 4 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.260 -2.064 25342 3274 1 4 . 1 1 137 137 ILE H H 137 9.139 9.139 8.351 0.788 25342 3275 1 4 . 1 1 138 138 GLY N N 138 108.226 108.226 107.194 1.032 25342 3276 1 4 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.039 -1.649 25342 3277 1 4 . 1 1 138 138 GLY H H 138 6.645 6.645 7.480 -0.835 25342 3278 1 4 . 1 1 139 139 VAL N N 139 119.408 119.408 120.139 -0.731 25342 3279 1 4 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.240 0.117 25342 3280 1 4 . 1 1 139 139 VAL C C 139 172.327 172.327 175.370 -3.043 25342 3281 1 4 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.999 -2.732 25342 3282 1 4 . 1 1 139 139 VAL CB C 139 32.743 32.743 34.466 -1.723 25342 3283 1 4 . 1 1 139 139 VAL H H 139 8.092 8.092 8.680 -0.588 25342 3284 1 4 . 1 1 140 140 ALA N N 140 127.415 127.415 130.285 -2.870 25342 3285 1 4 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.086 -0.641 25342 3286 1 4 . 1 1 140 140 ALA C C 140 170.718 170.718 175.896 -5.178 25342 3287 1 4 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.963 -2.063 25342 3288 1 4 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.130 -1.071 25342 3289 1 4 . 1 1 140 140 ALA H H 140 9.093 9.093 9.290 -0.197 25342 3290 1 4 . 1 1 141 141 ARG N N 141 119.287 119.287 119.034 0.253 25342 3291 1 4 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.436 -2.949 25342 3292 1 4 . 1 1 141 141 ARG C C 141 173.375 173.375 175.895 -2.520 25342 3293 1 4 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.827 -2.943 25342 3294 1 4 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.611 -4.927 25342 3295 1 4 . 1 1 141 141 ARG H H 141 7.620 7.620 8.566 -0.946 25342 3296 1 4 . 1 1 142 142 ASP N N 142 125.999 125.999 120.752 5.247 25342 3297 1 4 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.275 -0.551 25342 3298 1 4 . 1 1 142 142 ASP C C 142 169.292 169.292 175.753 -6.461 25342 3299 1 4 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.306 -2.968 25342 3300 1 4 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.512 -3.835 25342 3301 1 4 . 1 1 142 142 ASP H H 142 9.482 9.482 8.942 0.540 25342 3302 1 4 . 1 1 143 143 ASP N N 143 119.293 119.293 119.807 -0.514 25342 3303 1 4 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.576 -0.270 25342 3304 1 4 . 1 1 143 143 ASP C C 143 175.686 175.686 177.147 -1.461 25342 3305 1 4 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.484 -4.579 25342 3306 1 4 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.240 -3.928 25342 3307 1 4 . 1 1 143 143 ASP H H 143 8.108 8.108 8.651 -0.543 25342 3308 1 4 . 1 1 144 144 SER N N 144 115.303 115.303 115.648 -0.345 25342 3309 1 4 . 1 1 144 144 SER HA H 144 3.740 3.740 4.353 -0.613 25342 3310 1 4 . 1 1 144 144 SER C C 144 172.925 172.925 174.818 -1.893 25342 3311 1 4 . 1 1 144 144 SER CA C 144 59.213 59.213 60.624 -1.411 25342 3312 1 4 . 1 1 144 144 SER CB C 144 60.806 60.806 63.617 -2.811 25342 3313 1 4 . 1 1 144 144 SER H H 144 7.642 7.642 7.731 -0.089 25342 3314 1 4 . 1 1 145 145 GLU N N 145 119.523 119.523 120.333 -0.810 25342 3315 1 4 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.189 0.117 25342 3316 1 4 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.224 -3.185 25342 3317 1 4 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.166 -2.366 25342 3318 1 4 . 1 1 145 145 GLU H H 145 7.771 7.771 7.814 -0.043 25342 3319 1 4 . 1 1 146 146 VAL N N 146 118.683 118.683 119.020 -0.337 25342 3320 1 4 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.420 -0.479 25342 3321 1 4 . 1 1 146 146 VAL C C 146 174.591 174.591 176.979 -2.388 25342 3322 1 4 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.572 -2.640 25342 3323 1 4 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.315 -2.268 25342 3324 1 4 . 1 1 146 146 VAL H H 146 6.352 6.352 7.537 -1.185 25342 3325 1 4 . 1 1 147 147 ASP N N 147 119.312 119.312 115.898 3.414 25342 3326 1 4 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.331 -0.276 25342 3327 1 4 . 1 1 147 147 ASP C C 147 174.783 174.783 177.696 -2.913 25342 3328 1 4 . 1 1 147 147 ASP CA C 147 54.241 54.241 57.180 -2.939 25342 3329 1 4 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.649 -3.416 25342 3330 1 4 . 1 1 147 147 ASP H H 147 8.370 8.370 8.574 -0.204 25342 3331 1 4 . 1 1 148 148 LYS N N 148 119.342 119.342 117.759 1.583 25342 3332 1 4 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.376 -0.439 25342 3333 1 4 . 1 1 148 148 LYS C C 148 176.384 176.384 178.588 -2.204 25342 3334 1 4 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.842 -2.136 25342 3335 1 4 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.798 -3.287 25342 3336 1 4 . 1 1 148 148 LYS H H 148 7.040 7.040 7.245 -0.205 25342 3337 1 4 . 1 1 149 149 TRP N N 149 118.258 118.258 120.366 -2.108 25342 3338 1 4 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.793 -0.202 25342 3339 1 4 . 1 1 149 149 TRP C C 149 174.212 174.212 176.147 -1.935 25342 3340 1 4 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.850 -2.105 25342 3341 1 4 . 1 1 149 149 TRP CB C 149 26.940 26.940 27.959 -1.019 25342 3342 1 4 . 1 1 149 149 TRP H H 149 7.811 7.811 7.434 0.377 25342 3343 1 4 . 1 1 150 150 SER N N 150 109.618 109.618 112.096 -2.478 25342 3344 1 4 . 1 1 150 150 SER HA H 150 4.234 4.234 4.674 -0.440 25342 3345 1 4 . 1 1 150 150 SER C C 150 170.189 170.189 173.972 -3.783 25342 3346 1 4 . 1 1 150 150 SER CA C 150 56.695 56.695 57.943 -1.248 25342 3347 1 4 . 1 1 150 150 SER CB C 150 61.935 61.935 63.946 -2.011 25342 3348 1 4 . 1 1 150 150 SER H H 150 7.793 7.793 7.735 0.058 25342 3349 1 5 . 1 1 3 3 ALA N N 3 125.638 125.638 127.362 -1.724 25342 3350 1 5 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.645 -0.280 25342 3351 1 5 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.683 -3.385 25342 3352 1 5 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.389 -2.530 25342 3353 1 5 . 1 1 3 3 ALA H H 3 8.325 8.325 8.340 -0.015 25342 3354 1 5 . 1 1 4 4 LYS N N 4 121.813 121.813 118.324 3.489 25342 3355 1 5 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.399 -0.172 25342 3356 1 5 . 1 1 4 4 LYS C C 4 174.574 174.574 175.650 -1.076 25342 3357 1 5 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.922 -2.141 25342 3358 1 5 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.472 -0.982 25342 3359 1 5 . 1 1 4 4 LYS H H 4 8.486 8.486 8.072 0.414 25342 3360 1 5 . 1 1 5 5 LYS N N 5 129.722 129.722 120.821 8.901 25342 3361 1 5 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.366 0.152 25342 3362 1 5 . 1 1 5 5 LYS C C 5 174.720 174.720 176.661 -1.941 25342 3363 1 5 . 1 1 5 5 LYS CA C 5 54.722 54.722 56.613 -1.891 25342 3364 1 5 . 1 1 5 5 LYS CB C 5 29.785 29.785 33.320 -3.535 25342 3365 1 5 . 1 1 5 5 LYS H H 5 10.015 10.015 7.774 2.241 25342 3366 1 5 . 1 1 6 6 THR N N 6 126.254 126.254 115.797 10.457 25342 3367 1 5 . 1 1 6 6 THR HA H 6 5.654 5.654 5.303 0.351 25342 3368 1 5 . 1 1 6 6 THR C C 6 169.926 169.926 173.410 -3.484 25342 3369 1 5 . 1 1 6 6 THR CA C 6 60.598 60.598 62.051 -1.453 25342 3370 1 5 . 1 1 6 6 THR CB C 6 68.041 68.041 71.137 -3.096 25342 3371 1 5 . 1 1 6 6 THR H H 6 8.538 8.538 8.753 -0.215 25342 3372 1 5 . 1 1 7 7 LEU N N 7 130.775 130.775 126.548 4.227 25342 3373 1 5 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.679 -0.085 25342 3374 1 5 . 1 1 7 7 LEU C C 7 170.404 170.404 174.152 -3.748 25342 3375 1 5 . 1 1 7 7 LEU CA C 7 49.933 49.933 52.663 -2.731 25342 3376 1 5 . 1 1 7 7 LEU CB C 7 40.728 40.728 45.003 -4.275 25342 3377 1 5 . 1 1 7 7 LEU H H 7 8.575 8.575 8.359 0.216 25342 3378 1 5 . 1 1 8 8 ILE N N 8 127.242 127.242 122.676 4.566 25342 3379 1 5 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.526 0.322 25342 3380 1 5 . 1 1 8 8 ILE C C 8 170.936 170.936 174.356 -3.420 25342 3381 1 5 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.159 -2.907 25342 3382 1 5 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.557 -3.622 25342 3383 1 5 . 1 1 8 8 ILE H H 8 9.217 9.217 8.063 1.154 25342 3384 1 5 . 1 1 9 9 LEU N N 9 127.183 127.183 125.258 1.925 25342 3385 1 5 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.941 0.753 25342 3386 1 5 . 1 1 9 9 LEU C C 9 173.824 173.824 174.994 -1.170 25342 3387 1 5 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.086 -3.247 25342 3388 1 5 . 1 1 9 9 LEU CB C 9 43.963 43.963 46.044 -2.081 25342 3389 1 5 . 1 1 9 9 LEU H H 9 9.248 9.248 8.411 0.837 25342 3390 1 5 . 1 1 10 10 TYR N N 10 113.330 113.330 112.887 0.443 25342 3391 1 5 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.152 0.362 25342 3392 1 5 . 1 1 10 10 TYR C C 10 167.898 167.898 173.737 -5.839 25342 3393 1 5 . 1 1 10 10 TYR CA C 10 52.875 52.875 56.086 -3.211 25342 3394 1 5 . 1 1 10 10 TYR CB C 10 38.436 38.436 39.621 -1.185 25342 3395 1 5 . 1 1 10 10 TYR H H 10 7.306 7.306 7.967 -0.661 25342 3396 1 5 . 1 1 11 11 TYR N N 11 121.297 121.297 124.544 -3.247 25342 3397 1 5 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.072 -0.310 25342 3398 1 5 . 1 1 11 11 TYR C C 11 169.698 169.698 174.787 -5.089 25342 3399 1 5 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.919 -1.872 25342 3400 1 5 . 1 1 11 11 TYR CB C 11 40.538 40.538 38.868 1.670 25342 3401 1 5 . 1 1 11 11 TYR H H 11 7.891 7.891 8.464 -0.573 25342 3402 1 5 . 1 1 12 12 SER N N 12 117.763 117.763 124.450 -6.687 25342 3403 1 5 . 1 1 12 12 SER HA H 12 4.679 4.679 4.194 0.485 25342 3404 1 5 . 1 1 12 12 SER C C 12 170.075 170.075 173.579 -3.504 25342 3405 1 5 . 1 1 12 12 SER CA C 12 53.619 53.619 58.419 -4.800 25342 3406 1 5 . 1 1 12 12 SER CB C 12 62.847 62.847 62.896 -0.049 25342 3407 1 5 . 1 1 12 12 SER H H 12 7.557 7.557 8.592 -1.035 25342 3408 1 5 . 1 1 13 13 TRP N N 13 135.232 135.232 130.254 4.978 25342 3409 1 5 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.992 0.644 25342 3410 1 5 . 1 1 13 13 TRP C C 13 175.708 175.708 175.512 0.196 25342 3411 1 5 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.030 -1.914 25342 3412 1 5 . 1 1 13 13 TRP CB C 13 27.635 27.635 30.023 -2.388 25342 3413 1 5 . 1 1 13 13 TRP H H 13 9.755 9.755 7.881 1.874 25342 3414 1 5 . 1 1 14 14 SER N N 14 113.789 113.789 112.770 1.019 25342 3415 1 5 . 1 1 14 14 SER HA H 14 4.223 4.223 4.538 -0.315 25342 3416 1 5 . 1 1 14 14 SER C C 14 172.747 172.747 173.954 -1.207 25342 3417 1 5 . 1 1 14 14 SER CA C 14 53.828 53.828 58.205 -4.377 25342 3418 1 5 . 1 1 14 14 SER CB C 14 60.037 60.037 63.206 -3.168 25342 3419 1 5 . 1 1 14 14 SER H H 14 10.026 10.026 8.124 1.902 25342 3420 1 5 . 1 1 15 15 GLY N N 15 110.489 110.489 111.874 -1.385 25342 3421 1 5 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.577 -0.918 25342 3422 1 5 . 1 1 15 15 GLY H H 15 7.391 7.391 8.249 -0.858 25342 3423 1 5 . 1 1 16 16 GLU N N 16 129.005 129.005 120.523 8.482 25342 3424 1 5 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.198 -0.135 25342 3425 1 5 . 1 1 16 16 GLU CA C 16 56.761 56.761 57.673 -0.912 25342 3426 1 5 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.779 -3.368 25342 3427 1 5 . 1 1 16 16 GLU H H 16 11.550 11.550 8.509 3.041 25342 3428 1 5 . 1 1 17 17 THR N N 17 123.016 123.016 115.880 7.136 25342 3429 1 5 . 1 1 17 17 THR HA H 17 4.035 4.035 3.969 0.066 25342 3430 1 5 . 1 1 17 17 THR C C 17 173.360 173.360 176.070 -2.710 25342 3431 1 5 . 1 1 17 17 THR CA C 17 64.303 64.303 64.903 -0.600 25342 3432 1 5 . 1 1 17 17 THR CB C 17 63.999 63.999 68.592 -4.593 25342 3433 1 5 . 1 1 17 17 THR H H 17 11.293 11.293 8.004 3.289 25342 3434 1 5 . 1 1 18 18 LYS N N 18 120.156 120.156 120.823 -0.667 25342 3435 1 5 . 1 1 18 18 LYS HA H 18 2.856 2.856 3.776 -0.920 25342 3436 1 5 . 1 1 18 18 LYS C C 18 173.901 173.901 178.093 -4.192 25342 3437 1 5 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.001 -2.167 25342 3438 1 5 . 1 1 18 18 LYS CB C 18 29.481 29.481 31.852 -2.371 25342 3439 1 5 . 1 1 18 18 LYS H H 18 6.940 6.940 8.099 -1.159 25342 3440 1 5 . 1 1 19 19 LYS N N 19 117.237 117.237 117.796 -0.559 25342 3441 1 5 . 1 1 19 19 LYS HA H 19 3.923 3.923 3.968 -0.045 25342 3442 1 5 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.479 -3.155 25342 3443 1 5 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.194 -2.833 25342 3444 1 5 . 1 1 19 19 LYS H H 19 7.212 7.212 7.545 -0.333 25342 3445 1 5 . 1 1 20 20 MET N N 20 119.268 119.268 114.726 4.542 25342 3446 1 5 . 1 1 20 20 MET HA H 20 4.413 4.413 4.328 0.085 25342 3447 1 5 . 1 1 20 20 MET C C 20 173.625 173.625 177.401 -3.776 25342 3448 1 5 . 1 1 20 20 MET CA C 20 52.261 52.261 57.787 -5.526 25342 3449 1 5 . 1 1 20 20 MET CB C 20 26.680 26.680 31.994 -5.314 25342 3450 1 5 . 1 1 20 20 MET H H 20 7.600 7.600 7.647 -0.047 25342 3451 1 5 . 1 1 21 21 ALA N N 21 123.669 123.669 124.337 -0.668 25342 3452 1 5 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.805 -0.323 25342 3453 1 5 . 1 1 21 21 ALA C C 21 176.628 176.628 179.073 -2.445 25342 3454 1 5 . 1 1 21 21 ALA CA C 21 52.374 52.374 54.598 -2.224 25342 3455 1 5 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.904 -1.409 25342 3456 1 5 . 1 1 21 21 ALA H H 21 8.738 8.738 7.563 1.175 25342 3457 1 5 . 1 1 22 22 GLU N N 22 117.242 117.242 117.716 -0.474 25342 3458 1 5 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.934 -0.261 25342 3459 1 5 . 1 1 22 22 GLU C C 22 176.698 176.698 179.254 -2.556 25342 3460 1 5 . 1 1 22 22 GLU CA C 22 56.540 56.540 58.834 -2.294 25342 3461 1 5 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.246 -2.812 25342 3462 1 5 . 1 1 22 22 GLU H H 22 7.959 7.959 7.793 0.166 25342 3463 1 5 . 1 1 23 23 LYS N N 23 123.302 123.302 119.823 3.479 25342 3464 1 5 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.040 -0.219 25342 3465 1 5 . 1 1 23 23 LYS C C 23 177.389 177.389 179.143 -1.754 25342 3466 1 5 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.183 -2.261 25342 3467 1 5 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.324 -2.810 25342 3468 1 5 . 1 1 23 23 LYS H H 23 7.703 7.703 7.468 0.235 25342 3469 1 5 . 1 1 24 24 ILE N N 24 122.208 122.208 120.317 1.891 25342 3470 1 5 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.630 -0.347 25342 3471 1 5 . 1 1 24 24 ILE C C 24 174.934 174.934 177.450 -2.516 25342 3472 1 5 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.081 -1.789 25342 3473 1 5 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.765 -3.027 25342 3474 1 5 . 1 1 24 24 ILE H H 24 8.535 8.535 7.698 0.837 25342 3475 1 5 . 1 1 25 25 ASN N N 25 118.640 118.640 117.335 1.305 25342 3476 1 5 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.440 -0.213 25342 3477 1 5 . 1 1 25 25 ASN C C 25 173.530 173.530 176.254 -2.724 25342 3478 1 5 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.213 -4.002 25342 3479 1 5 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.837 -0.733 25342 3480 1 5 . 1 1 25 25 ASN H H 25 8.317 8.317 8.246 0.071 25342 3481 1 5 . 1 1 26 26 SER N N 26 111.990 111.990 112.136 -0.146 25342 3482 1 5 . 1 1 26 26 SER HA H 26 4.153 4.153 4.642 -0.489 25342 3483 1 5 . 1 1 26 26 SER C C 26 172.110 172.110 174.160 -2.050 25342 3484 1 5 . 1 1 26 26 SER CA C 26 57.905 57.905 59.349 -1.444 25342 3485 1 5 . 1 1 26 26 SER CB C 26 60.655 60.655 63.519 -2.864 25342 3486 1 5 . 1 1 26 26 SER H H 26 7.369 7.369 7.831 -0.462 25342 3487 1 5 . 1 1 27 27 GLU N N 27 120.201 120.201 120.081 0.120 25342 3488 1 5 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.461 -0.360 25342 3489 1 5 . 1 1 27 27 GLU C C 27 173.673 173.673 176.688 -3.015 25342 3490 1 5 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.298 -2.063 25342 3491 1 5 . 1 1 27 27 GLU CB C 27 26.601 26.601 31.710 -5.109 25342 3492 1 5 . 1 1 27 27 GLU H H 27 7.451 7.451 7.923 -0.472 25342 3493 1 5 . 1 1 28 28 ILE N N 28 118.762 118.762 121.670 -2.908 25342 3494 1 5 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.092 0.107 25342 3495 1 5 . 1 1 28 28 ILE C C 28 172.487 172.487 176.016 -3.529 25342 3496 1 5 . 1 1 28 28 ILE CA C 28 57.732 57.732 61.541 -3.809 25342 3497 1 5 . 1 1 28 28 ILE CB C 28 35.738 35.738 38.992 -3.254 25342 3498 1 5 . 1 1 28 28 ILE H H 28 7.255 7.255 7.880 -0.625 25342 3499 1 5 . 1 1 29 29 LYS N N 29 130.563 130.563 126.929 3.634 25342 3500 1 5 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.434 -0.432 25342 3501 1 5 . 1 1 29 29 LYS C C 29 174.386 174.386 176.433 -2.047 25342 3502 1 5 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.088 -0.553 25342 3503 1 5 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.411 -3.825 25342 3504 1 5 . 1 1 29 29 LYS H H 29 8.564 8.564 8.848 -0.284 25342 3505 1 5 . 1 1 30 30 ASP N N 30 119.357 119.357 119.633 -0.276 25342 3506 1 5 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.340 0.062 25342 3507 1 5 . 1 1 30 30 ASP C C 30 172.570 172.570 175.648 -3.078 25342 3508 1 5 . 1 1 30 30 ASP CA C 30 53.436 53.436 55.124 -1.688 25342 3509 1 5 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.422 -2.678 25342 3510 1 5 . 1 1 30 30 ASP H H 30 8.920 8.920 8.847 0.073 25342 3511 1 5 . 1 1 31 31 SER N N 31 114.019 114.019 114.727 -0.708 25342 3512 1 5 . 1 1 31 31 SER HA H 31 4.782 4.782 4.746 0.036 25342 3513 1 5 . 1 1 31 31 SER C C 31 171.150 171.150 175.192 -4.042 25342 3514 1 5 . 1 1 31 31 SER CA C 31 55.551 55.551 59.560 -4.009 25342 3515 1 5 . 1 1 31 31 SER CB C 31 62.259 62.259 64.434 -2.175 25342 3516 1 5 . 1 1 31 31 SER H H 31 8.006 8.006 8.098 -0.092 25342 3517 1 5 . 1 1 32 32 GLU N N 32 121.455 121.455 119.758 1.697 25342 3518 1 5 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.660 0.080 25342 3519 1 5 . 1 1 32 32 GLU C C 32 171.185 171.185 174.445 -3.260 25342 3520 1 5 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.630 -3.550 25342 3521 1 5 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.974 -2.147 25342 3522 1 5 . 1 1 32 32 GLU H H 32 8.145 8.145 8.201 -0.056 25342 3523 1 5 . 1 1 33 33 LEU N N 33 126.176 126.176 120.227 5.949 25342 3524 1 5 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.818 0.488 25342 3525 1 5 . 1 1 33 33 LEU C C 33 173.365 173.365 175.098 -1.733 25342 3526 1 5 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.787 -3.347 25342 3527 1 5 . 1 1 33 33 LEU CB C 33 43.635 43.635 44.588 -0.953 25342 3528 1 5 . 1 1 33 33 LEU H H 33 8.589 8.589 8.415 0.174 25342 3529 1 5 . 1 1 34 34 LYS N N 34 127.200 127.200 125.590 1.610 25342 3530 1 5 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.943 -0.347 25342 3531 1 5 . 1 1 34 34 LYS C C 34 169.622 169.622 174.778 -5.156 25342 3532 1 5 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.222 -1.893 25342 3533 1 5 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.853 -2.653 25342 3534 1 5 . 1 1 34 34 LYS H H 34 9.380 9.380 8.976 0.404 25342 3535 1 5 . 1 1 35 35 GLU N N 35 122.324 122.324 118.700 3.624 25342 3536 1 5 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.468 -2.135 25342 3537 1 5 . 1 1 35 35 GLU C C 35 172.734 172.734 175.319 -2.585 25342 3538 1 5 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.636 -2.023 25342 3539 1 5 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.354 -4.035 25342 3540 1 5 . 1 1 35 35 GLU H H 35 8.094 8.094 8.533 -0.439 25342 3541 1 5 . 1 1 36 36 VAL N N 36 126.781 126.781 122.142 4.639 25342 3542 1 5 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.374 -0.535 25342 3543 1 5 . 1 1 36 36 VAL C C 36 171.482 171.482 175.083 -3.601 25342 3544 1 5 . 1 1 36 36 VAL CA C 36 59.405 59.405 61.491 -2.086 25342 3545 1 5 . 1 1 36 36 VAL CB C 36 29.348 29.348 31.914 -2.566 25342 3546 1 5 . 1 1 36 36 VAL H H 36 8.660 8.660 8.787 -0.127 25342 3547 1 5 . 1 1 37 37 LYS N N 37 126.065 126.065 125.460 0.605 25342 3548 1 5 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.533 0.432 25342 3549 1 5 . 1 1 37 37 LYS C C 37 173.187 173.187 175.919 -2.732 25342 3550 1 5 . 1 1 37 37 LYS CA C 37 52.280 52.280 55.549 -3.269 25342 3551 1 5 . 1 1 37 37 LYS CB C 37 32.921 32.921 33.663 -0.742 25342 3552 1 5 . 1 1 37 37 LYS H H 37 7.809 7.809 8.521 -0.713 25342 3553 1 5 . 1 1 38 38 VAL N N 38 111.020 111.020 114.989 -3.969 25342 3554 1 5 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.982 -0.158 25342 3555 1 5 . 1 1 38 38 VAL C C 38 173.604 173.604 175.994 -2.390 25342 3556 1 5 . 1 1 38 38 VAL CA C 38 56.383 56.383 58.314 -1.931 25342 3557 1 5 . 1 1 38 38 VAL CB C 38 32.376 32.376 33.358 -0.982 25342 3558 1 5 . 1 1 38 38 VAL H H 38 8.305 8.305 8.068 0.237 25342 3559 1 5 . 1 1 39 39 SER N N 39 117.887 117.887 115.676 2.211 25342 3560 1 5 . 1 1 39 39 SER HA H 39 4.183 4.183 4.268 -0.085 25342 3561 1 5 . 1 1 39 39 SER C C 39 173.538 173.538 174.112 -0.574 25342 3562 1 5 . 1 1 39 39 SER CA C 39 56.279 56.279 59.217 -2.938 25342 3563 1 5 . 1 1 39 39 SER CB C 39 60.537 60.537 63.291 -2.754 25342 3564 1 5 . 1 1 39 39 SER H H 39 8.847 8.847 8.420 0.427 25342 3565 1 5 . 1 1 40 40 GLU N N 40 126.316 126.316 120.523 5.793 25342 3566 1 5 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.366 -0.212 25342 3567 1 5 . 1 1 40 40 GLU C C 40 174.586 174.586 176.276 -1.690 25342 3568 1 5 . 1 1 40 40 GLU CA C 40 55.812 55.812 55.866 -0.054 25342 3569 1 5 . 1 1 40 40 GLU CB C 40 26.720 26.720 30.381 -3.661 25342 3570 1 5 . 1 1 40 40 GLU H H 40 9.049 9.049 8.338 0.711 25342 3571 1 5 . 1 1 41 41 GLY N N 41 112.494 112.494 113.270 -0.776 25342 3572 1 5 . 1 1 41 41 GLY C C 41 171.994 171.994 174.992 -2.998 25342 3573 1 5 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.890 -3.428 25342 3574 1 5 . 1 1 41 41 GLY H H 41 8.780 8.780 8.807 -0.027 25342 3575 1 5 . 1 1 42 42 THR N N 42 118.631 118.631 114.745 3.886 25342 3576 1 5 . 1 1 42 42 THR HA H 42 3.582 3.582 3.985 -0.403 25342 3577 1 5 . 1 1 42 42 THR C C 42 171.225 171.225 173.620 -2.395 25342 3578 1 5 . 1 1 42 42 THR CA C 42 64.104 64.104 63.634 0.470 25342 3579 1 5 . 1 1 42 42 THR CB C 42 65.914 65.914 68.886 -2.972 25342 3580 1 5 . 1 1 42 42 THR H H 42 7.737 7.737 8.267 -0.530 25342 3581 1 5 . 1 1 43 43 PHE N N 43 116.279 116.279 114.375 1.904 25342 3582 1 5 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.917 0.103 25342 3583 1 5 . 1 1 43 43 PHE C C 43 170.141 170.141 173.369 -3.228 25342 3584 1 5 . 1 1 43 43 PHE CA C 43 52.472 52.472 54.840 -2.368 25342 3585 1 5 . 1 1 43 43 PHE CB C 43 37.385 37.385 40.372 -2.987 25342 3586 1 5 . 1 1 43 43 PHE H H 43 8.114 8.114 7.239 0.875 25342 3587 1 5 . 1 1 44 44 ASP N N 44 121.513 121.513 120.675 0.838 25342 3588 1 5 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.958 -0.107 25342 3589 1 5 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.753 -2.541 25342 3590 1 5 . 1 1 44 44 ASP CB C 44 44.385 44.385 43.438 0.947 25342 3591 1 5 . 1 1 44 44 ASP H H 44 7.774 7.774 8.610 -0.836 25342 3592 1 5 . 1 1 45 45 ALA N N 45 125.663 125.663 121.690 3.973 25342 3593 1 5 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.802 -0.591 25342 3594 1 5 . 1 1 45 45 ALA C C 45 175.139 175.139 177.088 -1.949 25342 3595 1 5 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.169 -0.733 25342 3596 1 5 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.628 -3.396 25342 3597 1 5 . 1 1 45 45 ALA H H 45 8.324 8.324 8.216 0.108 25342 3598 1 5 . 1 1 46 46 ASP N N 46 119.288 119.288 119.360 -0.072 25342 3599 1 5 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.555 0.270 25342 3600 1 5 . 1 1 46 46 ASP C C 46 175.013 175.013 176.512 -1.499 25342 3601 1 5 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.825 -2.664 25342 3602 1 5 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.192 -0.959 25342 3603 1 5 . 1 1 46 46 ASP H H 46 9.618 9.618 7.957 1.661 25342 3604 1 5 . 1 1 47 47 MET N N 47 127.347 127.347 112.484 14.863 25342 3605 1 5 . 1 1 47 47 MET HA H 47 3.456 3.456 4.662 -1.206 25342 3606 1 5 . 1 1 47 47 MET C C 47 173.605 173.605 175.967 -2.362 25342 3607 1 5 . 1 1 47 47 MET CA C 47 56.699 56.699 55.567 1.132 25342 3608 1 5 . 1 1 47 47 MET CB C 47 29.930 29.930 34.850 -4.920 25342 3609 1 5 . 1 1 47 47 MET H H 47 9.178 9.178 7.850 1.328 25342 3610 1 5 . 1 1 48 48 TYR N N 48 121.040 121.040 118.025 3.015 25342 3611 1 5 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.718 -0.846 25342 3612 1 5 . 1 1 48 48 TYR CA C 48 58.712 58.712 58.754 -0.042 25342 3613 1 5 . 1 1 48 48 TYR CB C 48 33.638 33.638 37.413 -3.776 25342 3614 1 5 . 1 1 48 48 TYR H H 48 7.881 7.881 7.109 0.772 25342 3615 1 5 . 1 1 49 49 LYS N N 49 121.754 121.754 121.530 0.224 25342 3616 1 5 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.151 -0.046 25342 3617 1 5 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.599 -3.213 25342 3618 1 5 . 1 1 49 49 LYS CB C 49 29.164 29.164 31.956 -2.792 25342 3619 1 5 . 1 1 49 49 LYS H H 49 8.365 8.365 7.565 0.800 25342 3620 1 5 . 1 1 50 50 THR N N 50 117.557 117.557 108.440 9.117 25342 3621 1 5 . 1 1 50 50 THR HA H 50 3.586 3.586 4.151 -0.565 25342 3622 1 5 . 1 1 50 50 THR CA C 50 65.634 65.634 64.967 0.667 25342 3623 1 5 . 1 1 50 50 THR CB C 50 65.904 65.904 67.790 -1.886 25342 3624 1 5 . 1 1 50 50 THR H H 50 8.007 8.007 8.420 -0.413 25342 3625 1 5 . 1 1 51 51 SER N N 51 115.110 115.110 117.136 -2.026 25342 3626 1 5 . 1 1 51 51 SER HA H 51 3.974 3.974 4.609 -0.635 25342 3627 1 5 . 1 1 51 51 SER CA C 51 59.042 59.042 60.874 -1.832 25342 3628 1 5 . 1 1 51 51 SER CB C 51 59.835 59.835 63.150 -3.315 25342 3629 1 5 . 1 1 51 51 SER H H 51 7.606 7.606 7.772 -0.166 25342 3630 1 5 . 1 1 52 52 ASP N N 52 119.713 119.713 123.215 -3.502 25342 3631 1 5 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.615 -0.307 25342 3632 1 5 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.543 -2.017 25342 3633 1 5 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.335 -3.647 25342 3634 1 5 . 1 1 52 52 ASP H H 52 7.552 7.552 7.834 -0.282 25342 3635 1 5 . 1 1 53 53 ILE N N 53 121.982 121.982 120.756 1.226 25342 3636 1 5 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.588 0.134 25342 3637 1 5 . 1 1 53 53 ILE C C 53 175.325 175.325 177.852 -2.527 25342 3638 1 5 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.763 -3.219 25342 3639 1 5 . 1 1 53 53 ILE CB C 53 36.699 36.699 38.025 -1.326 25342 3640 1 5 . 1 1 53 53 ILE H H 53 7.815 7.815 7.602 0.213 25342 3641 1 5 . 1 1 54 54 ALA N N 54 121.552 121.552 119.488 2.064 25342 3642 1 5 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.067 0.250 25342 3643 1 5 . 1 1 54 54 ALA C C 54 177.475 177.475 178.447 -0.972 25342 3644 1 5 . 1 1 54 54 ALA CA C 54 52.022 52.022 53.791 -1.769 25342 3645 1 5 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.861 -2.877 25342 3646 1 5 . 1 1 54 54 ALA H H 54 8.332 8.332 8.103 0.229 25342 3647 1 5 . 1 1 55 55 LEU N N 55 117.176 117.176 119.827 -2.651 25342 3648 1 5 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.159 -0.225 25342 3649 1 5 . 1 1 55 55 LEU C C 55 176.532 176.532 178.390 -1.858 25342 3650 1 5 . 1 1 55 55 LEU CA C 55 55.331 55.331 56.685 -1.355 25342 3651 1 5 . 1 1 55 55 LEU CB C 55 38.428 38.428 42.595 -4.167 25342 3652 1 5 . 1 1 55 55 LEU H H 55 8.195 8.195 7.377 0.818 25342 3653 1 5 . 1 1 56 56 ASP N N 56 120.056 120.056 120.865 -0.809 25342 3654 1 5 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.255 0.212 25342 3655 1 5 . 1 1 56 56 ASP C C 56 176.585 176.585 178.567 -1.982 25342 3656 1 5 . 1 1 56 56 ASP CA C 56 54.550 54.550 58.040 -3.490 25342 3657 1 5 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.552 -2.247 25342 3658 1 5 . 1 1 56 56 ASP H H 56 7.806 7.806 8.623 -0.817 25342 3659 1 5 . 1 1 57 57 GLN N N 57 120.020 120.020 115.294 4.726 25342 3660 1 5 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.341 -0.218 25342 3661 1 5 . 1 1 57 57 GLN C C 57 175.689 175.689 177.310 -1.621 25342 3662 1 5 . 1 1 57 57 GLN CA C 57 54.405 54.405 57.088 -2.683 25342 3663 1 5 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.763 -4.994 25342 3664 1 5 . 1 1 57 57 GLN H H 57 7.661 7.661 7.573 0.088 25342 3665 1 5 . 1 1 58 58 ILE N N 58 120.644 120.644 118.812 1.832 25342 3666 1 5 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.377 -0.801 25342 3667 1 5 . 1 1 58 58 ILE C C 58 176.237 176.237 177.130 -0.893 25342 3668 1 5 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.722 -0.216 25342 3669 1 5 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.937 -2.908 25342 3670 1 5 . 1 1 58 58 ILE H H 58 8.228 8.228 7.547 0.681 25342 3671 1 5 . 1 1 59 59 GLN N N 59 115.498 115.498 117.972 -2.474 25342 3672 1 5 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.190 -0.048 25342 3673 1 5 . 1 1 59 59 GLN C C 59 173.781 173.781 177.285 -3.504 25342 3674 1 5 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.395 -3.413 25342 3675 1 5 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.717 -3.106 25342 3676 1 5 . 1 1 59 59 GLN H H 59 8.331 8.331 8.390 -0.059 25342 3677 1 5 . 1 1 60 60 GLY N N 60 106.623 106.623 104.914 1.709 25342 3678 1 5 . 1 1 60 60 GLY C C 60 172.068 172.068 174.864 -2.796 25342 3679 1 5 . 1 1 60 60 GLY CA C 60 42.873 42.873 44.997 -2.124 25342 3680 1 5 . 1 1 60 60 GLY H H 60 7.611 7.611 8.046 -0.435 25342 3681 1 5 . 1 1 61 61 ASN N N 61 117.691 117.691 117.931 -0.240 25342 3682 1 5 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.676 -0.132 25342 3683 1 5 . 1 1 61 61 ASN C C 61 171.946 171.946 175.361 -3.415 25342 3684 1 5 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.001 -2.432 25342 3685 1 5 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.091 -2.731 25342 3686 1 5 . 1 1 61 61 ASN H H 61 8.151 8.151 8.641 -0.490 25342 3687 1 5 . 1 1 62 62 LYS N N 62 118.289 118.289 118.470 -0.181 25342 3688 1 5 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.548 -0.220 25342 3689 1 5 . 1 1 62 62 LYS C C 62 171.773 171.773 174.743 -2.970 25342 3690 1 5 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.936 -3.640 25342 3691 1 5 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.634 -0.951 25342 3692 1 5 . 1 1 62 62 LYS H H 62 7.242 7.242 7.587 -0.345 25342 3693 1 5 . 1 1 63 63 ASP N N 63 119.888 119.888 120.298 -0.410 25342 3694 1 5 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.185 0.231 25342 3695 1 5 . 1 1 63 63 ASP C C 63 174.476 174.476 175.506 -1.030 25342 3696 1 5 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.042 -1.581 25342 3697 1 5 . 1 1 63 63 ASP CB C 63 38.515 38.515 40.781 -2.266 25342 3698 1 5 . 1 1 63 63 ASP H H 63 8.230 8.230 8.204 0.026 25342 3699 1 5 . 1 1 64 64 PHE N N 64 119.789 119.789 116.633 3.156 25342 3700 1 5 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.415 -0.599 25342 3701 1 5 . 1 1 64 64 PHE CA C 64 56.250 56.250 55.100 1.150 25342 3702 1 5 . 1 1 64 64 PHE CB C 64 35.034 35.034 37.719 -2.685 25342 3703 1 5 . 1 1 64 64 PHE H H 64 8.428 8.428 7.100 1.328 25342 3704 1 5 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.535 -0.222 25342 3705 1 5 . 1 1 65 65 PRO C C 65 173.975 173.975 176.329 -2.354 25342 3706 1 5 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.598 -2.542 25342 3707 1 5 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.447 -2.927 25342 3708 1 5 . 1 1 66 66 GLU N N 66 121.326 121.326 120.372 0.954 25342 3709 1 5 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.292 -0.059 25342 3710 1 5 . 1 1 66 66 GLU C C 66 173.978 173.978 175.411 -1.433 25342 3711 1 5 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.573 -3.042 25342 3712 1 5 . 1 1 66 66 GLU CB C 66 27.700 27.700 30.227 -2.527 25342 3713 1 5 . 1 1 66 66 GLU H H 66 8.225 8.225 8.575 -0.350 25342 3714 1 5 . 1 1 67 67 ILE N N 67 113.897 113.897 115.314 -1.417 25342 3715 1 5 . 1 1 67 67 ILE HA H 67 5.169 5.169 5.045 0.124 25342 3716 1 5 . 1 1 67 67 ILE C C 67 172.791 172.791 175.208 -2.417 25342 3717 1 5 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.674 -2.399 25342 3718 1 5 . 1 1 67 67 ILE CB C 67 39.016 39.016 42.157 -3.141 25342 3719 1 5 . 1 1 67 67 ILE H H 67 8.366 8.366 8.156 0.210 25342 3720 1 5 . 1 1 68 68 GLN N N 68 121.654 121.654 119.453 2.201 25342 3721 1 5 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.584 -0.065 25342 3722 1 5 . 1 1 68 68 GLN C C 68 171.562 171.562 175.003 -3.441 25342 3723 1 5 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.329 -2.016 25342 3724 1 5 . 1 1 68 68 GLN CB C 68 26.785 26.785 29.095 -2.310 25342 3725 1 5 . 1 1 68 68 GLN H H 68 8.763 8.763 8.369 0.394 25342 3726 1 5 . 1 1 69 69 LEU N N 69 125.289 125.289 120.747 4.542 25342 3727 1 5 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.566 -0.047 25342 3728 1 5 . 1 1 69 69 LEU C C 69 172.567 172.567 175.847 -3.280 25342 3729 1 5 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.888 -3.091 25342 3730 1 5 . 1 1 69 69 LEU CB C 69 42.742 42.742 43.257 -0.515 25342 3731 1 5 . 1 1 69 69 LEU H H 69 7.996 7.996 7.691 0.305 25342 3732 1 5 . 1 1 70 70 ASP N N 70 123.170 123.170 122.255 0.915 25342 3733 1 5 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.744 -0.338 25342 3734 1 5 . 1 1 70 70 ASP C C 70 171.978 171.978 175.333 -3.355 25342 3735 1 5 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.529 -1.847 25342 3736 1 5 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.864 -3.135 25342 3737 1 5 . 1 1 70 70 ASP H H 70 8.278 8.278 8.420 -0.142 25342 3738 1 5 . 1 1 71 71 ASN N N 71 117.524 117.524 118.789 -1.265 25342 3739 1 5 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.774 -0.447 25342 3740 1 5 . 1 1 71 71 ASN C C 71 171.825 171.825 174.285 -2.460 25342 3741 1 5 . 1 1 71 71 ASN CA C 71 51.657 51.657 52.917 -1.260 25342 3742 1 5 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.905 -3.675 25342 3743 1 5 . 1 1 71 71 ASN H H 71 8.372 8.372 8.394 -0.022 25342 3744 1 5 . 1 1 72 72 ILE N N 72 124.515 124.515 124.585 -0.070 25342 3745 1 5 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.093 -0.164 25342 3746 1 5 . 1 1 72 72 ILE C C 72 171.607 171.607 174.140 -2.533 25342 3747 1 5 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.467 -2.178 25342 3748 1 5 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.612 -2.852 25342 3749 1 5 . 1 1 72 72 ILE H H 72 7.653 7.653 7.826 -0.173 25342 3750 1 5 . 1 1 73 73 ASP N N 73 125.182 125.182 123.997 1.185 25342 3751 1 5 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.471 0.157 25342 3752 1 5 . 1 1 73 73 ASP C C 73 173.980 173.980 176.050 -2.070 25342 3753 1 5 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.480 -5.266 25342 3754 1 5 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.145 -4.243 25342 3755 1 5 . 1 1 73 73 ASP H H 73 8.382 8.382 8.525 -0.143 25342 3756 1 5 . 1 1 74 74 TYR N N 74 123.092 123.092 124.571 -1.479 25342 3757 1 5 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.686 -0.821 25342 3758 1 5 . 1 1 74 74 TYR C C 74 173.582 173.582 176.272 -2.690 25342 3759 1 5 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.749 1.737 25342 3760 1 5 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.150 -3.341 25342 3761 1 5 . 1 1 74 74 TYR H H 74 7.348 7.348 8.692 -1.344 25342 3762 1 5 . 1 1 75 75 ASN N N 75 109.447 109.447 117.694 -8.247 25342 3763 1 5 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.615 0.310 25342 3764 1 5 . 1 1 75 75 ASN C C 75 172.570 172.570 175.937 -3.367 25342 3765 1 5 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.200 -1.582 25342 3766 1 5 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.536 -3.002 25342 3767 1 5 . 1 1 75 75 ASN H H 75 8.040 8.040 8.219 -0.179 25342 3768 1 5 . 1 1 76 76 ASN N N 76 117.411 117.411 117.469 -0.058 25342 3769 1 5 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.585 -0.131 25342 3770 1 5 . 1 1 76 76 ASN C C 76 171.155 171.155 173.511 -2.356 25342 3771 1 5 . 1 1 76 76 ASN CA C 76 50.934 50.934 52.743 -1.809 25342 3772 1 5 . 1 1 76 76 ASN CB C 76 35.658 35.658 37.512 -1.854 25342 3773 1 5 . 1 1 76 76 ASN H H 76 7.750 7.750 8.139 -0.389 25342 3774 1 5 . 1 1 77 77 TYR N N 77 116.878 116.878 118.004 -1.126 25342 3775 1 5 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.583 -0.229 25342 3776 1 5 . 1 1 77 77 TYR C C 77 172.224 172.224 174.019 -1.795 25342 3777 1 5 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.165 -1.925 25342 3778 1 5 . 1 1 77 77 TYR CB C 77 37.113 37.113 41.438 -4.325 25342 3779 1 5 . 1 1 77 77 TYR H H 77 7.789 7.789 7.179 0.610 25342 3780 1 5 . 1 1 78 78 ASP N N 78 121.352 121.352 121.369 -0.017 25342 3781 1 5 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.562 0.235 25342 3782 1 5 . 1 1 78 78 ASP C C 78 172.623 172.623 175.483 -2.860 25342 3783 1 5 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.209 -3.019 25342 3784 1 5 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.738 -1.703 25342 3785 1 5 . 1 1 78 78 ASP H H 78 9.036 9.036 8.839 0.197 25342 3786 1 5 . 1 1 79 79 LEU N N 79 123.073 123.073 117.363 5.710 25342 3787 1 5 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.196 -0.088 25342 3788 1 5 . 1 1 79 79 LEU C C 79 170.730 170.730 174.432 -3.702 25342 3789 1 5 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.770 -2.514 25342 3790 1 5 . 1 1 79 79 LEU CB C 79 42.284 42.284 45.795 -3.511 25342 3791 1 5 . 1 1 79 79 LEU H H 79 7.877 7.877 7.738 0.139 25342 3792 1 5 . 1 1 80 80 ILE N N 80 126.348 126.348 123.092 3.256 25342 3793 1 5 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.694 0.375 25342 3794 1 5 . 1 1 80 80 ILE C C 80 171.584 171.584 174.225 -2.641 25342 3795 1 5 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.091 -2.676 25342 3796 1 5 . 1 1 80 80 ILE CB C 80 37.998 37.998 41.104 -3.106 25342 3797 1 5 . 1 1 80 80 ILE H H 80 8.704 8.704 8.140 0.564 25342 3798 1 5 . 1 1 81 81 LEU N N 81 126.303 126.303 126.468 -0.165 25342 3799 1 5 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.621 0.502 25342 3800 1 5 . 1 1 81 81 LEU C C 81 172.779 172.779 175.540 -2.761 25342 3801 1 5 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.936 -4.427 25342 3802 1 5 . 1 1 81 81 LEU CB C 81 41.715 41.715 44.647 -2.932 25342 3803 1 5 . 1 1 81 81 LEU H H 81 9.202 9.202 8.632 0.570 25342 3804 1 5 . 1 1 82 82 ILE N N 82 120.931 120.931 119.343 1.588 25342 3805 1 5 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.479 0.368 25342 3806 1 5 . 1 1 82 82 ILE C C 82 172.796 172.796 174.380 -1.584 25342 3807 1 5 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.516 -2.635 25342 3808 1 5 . 1 1 82 82 ILE CB C 82 37.797 37.797 43.041 -5.244 25342 3809 1 5 . 1 1 82 82 ILE H H 82 8.846 8.846 7.669 1.177 25342 3810 1 5 . 1 1 83 83 GLY N N 83 120.905 120.905 109.110 11.795 25342 3811 1 5 . 1 1 83 83 GLY CA C 83 40.557 40.557 44.427 -3.870 25342 3812 1 5 . 1 1 83 83 GLY H H 83 9.558 9.558 8.328 1.230 25342 3813 1 5 . 1 1 84 84 SER N N 84 116.601 116.601 114.250 2.351 25342 3814 1 5 . 1 1 84 84 SER HA H 84 5.476 5.476 5.259 0.217 25342 3815 1 5 . 1 1 84 84 SER CA C 84 51.324 51.324 56.058 -4.734 25342 3816 1 5 . 1 1 84 84 SER CB C 84 64.271 64.271 65.236 -0.965 25342 3817 1 5 . 1 1 84 84 SER H H 84 7.533 7.533 8.182 -0.649 25342 3818 1 5 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.450 0.713 25342 3819 1 5 . 1 1 85 85 PRO C C 85 175.590 175.590 176.331 -0.741 25342 3820 1 5 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.623 -3.740 25342 3821 1 5 . 1 1 85 85 PRO CB C 85 30.474 30.474 31.985 -1.511 25342 3822 1 5 . 1 1 86 86 VAL N N 86 116.295 116.295 122.802 -6.507 25342 3823 1 5 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.496 -0.675 25342 3824 1 5 . 1 1 86 86 VAL C C 86 172.692 172.692 176.124 -3.432 25342 3825 1 5 . 1 1 86 86 VAL CA C 86 59.812 59.812 62.532 -2.720 25342 3826 1 5 . 1 1 86 86 VAL CB C 86 30.083 30.083 30.755 -0.672 25342 3827 1 5 . 1 1 86 86 VAL H H 86 7.246 7.246 8.222 -0.976 25342 3828 1 5 . 1 1 87 87 TRP N N 87 131.042 131.042 128.597 2.445 25342 3829 1 5 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.468 -0.157 25342 3830 1 5 . 1 1 87 87 TRP C C 87 173.323 173.323 177.299 -3.976 25342 3831 1 5 . 1 1 87 87 TRP CA C 87 50.887 50.887 58.025 -7.138 25342 3832 1 5 . 1 1 87 87 TRP CB C 87 27.310 27.310 30.814 -3.504 25342 3833 1 5 . 1 1 87 87 TRP H H 87 9.555 9.555 8.132 1.423 25342 3834 1 5 . 1 1 88 88 SER N N 88 122.660 122.660 116.621 6.039 25342 3835 1 5 . 1 1 88 88 SER HA H 88 4.582 4.582 4.156 0.426 25342 3836 1 5 . 1 1 88 88 SER C C 88 172.096 172.096 174.745 -2.649 25342 3837 1 5 . 1 1 88 88 SER CA C 88 55.391 55.391 60.260 -4.869 25342 3838 1 5 . 1 1 88 88 SER CB C 88 57.813 57.813 60.926 -3.113 25342 3839 1 5 . 1 1 88 88 SER H H 88 10.257 10.257 9.048 1.209 25342 3840 1 5 . 1 1 89 89 GLY N N 89 128.381 128.381 108.619 19.762 25342 3841 1 5 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.100 -2.471 25342 3842 1 5 . 1 1 89 89 GLY H H 89 6.372 6.372 8.346 -1.974 25342 3843 1 5 . 1 1 90 90 TYR N N 90 120.345 120.345 116.145 4.200 25342 3844 1 5 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.830 -0.641 25342 3845 1 5 . 1 1 90 90 TYR CA C 90 53.549 53.549 52.828 0.721 25342 3846 1 5 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.276 -1.081 25342 3847 1 5 . 1 1 90 90 TYR H H 90 8.113 8.113 7.334 0.779 25342 3848 1 5 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.586 0.248 25342 3849 1 5 . 1 1 91 91 PRO C C 91 170.911 170.911 177.260 -6.349 25342 3850 1 5 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.314 -3.479 25342 3851 1 5 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.392 -6.322 25342 3852 1 5 . 1 1 92 92 ALA N N 92 120.629 120.629 123.765 -3.136 25342 3853 1 5 . 1 1 92 92 ALA HA H 92 3.619 3.619 4.121 -0.502 25342 3854 1 5 . 1 1 92 92 ALA C C 92 176.782 176.782 176.646 0.136 25342 3855 1 5 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.830 -1.413 25342 3856 1 5 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.962 -1.446 25342 3857 1 5 . 1 1 92 92 ALA H H 92 7.554 7.554 8.785 -1.231 25342 3858 1 5 . 1 1 93 93 THR N N 93 112.558 112.558 109.373 3.185 25342 3859 1 5 . 1 1 93 93 THR CB C 93 64.173 64.173 67.407 -3.234 25342 3860 1 5 . 1 1 93 93 THR H H 93 6.730 6.730 7.809 -1.079 25342 3861 1 5 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.515 -0.656 25342 3862 1 5 . 1 1 94 94 PRO C C 94 173.309 173.309 177.582 -4.273 25342 3863 1 5 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.680 -1.617 25342 3864 1 5 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.004 -2.725 25342 3865 1 5 . 1 1 95 95 ILE N N 95 111.014 111.014 118.090 -7.076 25342 3866 1 5 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.188 -0.583 25342 3867 1 5 . 1 1 95 95 ILE C C 95 174.302 174.302 177.648 -3.346 25342 3868 1 5 . 1 1 95 95 ILE CA C 95 57.181 57.181 61.180 -3.999 25342 3869 1 5 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.680 -4.897 25342 3870 1 5 . 1 1 95 95 ILE H H 95 7.995 7.995 8.194 -0.199 25342 3871 1 5 . 1 1 96 96 LYS N N 96 123.208 123.208 122.327 0.881 25342 3872 1 5 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.950 -0.858 25342 3873 1 5 . 1 1 96 96 LYS C C 96 174.451 174.451 178.785 -4.334 25342 3874 1 5 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.532 -2.491 25342 3875 1 5 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.573 -2.826 25342 3876 1 5 . 1 1 96 96 LYS H H 96 6.928 6.928 7.720 -0.792 25342 3877 1 5 . 1 1 97 97 THR N N 97 113.320 113.320 114.074 -0.754 25342 3878 1 5 . 1 1 97 97 THR HA H 97 3.436 3.436 3.358 0.078 25342 3879 1 5 . 1 1 97 97 THR C C 97 173.221 173.221 176.446 -3.225 25342 3880 1 5 . 1 1 97 97 THR CA C 97 62.710 62.710 65.516 -2.806 25342 3881 1 5 . 1 1 97 97 THR CB C 97 65.562 65.562 68.219 -2.657 25342 3882 1 5 . 1 1 97 97 THR H H 97 6.325 6.325 7.634 -1.309 25342 3883 1 5 . 1 1 98 98 LEU N N 98 120.963 120.963 122.334 -1.371 25342 3884 1 5 . 1 1 98 98 LEU HA H 98 3.625 3.625 3.987 -0.362 25342 3885 1 5 . 1 1 98 98 LEU C C 98 174.713 174.713 179.051 -4.338 25342 3886 1 5 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.656 -2.142 25342 3887 1 5 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.883 -2.155 25342 3888 1 5 . 1 1 98 98 LEU H H 98 7.536 7.536 7.536 -0.000 25342 3889 1 5 . 1 1 99 99 LEU N N 99 118.859 118.859 119.353 -0.494 25342 3890 1 5 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.551 0.121 25342 3891 1 5 . 1 1 99 99 LEU C C 99 177.458 177.458 178.548 -1.090 25342 3892 1 5 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.181 -3.037 25342 3893 1 5 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.470 -2.613 25342 3894 1 5 . 1 1 99 99 LEU H H 99 8.179 8.179 8.440 -0.261 25342 3895 1 5 . 1 1 100 100 ASP N N 100 118.703 118.703 117.170 1.533 25342 3896 1 5 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.330 -0.109 25342 3897 1 5 . 1 1 100 100 ASP C C 100 176.472 176.472 178.463 -1.991 25342 3898 1 5 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.825 -2.518 25342 3899 1 5 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.796 -3.438 25342 3900 1 5 . 1 1 100 100 ASP H H 100 7.867 7.867 7.559 0.308 25342 3901 1 5 . 1 1 101 101 GLN N N 101 117.829 117.829 115.462 2.367 25342 3902 1 5 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.292 -0.092 25342 3903 1 5 . 1 1 101 101 GLN C C 101 174.508 174.508 176.740 -2.232 25342 3904 1 5 . 1 1 101 101 GLN CA C 101 54.688 54.688 57.149 -2.461 25342 3905 1 5 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.816 -4.219 25342 3906 1 5 . 1 1 101 101 GLN H H 101 7.597 7.597 7.717 -0.120 25342 3907 1 5 . 1 1 102 102 MET N N 102 118.406 118.406 111.391 7.015 25342 3908 1 5 . 1 1 102 102 MET HA H 102 3.864 3.864 5.014 -1.150 25342 3909 1 5 . 1 1 102 102 MET C C 102 172.820 172.820 176.553 -3.733 25342 3910 1 5 . 1 1 102 102 MET CA C 102 53.298 53.298 55.166 -1.868 25342 3911 1 5 . 1 1 102 102 MET CB C 102 31.207 31.207 34.009 -2.802 25342 3912 1 5 . 1 1 102 102 MET H H 102 7.434 7.434 7.566 -0.132 25342 3913 1 5 . 1 1 103 103 LYS N N 103 115.889 115.889 123.084 -7.195 25342 3914 1 5 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.852 0.067 25342 3915 1 5 . 1 1 103 103 LYS C C 103 173.938 173.938 176.951 -3.013 25342 3916 1 5 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.141 -2.704 25342 3917 1 5 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.366 -2.103 25342 3918 1 5 . 1 1 103 103 LYS H H 103 6.881 6.881 7.713 -0.832 25342 3919 1 5 . 1 1 104 104 ASN N N 104 114.951 114.951 114.361 0.590 25342 3920 1 5 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.798 -0.067 25342 3921 1 5 . 1 1 104 104 ASN C C 104 172.617 172.617 175.265 -2.648 25342 3922 1 5 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.369 -3.103 25342 3923 1 5 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.644 -2.861 25342 3924 1 5 . 1 1 104 104 ASN H H 104 8.493 8.493 7.939 0.554 25342 3925 1 5 . 1 1 105 105 TYR N N 105 122.680 122.680 120.777 1.903 25342 3926 1 5 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.217 0.345 25342 3927 1 5 . 1 1 105 105 TYR CA C 105 55.433 55.433 60.434 -5.001 25342 3928 1 5 . 1 1 105 105 TYR CB C 105 35.832 35.832 38.394 -2.562 25342 3929 1 5 . 1 1 105 105 TYR H H 105 8.217 8.217 7.999 0.218 25342 3930 1 5 . 1 1 106 106 ARG N N 106 128.872 128.872 125.712 3.160 25342 3931 1 5 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.500 -0.235 25342 3932 1 5 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.233 -2.251 25342 3933 1 5 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.516 -5.386 25342 3934 1 5 . 1 1 106 106 ARG H H 106 8.801 8.801 8.544 0.257 25342 3935 1 5 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.619 -2.218 25342 3936 1 5 . 1 1 108 108 GLU N N 108 117.000 117.000 123.070 -6.070 25342 3937 1 5 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.499 0.127 25342 3938 1 5 . 1 1 108 108 GLU C C 108 174.125 174.125 175.320 -1.195 25342 3939 1 5 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.108 -2.320 25342 3940 1 5 . 1 1 108 108 GLU CB C 108 30.440 30.440 32.142 -1.702 25342 3941 1 5 . 1 1 108 108 GLU H H 108 7.514 7.514 8.112 -0.598 25342 3942 1 5 . 1 1 109 109 VAL N N 109 123.398 123.398 120.488 2.910 25342 3943 1 5 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.240 0.097 25342 3944 1 5 . 1 1 109 109 VAL C C 109 170.606 170.606 173.941 -3.335 25342 3945 1 5 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.211 -2.931 25342 3946 1 5 . 1 1 109 109 VAL CB C 109 32.657 32.657 36.523 -3.866 25342 3947 1 5 . 1 1 109 109 VAL H H 109 8.942 8.942 7.989 0.953 25342 3948 1 5 . 1 1 110 110 ALA N N 110 127.905 127.905 124.948 2.957 25342 3949 1 5 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.666 -0.039 25342 3950 1 5 . 1 1 110 110 ALA C C 110 173.195 173.195 175.082 -1.887 25342 3951 1 5 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.789 -2.443 25342 3952 1 5 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.117 -3.792 25342 3953 1 5 . 1 1 110 110 ALA H H 110 8.776 8.776 7.955 0.821 25342 3954 1 5 . 1 1 111 111 SER N N 111 110.523 110.523 115.299 -4.776 25342 3955 1 5 . 1 1 111 111 SER HA H 111 5.562 5.562 4.682 0.880 25342 3956 1 5 . 1 1 111 111 SER C C 111 170.719 170.719 172.874 -2.155 25342 3957 1 5 . 1 1 111 111 SER CA C 111 51.314 51.314 57.073 -5.759 25342 3958 1 5 . 1 1 111 111 SER CB C 111 61.907 61.907 63.061 -1.154 25342 3959 1 5 . 1 1 111 111 SER H H 111 7.480 7.480 7.684 -0.204 25342 3960 1 5 . 1 1 112 112 PHE N N 112 125.567 125.567 122.613 2.954 25342 3961 1 5 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.295 1.061 25342 3962 1 5 . 1 1 112 112 PHE C C 112 169.536 169.536 174.564 -5.028 25342 3963 1 5 . 1 1 112 112 PHE CA C 112 50.371 50.371 54.255 -3.884 25342 3964 1 5 . 1 1 112 112 PHE CB C 112 39.788 39.788 38.715 1.073 25342 3965 1 5 . 1 1 112 112 PHE H H 112 7.848 7.848 7.432 0.416 25342 3966 1 5 . 1 1 113 113 PHE N N 113 115.065 115.065 118.327 -3.262 25342 3967 1 5 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.120 0.984 25342 3968 1 5 . 1 1 113 113 PHE C C 113 173.006 173.006 177.469 -4.463 25342 3969 1 5 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.580 -6.318 25342 3970 1 5 . 1 1 113 113 PHE CB C 113 38.749 38.749 40.702 -1.953 25342 3971 1 5 . 1 1 113 113 PHE H H 113 7.361 7.361 8.481 -1.120 25342 3972 1 5 . 1 1 114 114 THR N N 114 108.014 108.014 110.896 -2.882 25342 3973 1 5 . 1 1 114 114 THR HA H 114 4.999 4.999 4.838 0.161 25342 3974 1 5 . 1 1 114 114 THR C C 114 169.874 169.874 174.712 -4.838 25342 3975 1 5 . 1 1 114 114 THR CA C 114 56.500 56.500 61.067 -4.567 25342 3976 1 5 . 1 1 114 114 THR CB C 114 68.809 68.809 70.157 -1.348 25342 3977 1 5 . 1 1 114 114 THR H H 114 7.867 7.867 8.759 -0.892 25342 3978 1 5 . 1 1 115 115 SER N N 115 115.049 115.049 118.060 -3.011 25342 3979 1 5 . 1 1 115 115 SER HA H 115 5.613 5.613 4.310 1.303 25342 3980 1 5 . 1 1 115 115 SER C C 115 171.247 171.247 174.597 -3.350 25342 3981 1 5 . 1 1 115 115 SER CA C 115 54.830 54.830 58.571 -3.741 25342 3982 1 5 . 1 1 115 115 SER CB C 115 63.992 63.992 63.876 0.116 25342 3983 1 5 . 1 1 115 115 SER H H 115 8.970 8.970 7.857 1.113 25342 3984 1 5 . 1 1 116 116 ALA N N 116 122.671 122.671 123.853 -1.182 25342 3985 1 5 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.328 0.657 25342 3986 1 5 . 1 1 116 116 ALA C C 116 176.180 176.180 177.245 -1.065 25342 3987 1 5 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.282 -2.082 25342 3988 1 5 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.011 -1.016 25342 3989 1 5 . 1 1 116 116 ALA H H 116 8.963 8.963 8.842 0.121 25342 3990 1 5 . 1 1 117 117 GLY N N 117 107.387 107.387 106.992 0.395 25342 3991 1 5 . 1 1 117 117 GLY C C 117 172.528 172.528 172.863 -0.335 25342 3992 1 5 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.433 -1.701 25342 3993 1 5 . 1 1 117 117 GLY H H 117 9.340 9.340 8.357 0.983 25342 3994 1 5 . 1 1 118 118 THR N N 118 113.481 113.481 109.732 3.749 25342 3995 1 5 . 1 1 118 118 THR HA H 118 4.651 4.651 4.342 0.309 25342 3996 1 5 . 1 1 118 118 THR C C 118 172.067 172.067 174.405 -2.338 25342 3997 1 5 . 1 1 118 118 THR CA C 118 57.357 57.357 60.031 -2.674 25342 3998 1 5 . 1 1 118 118 THR CB C 118 69.475 69.475 70.089 -0.614 25342 3999 1 5 . 1 1 118 118 THR H H 118 9.373 9.373 7.245 2.128 25342 4000 1 5 . 1 1 119 119 ASN N N 119 113.202 113.202 117.975 -4.773 25342 4001 1 5 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.240 0.378 25342 4002 1 5 . 1 1 119 119 ASN C C 119 173.114 173.114 176.162 -3.048 25342 4003 1 5 . 1 1 119 119 ASN CA C 119 51.684 51.684 55.201 -3.517 25342 4004 1 5 . 1 1 119 119 ASN CB C 119 33.730 33.730 36.947 -3.216 25342 4005 1 5 . 1 1 119 119 ASN H H 119 8.908 8.908 8.905 0.003 25342 4006 1 5 . 1 1 120 120 HIS N N 120 117.315 117.315 117.432 -0.117 25342 4007 1 5 . 1 1 120 120 HIS HA H 120 3.786 3.786 3.803 -0.017 25342 4008 1 5 . 1 1 120 120 HIS C C 120 174.381 174.381 177.078 -2.697 25342 4009 1 5 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.681 -4.165 25342 4010 1 5 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.366 -2.861 25342 4011 1 5 . 1 1 120 120 HIS H H 120 8.074 8.074 8.376 -0.302 25342 4012 1 5 . 1 1 121 121 LYS N N 121 118.678 118.678 120.252 -1.574 25342 4013 1 5 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.113 -0.279 25342 4014 1 5 . 1 1 121 121 LYS C C 121 176.564 176.564 178.525 -1.961 25342 4015 1 5 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.799 -2.504 25342 4016 1 5 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.410 -3.468 25342 4017 1 5 . 1 1 121 121 LYS H H 121 8.336 8.336 8.447 -0.111 25342 4018 1 5 . 1 1 122 122 ALA N N 122 122.146 122.146 121.280 0.866 25342 4019 1 5 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.287 -0.592 25342 4020 1 5 . 1 1 122 122 ALA C C 122 175.163 175.163 179.883 -4.720 25342 4021 1 5 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.767 -3.075 25342 4022 1 5 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.009 -2.291 25342 4023 1 5 . 1 1 122 122 ALA H H 122 7.584 7.584 8.167 -0.583 25342 4024 1 5 . 1 1 123 123 TYR N N 123 119.730 119.730 120.269 -0.539 25342 4025 1 5 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.338 -1.185 25342 4026 1 5 . 1 1 123 123 TYR C C 123 174.340 174.340 178.140 -3.800 25342 4027 1 5 . 1 1 123 123 TYR CA C 123 60.398 60.398 61.294 -0.896 25342 4028 1 5 . 1 1 123 123 TYR CB C 123 34.663 34.663 38.546 -3.883 25342 4029 1 5 . 1 1 123 123 TYR H H 123 7.317 7.317 7.885 -0.568 25342 4030 1 5 . 1 1 124 124 VAL N N 124 118.649 118.649 118.967 -0.318 25342 4031 1 5 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.733 -0.531 25342 4032 1 5 . 1 1 124 124 VAL C C 124 175.603 175.603 178.515 -2.912 25342 4033 1 5 . 1 1 124 124 VAL CA C 124 64.680 64.680 67.350 -2.670 25342 4034 1 5 . 1 1 124 124 VAL CB C 124 29.289 29.289 31.578 -2.289 25342 4035 1 5 . 1 1 124 124 VAL H H 124 7.799 7.799 8.116 -0.317 25342 4036 1 5 . 1 1 125 125 SER N N 125 114.475 114.475 112.841 1.634 25342 4037 1 5 . 1 1 125 125 SER HA H 125 4.032 4.032 4.299 -0.267 25342 4038 1 5 . 1 1 125 125 SER C C 125 174.849 174.849 176.197 -1.348 25342 4039 1 5 . 1 1 125 125 SER CA C 125 59.002 59.002 61.810 -2.808 25342 4040 1 5 . 1 1 125 125 SER CB C 125 59.613 59.613 62.835 -3.222 25342 4041 1 5 . 1 1 125 125 SER H H 125 7.766 7.766 8.198 -0.432 25342 4042 1 5 . 1 1 126 126 HIS N N 126 119.326 119.326 121.215 -1.889 25342 4043 1 5 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.664 -0.537 25342 4044 1 5 . 1 1 126 126 HIS C C 126 172.865 172.865 177.469 -4.604 25342 4045 1 5 . 1 1 126 126 HIS CA C 126 55.706 55.706 58.945 -3.239 25342 4046 1 5 . 1 1 126 126 HIS CB C 126 25.993 25.993 31.070 -5.077 25342 4047 1 5 . 1 1 126 126 HIS H H 126 8.569 8.569 7.958 0.611 25342 4048 1 5 . 1 1 127 127 PHE N N 127 121.044 121.044 121.796 -0.752 25342 4049 1 5 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.280 -1.106 25342 4050 1 5 . 1 1 127 127 PHE C C 127 173.378 173.378 176.970 -3.592 25342 4051 1 5 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.148 -0.281 25342 4052 1 5 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.313 -3.259 25342 4053 1 5 . 1 1 127 127 PHE H H 127 9.139 9.139 9.286 -0.147 25342 4054 1 5 . 1 1 128 128 ASN N N 128 114.893 114.893 116.167 -1.274 25342 4055 1 5 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.281 -0.241 25342 4056 1 5 . 1 1 128 128 ASN C C 128 175.230 175.230 178.100 -2.870 25342 4057 1 5 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.688 -2.388 25342 4058 1 5 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.118 -1.947 25342 4059 1 5 . 1 1 128 128 ASN H H 128 7.774 7.774 8.021 -0.247 25342 4060 1 5 . 1 1 129 129 GLU N N 129 119.804 119.804 118.236 1.568 25342 4061 1 5 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.900 0.140 25342 4062 1 5 . 1 1 129 129 GLU C C 129 177.052 177.052 176.797 0.255 25342 4063 1 5 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.152 -1.422 25342 4064 1 5 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.138 -1.942 25342 4065 1 5 . 1 1 129 129 GLU H H 129 7.577 7.577 7.707 -0.130 25342 4066 1 5 . 1 1 130 130 TRP N N 130 120.979 120.979 117.500 3.479 25342 4067 1 5 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.585 -0.128 25342 4068 1 5 . 1 1 130 130 TRP C C 130 174.329 174.329 175.217 -0.888 25342 4069 1 5 . 1 1 130 130 TRP CA C 130 54.688 54.688 57.172 -2.485 25342 4070 1 5 . 1 1 130 130 TRP CB C 130 26.991 26.991 30.440 -3.449 25342 4071 1 5 . 1 1 130 130 TRP H H 130 8.225 8.225 7.592 0.633 25342 4072 1 5 . 1 1 131 131 ALA N N 131 120.450 120.450 119.103 1.347 25342 4073 1 5 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.309 -0.373 25342 4074 1 5 . 1 1 131 131 ALA C C 131 172.487 172.487 175.594 -3.107 25342 4075 1 5 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.064 -2.630 25342 4076 1 5 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.262 -2.974 25342 4077 1 5 . 1 1 131 131 ALA H H 131 8.081 8.081 7.532 0.549 25342 4078 1 5 . 1 1 132 132 ASP N N 132 117.813 117.813 119.578 -1.765 25342 4079 1 5 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.346 -0.138 25342 4080 1 5 . 1 1 132 132 ASP C C 132 173.804 173.804 176.542 -2.738 25342 4081 1 5 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.818 -1.637 25342 4082 1 5 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.844 -1.523 25342 4083 1 5 . 1 1 132 132 ASP H H 132 6.772 6.772 7.816 -1.044 25342 4084 1 5 . 1 1 133 133 GLY N N 133 115.052 115.052 112.604 2.448 25342 4085 1 5 . 1 1 133 133 GLY C C 133 172.078 172.078 174.120 -2.042 25342 4086 1 5 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.703 -2.283 25342 4087 1 5 . 1 1 133 133 GLY H H 133 8.626 8.626 8.123 0.503 25342 4088 1 5 . 1 1 134 134 LEU N N 134 120.063 120.063 121.133 -1.070 25342 4089 1 5 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.762 -0.290 25342 4090 1 5 . 1 1 134 134 LEU C C 134 174.079 174.079 175.231 -1.152 25342 4091 1 5 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.316 -2.352 25342 4092 1 5 . 1 1 134 134 LEU CB C 134 40.370 40.370 43.476 -3.106 25342 4093 1 5 . 1 1 134 134 LEU H H 134 8.094 8.094 7.515 0.579 25342 4094 1 5 . 1 1 135 135 ASN N N 135 119.292 119.292 118.766 0.526 25342 4095 1 5 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.833 -0.210 25342 4096 1 5 . 1 1 135 135 ASN C C 135 170.527 170.527 173.417 -2.890 25342 4097 1 5 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.776 -3.774 25342 4098 1 5 . 1 1 135 135 ASN CB C 135 33.560 33.560 40.335 -6.775 25342 4099 1 5 . 1 1 135 135 ASN H H 135 8.513 8.513 8.553 -0.040 25342 4100 1 5 . 1 1 136 136 VAL N N 136 125.412 125.412 125.028 0.384 25342 4101 1 5 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.763 -0.157 25342 4102 1 5 . 1 1 136 136 VAL C C 136 175.420 175.420 176.175 -0.755 25342 4103 1 5 . 1 1 136 136 VAL CA C 136 58.382 58.382 60.071 -1.689 25342 4104 1 5 . 1 1 136 136 VAL CB C 136 29.247 29.247 33.901 -4.654 25342 4105 1 5 . 1 1 136 136 VAL H H 136 7.648 7.648 8.389 -0.741 25342 4106 1 5 . 1 1 137 137 ILE N N 137 121.881 121.881 121.572 0.309 25342 4107 1 5 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.332 0.101 25342 4108 1 5 . 1 1 137 137 ILE C C 137 173.906 173.906 175.262 -1.356 25342 4109 1 5 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.084 -2.106 25342 4110 1 5 . 1 1 137 137 ILE CB C 137 36.196 36.196 37.877 -1.681 25342 4111 1 5 . 1 1 137 137 ILE H H 137 9.139 9.139 8.718 0.421 25342 4112 1 5 . 1 1 138 138 GLY N N 138 108.226 108.226 107.040 1.186 25342 4113 1 5 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.053 -1.662 25342 4114 1 5 . 1 1 138 138 GLY H H 138 6.645 6.645 7.149 -0.504 25342 4115 1 5 . 1 1 139 139 VAL N N 139 119.408 119.408 119.512 -0.104 25342 4116 1 5 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.294 1.063 25342 4117 1 5 . 1 1 139 139 VAL C C 139 172.327 172.327 174.945 -2.618 25342 4118 1 5 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.503 -3.236 25342 4119 1 5 . 1 1 139 139 VAL CB C 139 32.743 32.743 32.054 0.689 25342 4120 1 5 . 1 1 139 139 VAL H H 139 8.092 8.092 8.524 -0.432 25342 4121 1 5 . 1 1 140 140 ALA N N 140 127.415 127.415 129.408 -1.993 25342 4122 1 5 . 1 1 140 140 ALA HA H 140 4.445 4.445 4.942 -0.497 25342 4123 1 5 . 1 1 140 140 ALA C C 140 170.718 170.718 175.480 -4.762 25342 4124 1 5 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.857 -1.957 25342 4125 1 5 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.670 -1.611 25342 4126 1 5 . 1 1 140 140 ALA H H 140 9.093 9.093 8.270 0.823 25342 4127 1 5 . 1 1 141 141 ARG N N 141 119.287 119.287 120.580 -1.293 25342 4128 1 5 . 1 1 141 141 ARG HA H 141 2.487 2.487 4.928 -2.441 25342 4129 1 5 . 1 1 141 141 ARG C C 141 173.375 173.375 175.983 -2.608 25342 4130 1 5 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.146 -3.262 25342 4131 1 5 . 1 1 141 141 ARG CB C 141 28.684 28.684 32.642 -3.958 25342 4132 1 5 . 1 1 141 141 ARG H H 141 7.620 7.620 8.676 -1.056 25342 4133 1 5 . 1 1 142 142 ASP N N 142 125.999 125.999 123.990 2.009 25342 4134 1 5 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.220 -0.496 25342 4135 1 5 . 1 1 142 142 ASP C C 142 169.292 169.292 176.632 -7.340 25342 4136 1 5 . 1 1 142 142 ASP CA C 142 53.338 53.338 55.951 -2.613 25342 4137 1 5 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.435 -3.758 25342 4138 1 5 . 1 1 142 142 ASP H H 142 9.482 9.482 9.061 0.421 25342 4139 1 5 . 1 1 143 143 ASP N N 143 119.293 119.293 118.955 0.338 25342 4140 1 5 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.419 -0.113 25342 4141 1 5 . 1 1 143 143 ASP C C 143 175.686 175.686 176.077 -0.391 25342 4142 1 5 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.567 -5.662 25342 4143 1 5 . 1 1 143 143 ASP CB C 143 36.312 36.312 38.215 -1.903 25342 4144 1 5 . 1 1 143 143 ASP H H 143 8.108 8.108 8.649 -0.541 25342 4145 1 5 . 1 1 144 144 SER N N 144 115.303 115.303 114.701 0.602 25342 4146 1 5 . 1 1 144 144 SER HA H 144 3.740 3.740 4.302 -0.562 25342 4147 1 5 . 1 1 144 144 SER C C 144 172.925 172.925 175.070 -2.145 25342 4148 1 5 . 1 1 144 144 SER CA C 144 59.213 59.213 60.171 -0.958 25342 4149 1 5 . 1 1 144 144 SER CB C 144 60.806 60.806 63.724 -2.917 25342 4150 1 5 . 1 1 144 144 SER H H 144 7.642 7.642 7.935 -0.293 25342 4151 1 5 . 1 1 145 145 GLU N N 145 119.523 119.523 119.505 0.018 25342 4152 1 5 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.170 0.136 25342 4153 1 5 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.376 -3.337 25342 4154 1 5 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.849 -3.049 25342 4155 1 5 . 1 1 145 145 GLU H H 145 7.771 7.771 7.950 -0.179 25342 4156 1 5 . 1 1 146 146 VAL N N 146 118.683 118.683 121.163 -2.480 25342 4157 1 5 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.795 -0.854 25342 4158 1 5 . 1 1 146 146 VAL C C 146 174.591 174.591 176.155 -1.564 25342 4159 1 5 . 1 1 146 146 VAL CA C 146 63.932 63.932 65.263 -1.331 25342 4160 1 5 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.841 -2.795 25342 4161 1 5 . 1 1 146 146 VAL H H 146 6.352 6.352 7.721 -1.369 25342 4162 1 5 . 1 1 147 147 ASP N N 147 119.312 119.312 116.326 2.986 25342 4163 1 5 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.405 -0.350 25342 4164 1 5 . 1 1 147 147 ASP C C 147 174.783 174.783 176.929 -2.146 25342 4165 1 5 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.656 -2.415 25342 4166 1 5 . 1 1 147 147 ASP CB C 147 37.233 37.233 41.135 -3.902 25342 4167 1 5 . 1 1 147 147 ASP H H 147 8.370 8.370 8.529 -0.159 25342 4168 1 5 . 1 1 148 148 LYS N N 148 119.342 119.342 117.217 2.125 25342 4169 1 5 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.354 -0.417 25342 4170 1 5 . 1 1 148 148 LYS C C 148 176.384 176.384 179.712 -3.328 25342 4171 1 5 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.425 -1.719 25342 4172 1 5 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.779 -3.268 25342 4173 1 5 . 1 1 148 148 LYS H H 148 7.040 7.040 7.284 -0.244 25342 4174 1 5 . 1 1 149 149 TRP N N 149 118.258 118.258 121.179 -2.921 25342 4175 1 5 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.740 -0.149 25342 4176 1 5 . 1 1 149 149 TRP C C 149 174.212 174.212 175.753 -1.541 25342 4177 1 5 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.877 -2.132 25342 4178 1 5 . 1 1 149 149 TRP CB C 149 26.940 26.940 26.980 -0.040 25342 4179 1 5 . 1 1 149 149 TRP H H 149 7.811 7.811 7.884 -0.073 25342 4180 1 5 . 1 1 150 150 SER N N 150 109.618 109.618 114.417 -4.799 25342 4181 1 5 . 1 1 150 150 SER HA H 150 4.234 4.234 4.641 -0.407 25342 4182 1 5 . 1 1 150 150 SER C C 150 170.189 170.189 173.366 -3.177 25342 4183 1 5 . 1 1 150 150 SER CA C 150 56.695 56.695 57.941 -1.246 25342 4184 1 5 . 1 1 150 150 SER CB C 150 61.935 61.935 64.098 -2.163 25342 4185 1 5 . 1 1 150 150 SER H H 150 7.793 7.793 8.117 -0.324 25342 4186 1 6 . 1 1 3 3 ALA N N 3 125.638 125.638 126.253 -0.615 25342 4187 1 6 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.640 -0.275 25342 4188 1 6 . 1 1 3 3 ALA CA C 3 49.298 49.298 51.593 -2.295 25342 4189 1 6 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.963 -3.104 25342 4190 1 6 . 1 1 3 3 ALA H H 3 8.325 8.325 8.284 0.040 25342 4191 1 6 . 1 1 4 4 LYS N N 4 121.813 121.813 121.668 0.145 25342 4192 1 6 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.407 -0.180 25342 4193 1 6 . 1 1 4 4 LYS C C 4 174.574 174.574 175.857 -1.283 25342 4194 1 6 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.901 -2.120 25342 4195 1 6 . 1 1 4 4 LYS CB C 4 31.490 31.490 33.046 -1.556 25342 4196 1 6 . 1 1 4 4 LYS H H 4 8.486 8.486 8.296 0.190 25342 4197 1 6 . 1 1 5 5 LYS N N 5 129.722 129.722 119.629 10.093 25342 4198 1 6 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.812 -0.294 25342 4199 1 6 . 1 1 5 5 LYS C C 5 174.720 174.720 175.081 -0.361 25342 4200 1 6 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.509 -0.787 25342 4201 1 6 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.210 -6.425 25342 4202 1 6 . 1 1 5 5 LYS H H 5 10.015 10.015 8.211 1.804 25342 4203 1 6 . 1 1 6 6 THR N N 6 126.254 126.254 116.443 9.811 25342 4204 1 6 . 1 1 6 6 THR HA H 6 5.654 5.654 5.247 0.407 25342 4205 1 6 . 1 1 6 6 THR C C 6 169.926 169.926 172.488 -2.562 25342 4206 1 6 . 1 1 6 6 THR CA C 6 60.598 60.598 61.771 -1.173 25342 4207 1 6 . 1 1 6 6 THR CB C 6 68.041 68.041 70.876 -2.835 25342 4208 1 6 . 1 1 6 6 THR H H 6 8.538 8.538 8.463 0.075 25342 4209 1 6 . 1 1 7 7 LEU N N 7 130.775 130.775 128.212 2.563 25342 4210 1 6 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.498 0.096 25342 4211 1 6 . 1 1 7 7 LEU C C 7 170.404 170.404 174.495 -4.091 25342 4212 1 6 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.154 -3.221 25342 4213 1 6 . 1 1 7 7 LEU CB C 7 40.728 40.728 44.321 -3.593 25342 4214 1 6 . 1 1 7 7 LEU H H 7 8.575 8.575 8.149 0.426 25342 4215 1 6 . 1 1 8 8 ILE N N 8 127.242 127.242 123.317 3.925 25342 4216 1 6 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.524 0.324 25342 4217 1 6 . 1 1 8 8 ILE C C 8 170.936 170.936 174.674 -3.738 25342 4218 1 6 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.516 -3.264 25342 4219 1 6 . 1 1 8 8 ILE CB C 8 36.935 36.935 39.750 -2.815 25342 4220 1 6 . 1 1 8 8 ILE H H 8 9.217 9.217 7.755 1.462 25342 4221 1 6 . 1 1 9 9 LEU N N 9 127.183 127.183 128.057 -0.874 25342 4222 1 6 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.886 0.808 25342 4223 1 6 . 1 1 9 9 LEU C C 9 173.824 173.824 175.652 -1.828 25342 4224 1 6 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.064 -4.225 25342 4225 1 6 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.454 1.509 25342 4226 1 6 . 1 1 9 9 LEU H H 9 9.248 9.248 8.777 0.471 25342 4227 1 6 . 1 1 10 10 TYR N N 10 113.330 113.330 121.888 -8.558 25342 4228 1 6 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.128 0.386 25342 4229 1 6 . 1 1 10 10 TYR C C 10 167.898 167.898 174.620 -6.722 25342 4230 1 6 . 1 1 10 10 TYR CA C 10 52.875 52.875 54.450 -1.575 25342 4231 1 6 . 1 1 10 10 TYR CB C 10 38.436 38.436 41.541 -3.105 25342 4232 1 6 . 1 1 10 10 TYR H H 10 7.306 7.306 8.108 -0.802 25342 4233 1 6 . 1 1 11 11 TYR N N 11 121.297 121.297 123.248 -1.951 25342 4234 1 6 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.305 -0.543 25342 4235 1 6 . 1 1 11 11 TYR C C 11 169.698 169.698 174.611 -4.913 25342 4236 1 6 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.573 -1.526 25342 4237 1 6 . 1 1 11 11 TYR CB C 11 40.538 40.538 40.060 0.478 25342 4238 1 6 . 1 1 11 11 TYR H H 11 7.891 7.891 8.209 -0.318 25342 4239 1 6 . 1 1 12 12 SER N N 12 117.763 117.763 123.006 -5.243 25342 4240 1 6 . 1 1 12 12 SER HA H 12 4.679 4.679 4.372 0.307 25342 4241 1 6 . 1 1 12 12 SER C C 12 170.075 170.075 173.788 -3.713 25342 4242 1 6 . 1 1 12 12 SER CA C 12 53.619 53.619 57.184 -3.565 25342 4243 1 6 . 1 1 12 12 SER CB C 12 62.847 62.847 64.113 -1.266 25342 4244 1 6 . 1 1 12 12 SER H H 12 7.557 7.557 9.168 -1.611 25342 4245 1 6 . 1 1 13 13 TRP N N 13 135.232 135.232 127.311 7.921 25342 4246 1 6 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.285 0.351 25342 4247 1 6 . 1 1 13 13 TRP C C 13 175.708 175.708 176.429 -0.721 25342 4248 1 6 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.601 -1.485 25342 4249 1 6 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.609 -1.974 25342 4250 1 6 . 1 1 13 13 TRP H H 13 9.755 9.755 7.941 1.814 25342 4251 1 6 . 1 1 14 14 SER N N 14 113.789 113.789 115.152 -1.363 25342 4252 1 6 . 1 1 14 14 SER HA H 14 4.223 4.223 4.560 -0.337 25342 4253 1 6 . 1 1 14 14 SER C C 14 172.747 172.747 174.558 -1.811 25342 4254 1 6 . 1 1 14 14 SER CA C 14 53.828 53.828 57.766 -3.938 25342 4255 1 6 . 1 1 14 14 SER CB C 14 60.037 60.037 62.603 -2.566 25342 4256 1 6 . 1 1 14 14 SER H H 14 10.026 10.026 8.496 1.530 25342 4257 1 6 . 1 1 15 15 GLY N N 15 110.489 110.489 110.424 0.065 25342 4258 1 6 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.373 -0.714 25342 4259 1 6 . 1 1 15 15 GLY H H 15 7.391 7.391 8.372 -0.981 25342 4260 1 6 . 1 1 16 16 GLU N N 16 129.005 129.005 121.198 7.807 25342 4261 1 6 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.033 0.030 25342 4262 1 6 . 1 1 16 16 GLU CA C 16 56.761 56.761 59.528 -2.767 25342 4263 1 6 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.149 -2.737 25342 4264 1 6 . 1 1 16 16 GLU H H 16 11.550 11.550 8.788 2.762 25342 4265 1 6 . 1 1 17 17 THR N N 17 123.016 123.016 113.882 9.134 25342 4266 1 6 . 1 1 17 17 THR HA H 17 4.035 4.035 4.097 -0.062 25342 4267 1 6 . 1 1 17 17 THR C C 17 173.360 173.360 176.834 -3.474 25342 4268 1 6 . 1 1 17 17 THR CA C 17 64.303 64.303 65.621 -1.318 25342 4269 1 6 . 1 1 17 17 THR CB C 17 63.999 63.999 68.237 -4.238 25342 4270 1 6 . 1 1 17 17 THR H H 17 11.293 11.293 8.471 2.822 25342 4271 1 6 . 1 1 18 18 LYS N N 18 120.156 120.156 122.323 -2.167 25342 4272 1 6 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.145 -1.289 25342 4273 1 6 . 1 1 18 18 LYS C C 18 173.901 173.901 178.688 -4.787 25342 4274 1 6 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.222 -2.388 25342 4275 1 6 . 1 1 18 18 LYS CB C 18 29.481 29.481 31.801 -2.320 25342 4276 1 6 . 1 1 18 18 LYS H H 18 6.940 6.940 8.157 -1.217 25342 4277 1 6 . 1 1 19 19 LYS N N 19 117.237 117.237 119.401 -2.164 25342 4278 1 6 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.100 -0.177 25342 4279 1 6 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.849 -2.525 25342 4280 1 6 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.003 -2.642 25342 4281 1 6 . 1 1 19 19 LYS H H 19 7.212 7.212 7.579 -0.367 25342 4282 1 6 . 1 1 20 20 MET N N 20 119.268 119.268 117.677 1.591 25342 4283 1 6 . 1 1 20 20 MET HA H 20 4.413 4.413 4.221 0.192 25342 4284 1 6 . 1 1 20 20 MET C C 20 173.625 173.625 177.393 -3.768 25342 4285 1 6 . 1 1 20 20 MET CA C 20 52.261 52.261 57.533 -5.272 25342 4286 1 6 . 1 1 20 20 MET CB C 20 26.680 26.680 32.251 -5.571 25342 4287 1 6 . 1 1 20 20 MET H H 20 7.600 7.600 7.720 -0.120 25342 4288 1 6 . 1 1 21 21 ALA N N 21 123.669 123.669 121.494 2.175 25342 4289 1 6 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.926 -0.444 25342 4290 1 6 . 1 1 21 21 ALA C C 21 176.628 176.628 179.208 -2.580 25342 4291 1 6 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.282 -2.908 25342 4292 1 6 . 1 1 21 21 ALA CB C 21 16.495 16.495 18.184 -1.689 25342 4293 1 6 . 1 1 21 21 ALA H H 21 8.738 8.738 8.143 0.595 25342 4294 1 6 . 1 1 22 22 GLU N N 22 117.242 117.242 117.769 -0.527 25342 4295 1 6 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.960 -0.287 25342 4296 1 6 . 1 1 22 22 GLU C C 22 176.698 176.698 178.820 -2.122 25342 4297 1 6 . 1 1 22 22 GLU CA C 22 56.540 56.540 58.927 -2.387 25342 4298 1 6 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.134 -2.700 25342 4299 1 6 . 1 1 22 22 GLU H H 22 7.959 7.959 7.925 0.034 25342 4300 1 6 . 1 1 23 23 LYS N N 23 123.302 123.302 121.275 2.027 25342 4301 1 6 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.093 -0.272 25342 4302 1 6 . 1 1 23 23 LYS C C 23 177.389 177.389 178.693 -1.304 25342 4303 1 6 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.015 -2.093 25342 4304 1 6 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.588 -3.074 25342 4305 1 6 . 1 1 23 23 LYS H H 23 7.703 7.703 7.165 0.538 25342 4306 1 6 . 1 1 24 24 ILE N N 24 122.208 122.208 119.736 2.472 25342 4307 1 6 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.605 -0.322 25342 4308 1 6 . 1 1 24 24 ILE C C 24 174.934 174.934 177.162 -2.228 25342 4309 1 6 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.094 -1.802 25342 4310 1 6 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.736 -2.998 25342 4311 1 6 . 1 1 24 24 ILE H H 24 8.535 8.535 7.982 0.553 25342 4312 1 6 . 1 1 25 25 ASN N N 25 118.640 118.640 117.955 0.685 25342 4313 1 6 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.319 -0.092 25342 4314 1 6 . 1 1 25 25 ASN C C 25 173.530 173.530 177.295 -3.765 25342 4315 1 6 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.152 -3.941 25342 4316 1 6 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.689 -0.585 25342 4317 1 6 . 1 1 25 25 ASN H H 25 8.317 8.317 8.367 -0.050 25342 4318 1 6 . 1 1 26 26 SER N N 26 111.990 111.990 113.897 -1.907 25342 4319 1 6 . 1 1 26 26 SER HA H 26 4.153 4.153 4.327 -0.174 25342 4320 1 6 . 1 1 26 26 SER C C 26 172.110 172.110 175.414 -3.304 25342 4321 1 6 . 1 1 26 26 SER CA C 26 57.905 57.905 60.865 -2.960 25342 4322 1 6 . 1 1 26 26 SER CB C 26 60.655 60.655 63.153 -2.498 25342 4323 1 6 . 1 1 26 26 SER H H 26 7.369 7.369 7.852 -0.483 25342 4324 1 6 . 1 1 27 27 GLU N N 27 120.201 120.201 120.071 0.130 25342 4325 1 6 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.255 -0.154 25342 4326 1 6 . 1 1 27 27 GLU C C 27 173.673 173.673 177.238 -3.565 25342 4327 1 6 . 1 1 27 27 GLU CA C 27 54.235 54.235 57.062 -2.827 25342 4328 1 6 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.234 -3.633 25342 4329 1 6 . 1 1 27 27 GLU H H 27 7.451 7.451 7.520 -0.069 25342 4330 1 6 . 1 1 28 28 ILE N N 28 118.762 118.762 119.301 -0.539 25342 4331 1 6 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.109 0.090 25342 4332 1 6 . 1 1 28 28 ILE C C 28 172.487 172.487 176.487 -4.000 25342 4333 1 6 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.805 -3.073 25342 4334 1 6 . 1 1 28 28 ILE CB C 28 35.738 35.738 38.927 -3.189 25342 4335 1 6 . 1 1 28 28 ILE H H 28 7.255 7.255 7.392 -0.137 25342 4336 1 6 . 1 1 29 29 LYS N N 29 130.563 130.563 122.753 7.810 25342 4337 1 6 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.178 -0.176 25342 4338 1 6 . 1 1 29 29 LYS C C 29 174.386 174.386 177.377 -2.991 25342 4339 1 6 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.633 -1.098 25342 4340 1 6 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.737 -3.151 25342 4341 1 6 . 1 1 29 29 LYS H H 29 8.564 8.564 8.572 -0.008 25342 4342 1 6 . 1 1 30 30 ASP N N 30 119.357 119.357 121.306 -1.949 25342 4343 1 6 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.576 -0.174 25342 4344 1 6 . 1 1 30 30 ASP C C 30 172.570 172.570 175.958 -3.388 25342 4345 1 6 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.869 -1.433 25342 4346 1 6 . 1 1 30 30 ASP CB C 30 36.744 36.744 38.884 -2.140 25342 4347 1 6 . 1 1 30 30 ASP H H 30 8.920 8.920 8.586 0.334 25342 4348 1 6 . 1 1 31 31 SER N N 31 114.019 114.019 115.636 -1.617 25342 4349 1 6 . 1 1 31 31 SER HA H 31 4.782 4.782 4.245 0.537 25342 4350 1 6 . 1 1 31 31 SER C C 31 171.150 171.150 174.685 -3.535 25342 4351 1 6 . 1 1 31 31 SER CA C 31 55.551 55.551 59.363 -3.812 25342 4352 1 6 . 1 1 31 31 SER CB C 31 62.259 62.259 64.504 -2.245 25342 4353 1 6 . 1 1 31 31 SER H H 31 8.006 8.006 8.024 -0.018 25342 4354 1 6 . 1 1 32 32 GLU N N 32 121.455 121.455 119.717 1.738 25342 4355 1 6 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.600 0.140 25342 4356 1 6 . 1 1 32 32 GLU C C 32 171.185 171.185 174.934 -3.749 25342 4357 1 6 . 1 1 32 32 GLU CA C 32 52.081 52.081 54.667 -2.586 25342 4358 1 6 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.133 -1.306 25342 4359 1 6 . 1 1 32 32 GLU H H 32 8.145 8.145 8.287 -0.142 25342 4360 1 6 . 1 1 33 33 LEU N N 33 126.176 126.176 122.245 3.931 25342 4361 1 6 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.496 0.810 25342 4362 1 6 . 1 1 33 33 LEU C C 33 173.365 173.365 175.814 -2.449 25342 4363 1 6 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.012 -2.572 25342 4364 1 6 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.019 0.616 25342 4365 1 6 . 1 1 33 33 LEU H H 33 8.589 8.589 8.223 0.366 25342 4366 1 6 . 1 1 34 34 LYS N N 34 127.200 127.200 126.172 1.028 25342 4367 1 6 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.764 -0.168 25342 4368 1 6 . 1 1 34 34 LYS C C 34 169.622 169.622 174.462 -4.840 25342 4369 1 6 . 1 1 34 34 LYS CA C 34 52.329 52.329 53.953 -1.624 25342 4370 1 6 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.290 -2.090 25342 4371 1 6 . 1 1 34 34 LYS H H 34 9.380 9.380 8.464 0.916 25342 4372 1 6 . 1 1 35 35 GLU N N 35 122.324 122.324 119.123 3.201 25342 4373 1 6 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.314 -1.981 25342 4374 1 6 . 1 1 35 35 GLU C C 35 172.734 172.734 174.975 -2.241 25342 4375 1 6 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.941 -2.329 25342 4376 1 6 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.365 -4.046 25342 4377 1 6 . 1 1 35 35 GLU H H 35 8.094 8.094 8.409 -0.315 25342 4378 1 6 . 1 1 36 36 VAL N N 36 126.781 126.781 120.415 6.366 25342 4379 1 6 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.499 -0.660 25342 4380 1 6 . 1 1 36 36 VAL C C 36 171.482 171.482 174.401 -2.919 25342 4381 1 6 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.951 -1.546 25342 4382 1 6 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.583 -6.235 25342 4383 1 6 . 1 1 36 36 VAL H H 36 8.660 8.660 8.965 -0.305 25342 4384 1 6 . 1 1 37 37 LYS N N 37 126.065 126.065 119.948 6.117 25342 4385 1 6 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.849 0.116 25342 4386 1 6 . 1 1 37 37 LYS C C 37 173.187 173.187 175.014 -1.827 25342 4387 1 6 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.943 -2.663 25342 4388 1 6 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.499 -2.578 25342 4389 1 6 . 1 1 37 37 LYS H H 37 7.809 7.809 8.270 -0.461 25342 4390 1 6 . 1 1 38 38 VAL N N 38 111.020 111.020 116.036 -5.016 25342 4391 1 6 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.873 -0.049 25342 4392 1 6 . 1 1 38 38 VAL C C 38 173.604 173.604 175.627 -2.023 25342 4393 1 6 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.379 -2.995 25342 4394 1 6 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.133 -1.757 25342 4395 1 6 . 1 1 38 38 VAL H H 38 8.305 8.305 8.205 0.100 25342 4396 1 6 . 1 1 39 39 SER N N 39 117.887 117.887 115.719 2.168 25342 4397 1 6 . 1 1 39 39 SER HA H 39 4.183 4.183 4.432 -0.249 25342 4398 1 6 . 1 1 39 39 SER C C 39 173.538 173.538 174.982 -1.444 25342 4399 1 6 . 1 1 39 39 SER CA C 39 56.279 56.279 58.549 -2.270 25342 4400 1 6 . 1 1 39 39 SER CB C 39 60.537 60.537 63.680 -3.143 25342 4401 1 6 . 1 1 39 39 SER H H 39 8.847 8.847 8.343 0.504 25342 4402 1 6 . 1 1 40 40 GLU N N 40 126.316 126.316 121.996 4.320 25342 4403 1 6 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.211 -0.057 25342 4404 1 6 . 1 1 40 40 GLU C C 40 174.586 174.586 177.472 -2.886 25342 4405 1 6 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.399 -1.587 25342 4406 1 6 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.654 -2.934 25342 4407 1 6 . 1 1 40 40 GLU H H 40 9.049 9.049 8.414 0.635 25342 4408 1 6 . 1 1 41 41 GLY N N 41 112.494 112.494 111.662 0.832 25342 4409 1 6 . 1 1 41 41 GLY C C 41 171.994 171.994 175.118 -3.124 25342 4410 1 6 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.917 -3.455 25342 4411 1 6 . 1 1 41 41 GLY H H 41 8.780 8.780 8.874 -0.094 25342 4412 1 6 . 1 1 42 42 THR N N 42 118.631 118.631 115.400 3.231 25342 4413 1 6 . 1 1 42 42 THR HA H 42 3.582 3.582 4.054 -0.472 25342 4414 1 6 . 1 1 42 42 THR C C 42 171.225 171.225 173.887 -2.662 25342 4415 1 6 . 1 1 42 42 THR CA C 42 64.104 64.104 65.322 -1.218 25342 4416 1 6 . 1 1 42 42 THR CB C 42 65.914 65.914 69.716 -3.802 25342 4417 1 6 . 1 1 42 42 THR H H 42 7.737 7.737 7.563 0.174 25342 4418 1 6 . 1 1 43 43 PHE N N 43 116.279 116.279 117.822 -1.543 25342 4419 1 6 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.603 0.417 25342 4420 1 6 . 1 1 43 43 PHE C C 43 170.141 170.141 174.035 -3.894 25342 4421 1 6 . 1 1 43 43 PHE CA C 43 52.472 52.472 57.352 -4.880 25342 4422 1 6 . 1 1 43 43 PHE CB C 43 37.385 37.385 42.023 -4.638 25342 4423 1 6 . 1 1 43 43 PHE H H 43 8.114 8.114 8.077 0.037 25342 4424 1 6 . 1 1 44 44 ASP N N 44 121.513 121.513 118.999 2.514 25342 4425 1 6 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.924 -0.073 25342 4426 1 6 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.025 -2.813 25342 4427 1 6 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.330 0.055 25342 4428 1 6 . 1 1 44 44 ASP H H 44 7.774 7.774 8.280 -0.506 25342 4429 1 6 . 1 1 45 45 ALA N N 45 125.663 125.663 121.806 3.857 25342 4430 1 6 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.786 -0.575 25342 4431 1 6 . 1 1 45 45 ALA C C 45 175.139 175.139 177.440 -2.301 25342 4432 1 6 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.507 -1.071 25342 4433 1 6 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.107 -2.875 25342 4434 1 6 . 1 1 45 45 ALA H H 45 8.324 8.324 8.517 -0.193 25342 4435 1 6 . 1 1 46 46 ASP N N 46 119.288 119.288 118.592 0.696 25342 4436 1 6 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.613 0.212 25342 4437 1 6 . 1 1 46 46 ASP C C 46 175.013 175.013 177.145 -2.132 25342 4438 1 6 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.937 -2.776 25342 4439 1 6 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.130 -0.897 25342 4440 1 6 . 1 1 46 46 ASP H H 46 9.618 9.618 7.619 1.999 25342 4441 1 6 . 1 1 47 47 MET N N 47 127.347 127.347 120.026 7.321 25342 4442 1 6 . 1 1 47 47 MET HA H 47 3.456 3.456 4.393 -0.937 25342 4443 1 6 . 1 1 47 47 MET C C 47 173.605 173.605 175.638 -2.033 25342 4444 1 6 . 1 1 47 47 MET CA C 47 56.699 56.699 57.623 -0.924 25342 4445 1 6 . 1 1 47 47 MET CB C 47 29.930 29.930 33.615 -3.685 25342 4446 1 6 . 1 1 47 47 MET H H 47 9.178 9.178 8.373 0.805 25342 4447 1 6 . 1 1 48 48 TYR N N 48 121.040 121.040 112.470 8.570 25342 4448 1 6 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.886 -1.014 25342 4449 1 6 . 1 1 48 48 TYR CA C 48 58.712 58.712 56.963 1.749 25342 4450 1 6 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.070 -4.432 25342 4451 1 6 . 1 1 48 48 TYR H H 48 7.881 7.881 8.140 -0.259 25342 4452 1 6 . 1 1 49 49 LYS N N 49 121.754 121.754 121.377 0.377 25342 4453 1 6 . 1 1 49 49 LYS HA H 49 4.105 4.105 3.966 0.139 25342 4454 1 6 . 1 1 49 49 LYS CA C 49 56.385 56.385 60.335 -3.950 25342 4455 1 6 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.239 -3.075 25342 4456 1 6 . 1 1 49 49 LYS H H 49 8.365 8.365 8.461 -0.096 25342 4457 1 6 . 1 1 50 50 THR N N 50 117.557 117.557 110.599 6.958 25342 4458 1 6 . 1 1 50 50 THR HA H 50 3.586 3.586 4.219 -0.633 25342 4459 1 6 . 1 1 50 50 THR CA C 50 65.634 65.634 66.150 -0.515 25342 4460 1 6 . 1 1 50 50 THR CB C 50 65.904 65.904 68.093 -2.189 25342 4461 1 6 . 1 1 50 50 THR H H 50 8.007 8.007 8.421 -0.414 25342 4462 1 6 . 1 1 51 51 SER N N 51 115.110 115.110 118.931 -3.821 25342 4463 1 6 . 1 1 51 51 SER HA H 51 3.974 3.974 4.228 -0.254 25342 4464 1 6 . 1 1 51 51 SER CA C 51 59.042 59.042 63.155 -4.113 25342 4465 1 6 . 1 1 51 51 SER CB C 51 59.835 59.835 62.709 -2.874 25342 4466 1 6 . 1 1 51 51 SER H H 51 7.606 7.606 8.277 -0.671 25342 4467 1 6 . 1 1 52 52 ASP N N 52 119.713 119.713 121.802 -2.089 25342 4468 1 6 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.440 -0.132 25342 4469 1 6 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.841 -2.315 25342 4470 1 6 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.571 -2.883 25342 4471 1 6 . 1 1 52 52 ASP H H 52 7.552 7.552 7.524 0.029 25342 4472 1 6 . 1 1 53 53 ILE N N 53 121.982 121.982 120.118 1.864 25342 4473 1 6 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.470 0.252 25342 4474 1 6 . 1 1 53 53 ILE C C 53 175.325 175.325 177.845 -2.520 25342 4475 1 6 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.096 -2.552 25342 4476 1 6 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.542 -0.843 25342 4477 1 6 . 1 1 53 53 ILE H H 53 7.815 7.815 7.918 -0.103 25342 4478 1 6 . 1 1 54 54 ALA N N 54 121.552 121.552 121.969 -0.417 25342 4479 1 6 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.195 0.122 25342 4480 1 6 . 1 1 54 54 ALA C C 54 177.475 177.475 179.844 -2.369 25342 4481 1 6 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.934 -2.912 25342 4482 1 6 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.878 -2.893 25342 4483 1 6 . 1 1 54 54 ALA H H 54 8.332 8.332 8.076 0.256 25342 4484 1 6 . 1 1 55 55 LEU N N 55 117.176 117.176 119.343 -2.167 25342 4485 1 6 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.990 -0.056 25342 4486 1 6 . 1 1 55 55 LEU C C 55 176.532 176.532 178.246 -1.714 25342 4487 1 6 . 1 1 55 55 LEU CA C 55 55.331 55.331 58.077 -2.746 25342 4488 1 6 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.104 -2.676 25342 4489 1 6 . 1 1 55 55 LEU H H 55 8.195 8.195 8.453 -0.258 25342 4490 1 6 . 1 1 56 56 ASP N N 56 120.056 120.056 119.446 0.610 25342 4491 1 6 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.310 0.157 25342 4492 1 6 . 1 1 56 56 ASP C C 56 176.585 176.585 179.095 -2.510 25342 4493 1 6 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.667 -3.117 25342 4494 1 6 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.632 -2.327 25342 4495 1 6 . 1 1 56 56 ASP H H 56 7.806 7.806 8.048 -0.242 25342 4496 1 6 . 1 1 57 57 GLN N N 57 120.020 120.020 117.686 2.334 25342 4497 1 6 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.289 -0.166 25342 4498 1 6 . 1 1 57 57 GLN C C 57 175.689 175.689 178.290 -2.601 25342 4499 1 6 . 1 1 57 57 GLN CA C 57 54.405 54.405 57.993 -3.588 25342 4500 1 6 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.896 -5.127 25342 4501 1 6 . 1 1 57 57 GLN H H 57 7.661 7.661 7.535 0.126 25342 4502 1 6 . 1 1 58 58 ILE N N 58 120.644 120.644 119.990 0.654 25342 4503 1 6 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.288 -0.712 25342 4504 1 6 . 1 1 58 58 ILE C C 58 176.237 176.237 177.545 -1.308 25342 4505 1 6 . 1 1 58 58 ILE CA C 58 62.506 62.506 63.745 -1.239 25342 4506 1 6 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.613 -2.584 25342 4507 1 6 . 1 1 58 58 ILE H H 58 8.228 8.228 7.700 0.528 25342 4508 1 6 . 1 1 59 59 GLN N N 59 115.498 115.498 118.509 -3.011 25342 4509 1 6 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.270 -0.128 25342 4510 1 6 . 1 1 59 59 GLN C C 59 173.781 173.781 176.795 -3.014 25342 4511 1 6 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.767 -2.785 25342 4512 1 6 . 1 1 59 59 GLN CB C 59 26.611 26.611 28.916 -2.305 25342 4513 1 6 . 1 1 59 59 GLN H H 59 8.331 8.331 8.321 0.010 25342 4514 1 6 . 1 1 60 60 GLY N N 60 106.623 106.623 106.829 -0.206 25342 4515 1 6 . 1 1 60 60 GLY C C 60 172.068 172.068 175.351 -3.283 25342 4516 1 6 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.519 -2.646 25342 4517 1 6 . 1 1 60 60 GLY H H 60 7.611 7.611 8.420 -0.809 25342 4518 1 6 . 1 1 61 61 ASN N N 61 117.691 117.691 118.398 -0.707 25342 4519 1 6 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.562 -0.018 25342 4520 1 6 . 1 1 61 61 ASN C C 61 171.946 171.946 175.755 -3.809 25342 4521 1 6 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.471 -2.902 25342 4522 1 6 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.811 -2.451 25342 4523 1 6 . 1 1 61 61 ASN H H 61 8.151 8.151 8.203 -0.052 25342 4524 1 6 . 1 1 62 62 LYS N N 62 118.289 118.289 118.590 -0.301 25342 4525 1 6 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.597 -0.269 25342 4526 1 6 . 1 1 62 62 LYS C C 62 171.773 171.773 175.083 -3.310 25342 4527 1 6 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.225 -2.929 25342 4528 1 6 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.585 -0.902 25342 4529 1 6 . 1 1 62 62 LYS H H 62 7.242 7.242 7.868 -0.626 25342 4530 1 6 . 1 1 63 63 ASP N N 63 119.888 119.888 120.673 -0.785 25342 4531 1 6 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.357 0.059 25342 4532 1 6 . 1 1 63 63 ASP C C 63 174.476 174.476 175.719 -1.243 25342 4533 1 6 . 1 1 63 63 ASP CA C 63 51.461 51.461 54.055 -2.594 25342 4534 1 6 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.812 -3.297 25342 4535 1 6 . 1 1 63 63 ASP H H 63 8.230 8.230 8.326 -0.096 25342 4536 1 6 . 1 1 64 64 PHE N N 64 119.789 119.789 116.131 3.658 25342 4537 1 6 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.703 -0.887 25342 4538 1 6 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.813 1.437 25342 4539 1 6 . 1 1 64 64 PHE CB C 64 35.034 35.034 37.553 -2.518 25342 4540 1 6 . 1 1 64 64 PHE H H 64 8.428 8.428 7.246 1.182 25342 4541 1 6 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.583 -0.270 25342 4542 1 6 . 1 1 65 65 PRO C C 65 173.975 173.975 175.849 -1.874 25342 4543 1 6 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.859 -2.803 25342 4544 1 6 . 1 1 65 65 PRO CB C 65 29.520 29.520 33.431 -3.911 25342 4545 1 6 . 1 1 66 66 GLU N N 66 121.326 121.326 116.951 4.375 25342 4546 1 6 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.833 -0.600 25342 4547 1 6 . 1 1 66 66 GLU C C 66 173.978 173.978 176.192 -2.214 25342 4548 1 6 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.038 -1.507 25342 4549 1 6 . 1 1 66 66 GLU CB C 66 27.700 27.700 33.844 -6.144 25342 4550 1 6 . 1 1 66 66 GLU H H 66 8.225 8.225 8.440 -0.215 25342 4551 1 6 . 1 1 67 67 ILE N N 67 113.897 113.897 116.163 -2.266 25342 4552 1 6 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.746 0.423 25342 4553 1 6 . 1 1 67 67 ILE C C 67 172.791 172.791 175.876 -3.085 25342 4554 1 6 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.462 -3.187 25342 4555 1 6 . 1 1 67 67 ILE CB C 67 39.016 39.016 40.479 -1.463 25342 4556 1 6 . 1 1 67 67 ILE H H 67 8.366 8.366 8.305 0.061 25342 4557 1 6 . 1 1 68 68 GLN N N 68 121.654 121.654 119.244 2.410 25342 4558 1 6 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.643 -0.124 25342 4559 1 6 . 1 1 68 68 GLN C C 68 171.562 171.562 174.406 -2.844 25342 4560 1 6 . 1 1 68 68 GLN CA C 68 52.313 52.313 55.004 -2.691 25342 4561 1 6 . 1 1 68 68 GLN CB C 68 26.785 26.785 29.267 -2.482 25342 4562 1 6 . 1 1 68 68 GLN H H 68 8.763 8.763 8.716 0.047 25342 4563 1 6 . 1 1 69 69 LEU N N 69 125.289 125.289 119.470 5.819 25342 4564 1 6 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.577 -0.058 25342 4565 1 6 . 1 1 69 69 LEU C C 69 172.567 172.567 176.599 -4.032 25342 4566 1 6 . 1 1 69 69 LEU CA C 69 51.797 51.797 53.590 -1.793 25342 4567 1 6 . 1 1 69 69 LEU CB C 69 42.742 42.742 43.383 -0.640 25342 4568 1 6 . 1 1 69 69 LEU H H 69 7.996 7.996 7.675 0.321 25342 4569 1 6 . 1 1 70 70 ASP N N 70 123.170 123.170 121.162 2.008 25342 4570 1 6 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.669 -0.263 25342 4571 1 6 . 1 1 70 70 ASP C C 70 171.978 171.978 175.327 -3.349 25342 4572 1 6 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.578 -2.896 25342 4573 1 6 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.874 -3.145 25342 4574 1 6 . 1 1 70 70 ASP H H 70 8.278 8.278 8.468 -0.190 25342 4575 1 6 . 1 1 71 71 ASN N N 71 117.524 117.524 119.543 -2.019 25342 4576 1 6 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.642 -0.315 25342 4577 1 6 . 1 1 71 71 ASN C C 71 171.825 171.825 174.343 -2.518 25342 4578 1 6 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.412 -1.755 25342 4579 1 6 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.745 -3.515 25342 4580 1 6 . 1 1 71 71 ASN H H 71 8.372 8.372 8.483 -0.111 25342 4581 1 6 . 1 1 72 72 ILE N N 72 124.515 124.515 123.069 1.446 25342 4582 1 6 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.102 -0.173 25342 4583 1 6 . 1 1 72 72 ILE C C 72 171.607 171.607 174.037 -2.430 25342 4584 1 6 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.824 -2.534 25342 4585 1 6 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.414 -2.654 25342 4586 1 6 . 1 1 72 72 ILE H H 72 7.653 7.653 8.071 -0.418 25342 4587 1 6 . 1 1 73 73 ASP N N 73 125.182 125.182 124.481 0.701 25342 4588 1 6 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.477 0.151 25342 4589 1 6 . 1 1 73 73 ASP C C 73 173.980 173.980 175.737 -1.757 25342 4590 1 6 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.127 -4.913 25342 4591 1 6 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.442 -4.540 25342 4592 1 6 . 1 1 73 73 ASP H H 73 8.382 8.382 8.456 -0.074 25342 4593 1 6 . 1 1 74 74 TYR N N 74 123.092 123.092 123.045 0.047 25342 4594 1 6 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.906 -1.041 25342 4595 1 6 . 1 1 74 74 TYR C C 74 173.582 173.582 176.149 -2.567 25342 4596 1 6 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.642 1.844 25342 4597 1 6 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.991 -4.183 25342 4598 1 6 . 1 1 74 74 TYR H H 74 7.348 7.348 8.687 -1.339 25342 4599 1 6 . 1 1 75 75 ASN N N 75 109.447 109.447 118.882 -9.435 25342 4600 1 6 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.876 0.049 25342 4601 1 6 . 1 1 75 75 ASN C C 75 172.570 172.570 175.139 -2.569 25342 4602 1 6 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.570 -1.952 25342 4603 1 6 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.675 -3.141 25342 4604 1 6 . 1 1 75 75 ASN H H 75 8.040 8.040 8.362 -0.322 25342 4605 1 6 . 1 1 76 76 ASN N N 76 117.411 117.411 113.570 3.841 25342 4606 1 6 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.662 -0.208 25342 4607 1 6 . 1 1 76 76 ASN C C 76 171.155 171.155 174.865 -3.710 25342 4608 1 6 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.129 -2.195 25342 4609 1 6 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.551 -2.893 25342 4610 1 6 . 1 1 76 76 ASN H H 76 7.750 7.750 8.000 -0.250 25342 4611 1 6 . 1 1 77 77 TYR N N 77 116.878 116.878 119.334 -2.456 25342 4612 1 6 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.691 -0.337 25342 4613 1 6 . 1 1 77 77 TYR C C 77 172.224 172.224 175.717 -3.493 25342 4614 1 6 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.224 -2.984 25342 4615 1 6 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.848 -2.735 25342 4616 1 6 . 1 1 77 77 TYR H H 77 7.789 7.789 7.872 -0.083 25342 4617 1 6 . 1 1 78 78 ASP N N 78 121.352 121.352 119.847 1.505 25342 4618 1 6 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.758 0.039 25342 4619 1 6 . 1 1 78 78 ASP C C 78 172.623 172.623 175.517 -2.894 25342 4620 1 6 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.174 -2.984 25342 4621 1 6 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.200 -2.165 25342 4622 1 6 . 1 1 78 78 ASP H H 78 9.036 9.036 8.564 0.472 25342 4623 1 6 . 1 1 79 79 LEU N N 79 123.073 123.073 118.403 4.670 25342 4624 1 6 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.387 -0.279 25342 4625 1 6 . 1 1 79 79 LEU C C 79 170.730 170.730 174.665 -3.935 25342 4626 1 6 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.773 -2.516 25342 4627 1 6 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.199 -3.915 25342 4628 1 6 . 1 1 79 79 LEU H H 79 7.877 7.877 7.982 -0.105 25342 4629 1 6 . 1 1 80 80 ILE N N 80 126.348 126.348 123.252 3.096 25342 4630 1 6 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.857 0.212 25342 4631 1 6 . 1 1 80 80 ILE C C 80 171.584 171.584 174.342 -2.758 25342 4632 1 6 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.227 -2.812 25342 4633 1 6 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.718 -2.720 25342 4634 1 6 . 1 1 80 80 ILE H H 80 8.704 8.704 8.070 0.634 25342 4635 1 6 . 1 1 81 81 LEU N N 81 126.303 126.303 128.010 -1.707 25342 4636 1 6 . 1 1 81 81 LEU HA H 81 5.123 5.123 5.073 0.050 25342 4637 1 6 . 1 1 81 81 LEU C C 81 172.779 172.779 175.720 -2.941 25342 4638 1 6 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.831 -4.322 25342 4639 1 6 . 1 1 81 81 LEU CB C 81 41.715 41.715 44.635 -2.920 25342 4640 1 6 . 1 1 81 81 LEU H H 81 9.202 9.202 8.111 1.091 25342 4641 1 6 . 1 1 82 82 ILE N N 82 120.931 120.931 120.860 0.071 25342 4642 1 6 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.130 -0.283 25342 4643 1 6 . 1 1 82 82 ILE C C 82 172.796 172.796 175.271 -2.475 25342 4644 1 6 . 1 1 82 82 ILE CA C 82 56.881 56.881 60.271 -3.390 25342 4645 1 6 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.054 -4.257 25342 4646 1 6 . 1 1 82 82 ILE H H 82 8.846 8.846 8.276 0.570 25342 4647 1 6 . 1 1 83 83 GLY N N 83 120.905 120.905 113.018 7.887 25342 4648 1 6 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.021 -2.464 25342 4649 1 6 . 1 1 83 83 GLY H H 83 9.558 9.558 8.223 1.335 25342 4650 1 6 . 1 1 84 84 SER N N 84 116.601 116.601 115.099 1.502 25342 4651 1 6 . 1 1 84 84 SER HA H 84 5.476 5.476 5.093 0.383 25342 4652 1 6 . 1 1 84 84 SER CA C 84 51.324 51.324 55.586 -4.262 25342 4653 1 6 . 1 1 84 84 SER CB C 84 64.271 64.271 64.825 -0.554 25342 4654 1 6 . 1 1 84 84 SER H H 84 7.533 7.533 7.517 0.016 25342 4655 1 6 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.370 0.793 25342 4656 1 6 . 1 1 85 85 PRO C C 85 175.590 175.590 176.350 -0.760 25342 4657 1 6 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.363 -3.480 25342 4658 1 6 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.409 -1.935 25342 4659 1 6 . 1 1 86 86 VAL N N 86 116.295 116.295 121.276 -4.981 25342 4660 1 6 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.125 -0.304 25342 4661 1 6 . 1 1 86 86 VAL C C 86 172.692 172.692 175.659 -2.967 25342 4662 1 6 . 1 1 86 86 VAL CA C 86 59.812 59.812 63.961 -4.149 25342 4663 1 6 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.156 -2.073 25342 4664 1 6 . 1 1 86 86 VAL H H 86 7.246 7.246 7.628 -0.382 25342 4665 1 6 . 1 1 87 87 TRP N N 87 131.042 131.042 128.140 2.902 25342 4666 1 6 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.781 -0.470 25342 4667 1 6 . 1 1 87 87 TRP C C 87 173.323 173.323 175.935 -2.612 25342 4668 1 6 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.132 -4.245 25342 4669 1 6 . 1 1 87 87 TRP CB C 87 27.310 27.310 32.221 -4.912 25342 4670 1 6 . 1 1 87 87 TRP H H 87 9.555 9.555 9.138 0.417 25342 4671 1 6 . 1 1 88 88 SER N N 88 122.660 122.660 117.577 5.083 25342 4672 1 6 . 1 1 88 88 SER HA H 88 4.582 4.582 4.276 0.306 25342 4673 1 6 . 1 1 88 88 SER C C 88 172.096 172.096 175.180 -3.084 25342 4674 1 6 . 1 1 88 88 SER CA C 88 55.391 55.391 59.607 -4.216 25342 4675 1 6 . 1 1 88 88 SER CB C 88 57.813 57.813 61.903 -4.090 25342 4676 1 6 . 1 1 88 88 SER H H 88 10.257 10.257 9.036 1.221 25342 4677 1 6 . 1 1 89 89 GLY N N 89 128.381 128.381 113.965 14.416 25342 4678 1 6 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.763 -2.134 25342 4679 1 6 . 1 1 89 89 GLY H H 89 6.372 6.372 8.189 -1.817 25342 4680 1 6 . 1 1 90 90 TYR N N 90 120.345 120.345 117.246 3.099 25342 4681 1 6 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.756 -0.567 25342 4682 1 6 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.634 -1.085 25342 4683 1 6 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.999 -1.804 25342 4684 1 6 . 1 1 90 90 TYR H H 90 8.113 8.113 7.410 0.703 25342 4685 1 6 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.981 -0.147 25342 4686 1 6 . 1 1 91 91 PRO C C 91 170.911 170.911 177.286 -6.375 25342 4687 1 6 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.415 -3.580 25342 4688 1 6 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.017 -5.947 25342 4689 1 6 . 1 1 92 92 ALA N N 92 120.629 120.629 124.775 -4.146 25342 4690 1 6 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.655 -0.036 25342 4691 1 6 . 1 1 92 92 ALA C C 92 176.782 176.782 176.542 0.240 25342 4692 1 6 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.405 -0.988 25342 4693 1 6 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.652 -1.136 25342 4694 1 6 . 1 1 92 92 ALA H H 92 7.554 7.554 8.723 -1.169 25342 4695 1 6 . 1 1 93 93 THR N N 93 112.558 112.558 109.358 3.200 25342 4696 1 6 . 1 1 93 93 THR CB C 93 64.173 64.173 67.506 -3.333 25342 4697 1 6 . 1 1 93 93 THR H H 93 6.730 6.730 7.687 -0.957 25342 4698 1 6 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.564 -0.705 25342 4699 1 6 . 1 1 94 94 PRO C C 94 173.309 173.309 176.053 -2.744 25342 4700 1 6 . 1 1 94 94 PRO CA C 94 63.063 63.063 63.853 -0.791 25342 4701 1 6 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.857 -2.578 25342 4702 1 6 . 1 1 95 95 ILE N N 95 111.014 111.014 117.294 -6.280 25342 4703 1 6 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.376 -0.771 25342 4704 1 6 . 1 1 95 95 ILE C C 95 174.302 174.302 177.122 -2.820 25342 4705 1 6 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.736 -2.555 25342 4706 1 6 . 1 1 95 95 ILE CB C 95 31.783 31.783 37.029 -5.247 25342 4707 1 6 . 1 1 95 95 ILE H H 95 7.995 7.995 7.937 0.058 25342 4708 1 6 . 1 1 96 96 LYS N N 96 123.208 123.208 122.511 0.697 25342 4709 1 6 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.984 -0.892 25342 4710 1 6 . 1 1 96 96 LYS C C 96 174.451 174.451 178.177 -3.726 25342 4711 1 6 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.733 -2.692 25342 4712 1 6 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.653 -2.906 25342 4713 1 6 . 1 1 96 96 LYS H H 96 6.928 6.928 7.497 -0.569 25342 4714 1 6 . 1 1 97 97 THR N N 97 113.320 113.320 113.752 -0.432 25342 4715 1 6 . 1 1 97 97 THR HA H 97 3.436 3.436 3.831 -0.395 25342 4716 1 6 . 1 1 97 97 THR C C 97 173.221 173.221 176.279 -3.058 25342 4717 1 6 . 1 1 97 97 THR CA C 97 62.710 62.710 66.606 -3.896 25342 4718 1 6 . 1 1 97 97 THR CB C 97 65.562 65.562 68.274 -2.712 25342 4719 1 6 . 1 1 97 97 THR H H 97 6.325 6.325 8.358 -2.033 25342 4720 1 6 . 1 1 98 98 LEU N N 98 120.963 120.963 121.800 -0.837 25342 4721 1 6 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.231 -0.606 25342 4722 1 6 . 1 1 98 98 LEU C C 98 174.713 174.713 177.920 -3.207 25342 4723 1 6 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.315 -1.801 25342 4724 1 6 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.856 -2.128 25342 4725 1 6 . 1 1 98 98 LEU H H 98 7.536 7.536 7.523 0.013 25342 4726 1 6 . 1 1 99 99 LEU N N 99 118.859 118.859 119.414 -0.555 25342 4727 1 6 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.904 -0.232 25342 4728 1 6 . 1 1 99 99 LEU C C 99 177.458 177.458 178.495 -1.037 25342 4729 1 6 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.556 -3.411 25342 4730 1 6 . 1 1 99 99 LEU CB C 99 38.857 38.857 40.930 -2.073 25342 4731 1 6 . 1 1 99 99 LEU H H 99 8.179 8.179 8.300 -0.121 25342 4732 1 6 . 1 1 100 100 ASP N N 100 118.703 118.703 118.189 0.514 25342 4733 1 6 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.284 -0.063 25342 4734 1 6 . 1 1 100 100 ASP C C 100 176.472 176.472 178.264 -1.792 25342 4735 1 6 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.995 -2.688 25342 4736 1 6 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.589 -3.231 25342 4737 1 6 . 1 1 100 100 ASP H H 100 7.867 7.867 8.054 -0.187 25342 4738 1 6 . 1 1 101 101 GLN N N 101 117.829 117.829 117.573 0.256 25342 4739 1 6 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.181 0.019 25342 4740 1 6 . 1 1 101 101 GLN C C 101 174.508 174.508 178.217 -3.709 25342 4741 1 6 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.276 -3.588 25342 4742 1 6 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.220 -3.623 25342 4743 1 6 . 1 1 101 101 GLN H H 101 7.597 7.597 7.521 0.076 25342 4744 1 6 . 1 1 102 102 MET N N 102 118.406 118.406 114.657 3.749 25342 4745 1 6 . 1 1 102 102 MET HA H 102 3.864 3.864 4.550 -0.686 25342 4746 1 6 . 1 1 102 102 MET C C 102 172.820 172.820 177.695 -4.875 25342 4747 1 6 . 1 1 102 102 MET CA C 102 53.298 53.298 57.313 -4.016 25342 4748 1 6 . 1 1 102 102 MET CB C 102 31.207 31.207 32.278 -1.071 25342 4749 1 6 . 1 1 102 102 MET H H 102 7.434 7.434 8.289 -0.855 25342 4750 1 6 . 1 1 103 103 LYS N N 103 115.889 115.889 117.535 -1.646 25342 4751 1 6 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.088 -0.169 25342 4752 1 6 . 1 1 103 103 LYS C C 103 173.938 173.938 176.800 -2.862 25342 4753 1 6 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.207 -1.770 25342 4754 1 6 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.442 -2.179 25342 4755 1 6 . 1 1 103 103 LYS H H 103 6.881 6.881 7.774 -0.893 25342 4756 1 6 . 1 1 104 104 ASN N N 104 114.951 114.951 114.885 0.066 25342 4757 1 6 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.838 -0.107 25342 4758 1 6 . 1 1 104 104 ASN C C 104 172.617 172.617 175.052 -2.435 25342 4759 1 6 . 1 1 104 104 ASN CA C 104 50.266 50.266 52.856 -2.590 25342 4760 1 6 . 1 1 104 104 ASN CB C 104 35.783 35.783 40.027 -4.244 25342 4761 1 6 . 1 1 104 104 ASN H H 104 8.493 8.493 7.907 0.586 25342 4762 1 6 . 1 1 105 105 TYR N N 105 122.680 122.680 123.539 -0.859 25342 4763 1 6 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.516 0.046 25342 4764 1 6 . 1 1 105 105 TYR CA C 105 55.433 55.433 60.108 -4.675 25342 4765 1 6 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.161 -3.329 25342 4766 1 6 . 1 1 105 105 TYR H H 105 8.217 8.217 7.746 0.471 25342 4767 1 6 . 1 1 106 106 ARG N N 106 128.872 128.872 126.158 2.714 25342 4768 1 6 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.464 -0.199 25342 4769 1 6 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.649 -1.667 25342 4770 1 6 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.594 -4.464 25342 4771 1 6 . 1 1 106 106 ARG H H 106 8.801 8.801 7.923 0.878 25342 4772 1 6 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.679 -2.278 25342 4773 1 6 . 1 1 108 108 GLU N N 108 117.000 117.000 120.964 -3.964 25342 4774 1 6 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.642 -0.016 25342 4775 1 6 . 1 1 108 108 GLU C C 108 174.125 174.125 175.482 -1.357 25342 4776 1 6 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.026 -2.238 25342 4777 1 6 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.925 -1.485 25342 4778 1 6 . 1 1 108 108 GLU H H 108 7.514 7.514 8.477 -0.963 25342 4779 1 6 . 1 1 109 109 VAL N N 109 123.398 123.398 120.754 2.644 25342 4780 1 6 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.083 0.254 25342 4781 1 6 . 1 1 109 109 VAL C C 109 170.606 170.606 173.917 -3.311 25342 4782 1 6 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.655 -3.375 25342 4783 1 6 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.870 -3.213 25342 4784 1 6 . 1 1 109 109 VAL H H 109 8.942 8.942 8.172 0.770 25342 4785 1 6 . 1 1 110 110 ALA N N 110 127.905 127.905 127.488 0.417 25342 4786 1 6 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.698 -0.071 25342 4787 1 6 . 1 1 110 110 ALA C C 110 173.195 173.195 175.440 -2.245 25342 4788 1 6 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.822 -2.476 25342 4789 1 6 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.028 -3.703 25342 4790 1 6 . 1 1 110 110 ALA H H 110 8.776 8.776 8.612 0.164 25342 4791 1 6 . 1 1 111 111 SER N N 111 110.523 110.523 114.793 -4.270 25342 4792 1 6 . 1 1 111 111 SER HA H 111 5.562 5.562 5.195 0.367 25342 4793 1 6 . 1 1 111 111 SER C C 111 170.719 170.719 173.735 -3.016 25342 4794 1 6 . 1 1 111 111 SER CA C 111 51.314 51.314 57.359 -6.045 25342 4795 1 6 . 1 1 111 111 SER CB C 111 61.907 61.907 63.535 -1.628 25342 4796 1 6 . 1 1 111 111 SER H H 111 7.480 7.480 7.887 -0.407 25342 4797 1 6 . 1 1 112 112 PHE N N 112 125.567 125.567 123.248 2.319 25342 4798 1 6 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.621 0.735 25342 4799 1 6 . 1 1 112 112 PHE C C 112 169.536 169.536 174.133 -4.597 25342 4800 1 6 . 1 1 112 112 PHE CA C 112 50.371 50.371 56.761 -6.390 25342 4801 1 6 . 1 1 112 112 PHE CB C 112 39.788 39.788 40.131 -0.343 25342 4802 1 6 . 1 1 112 112 PHE H H 112 7.848 7.848 7.816 0.032 25342 4803 1 6 . 1 1 113 113 PHE N N 113 115.065 115.065 113.973 1.092 25342 4804 1 6 . 1 1 113 113 PHE HA H 113 6.104 6.104 4.901 1.203 25342 4805 1 6 . 1 1 113 113 PHE C C 113 173.006 173.006 173.332 -0.326 25342 4806 1 6 . 1 1 113 113 PHE CA C 113 50.262 50.262 54.635 -4.373 25342 4807 1 6 . 1 1 113 113 PHE CB C 113 38.749 38.749 41.160 -2.411 25342 4808 1 6 . 1 1 113 113 PHE H H 113 7.361 7.361 8.156 -0.795 25342 4809 1 6 . 1 1 114 114 THR N N 114 108.014 108.014 111.255 -3.241 25342 4810 1 6 . 1 1 114 114 THR HA H 114 4.999 4.999 4.401 0.598 25342 4811 1 6 . 1 1 114 114 THR C C 114 169.874 169.874 173.316 -3.442 25342 4812 1 6 . 1 1 114 114 THR CA C 114 56.500 56.500 60.221 -3.720 25342 4813 1 6 . 1 1 114 114 THR CB C 114 68.809 68.809 71.463 -2.654 25342 4814 1 6 . 1 1 114 114 THR H H 114 7.867 7.867 7.771 0.096 25342 4815 1 6 . 1 1 115 115 SER N N 115 115.049 115.049 119.632 -4.583 25342 4816 1 6 . 1 1 115 115 SER HA H 115 5.613 5.613 4.485 1.128 25342 4817 1 6 . 1 1 115 115 SER C C 115 171.247 171.247 174.212 -2.965 25342 4818 1 6 . 1 1 115 115 SER CA C 115 54.830 54.830 56.808 -1.978 25342 4819 1 6 . 1 1 115 115 SER CB C 115 63.992 63.992 65.527 -1.535 25342 4820 1 6 . 1 1 115 115 SER H H 115 8.970 8.970 8.293 0.677 25342 4821 1 6 . 1 1 116 116 ALA N N 116 122.671 122.671 122.881 -0.210 25342 4822 1 6 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.328 0.657 25342 4823 1 6 . 1 1 116 116 ALA C C 116 176.180 176.180 177.822 -1.642 25342 4824 1 6 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.255 -2.055 25342 4825 1 6 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.207 -2.212 25342 4826 1 6 . 1 1 116 116 ALA H H 116 8.963 8.963 8.541 0.422 25342 4827 1 6 . 1 1 117 117 GLY N N 117 107.387 107.387 107.432 -0.045 25342 4828 1 6 . 1 1 117 117 GLY C C 117 172.528 172.528 173.424 -0.896 25342 4829 1 6 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.517 -1.784 25342 4830 1 6 . 1 1 117 117 GLY H H 117 9.340 9.340 7.641 1.699 25342 4831 1 6 . 1 1 118 118 THR N N 118 113.481 113.481 110.767 2.714 25342 4832 1 6 . 1 1 118 118 THR HA H 118 4.651 4.651 4.611 0.040 25342 4833 1 6 . 1 1 118 118 THR C C 118 172.067 172.067 173.828 -1.761 25342 4834 1 6 . 1 1 118 118 THR CA C 118 57.357 57.357 60.204 -2.847 25342 4835 1 6 . 1 1 118 118 THR CB C 118 69.475 69.475 70.835 -1.360 25342 4836 1 6 . 1 1 118 118 THR H H 118 9.373 9.373 7.393 1.980 25342 4837 1 6 . 1 1 119 119 ASN N N 119 113.202 113.202 116.608 -3.406 25342 4838 1 6 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.409 0.209 25342 4839 1 6 . 1 1 119 119 ASN C C 119 173.114 173.114 176.521 -3.407 25342 4840 1 6 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.325 -2.642 25342 4841 1 6 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.218 -3.488 25342 4842 1 6 . 1 1 119 119 ASN H H 119 8.908 8.908 8.851 0.057 25342 4843 1 6 . 1 1 120 120 HIS N N 120 117.315 117.315 116.811 0.504 25342 4844 1 6 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.509 -0.723 25342 4845 1 6 . 1 1 120 120 HIS C C 120 174.381 174.381 176.976 -2.595 25342 4846 1 6 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.875 -4.359 25342 4847 1 6 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.756 -3.252 25342 4848 1 6 . 1 1 120 120 HIS H H 120 8.074 8.074 8.706 -0.632 25342 4849 1 6 . 1 1 121 121 LYS N N 121 118.678 118.678 118.976 -0.298 25342 4850 1 6 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.918 -0.084 25342 4851 1 6 . 1 1 121 121 LYS C C 121 176.564 176.564 178.622 -2.058 25342 4852 1 6 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.039 -1.744 25342 4853 1 6 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.916 -2.974 25342 4854 1 6 . 1 1 121 121 LYS H H 121 8.336 8.336 7.873 0.463 25342 4855 1 6 . 1 1 122 122 ALA N N 122 122.146 122.146 122.583 -0.437 25342 4856 1 6 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.176 -0.481 25342 4857 1 6 . 1 1 122 122 ALA C C 122 175.163 175.163 179.686 -4.523 25342 4858 1 6 . 1 1 122 122 ALA CA C 122 51.692 51.692 55.027 -3.335 25342 4859 1 6 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.001 -2.283 25342 4860 1 6 . 1 1 122 122 ALA H H 122 7.584 7.584 7.620 -0.036 25342 4861 1 6 . 1 1 123 123 TYR N N 123 119.730 119.730 120.203 -0.473 25342 4862 1 6 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.249 -1.096 25342 4863 1 6 . 1 1 123 123 TYR C C 123 174.340 174.340 177.892 -3.552 25342 4864 1 6 . 1 1 123 123 TYR CA C 123 60.398 60.398 62.097 -1.699 25342 4865 1 6 . 1 1 123 123 TYR CB C 123 34.663 34.663 38.529 -3.866 25342 4866 1 6 . 1 1 123 123 TYR H H 123 7.317 7.317 7.885 -0.568 25342 4867 1 6 . 1 1 124 124 VAL N N 124 118.649 118.649 118.930 -0.281 25342 4868 1 6 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.537 -0.335 25342 4869 1 6 . 1 1 124 124 VAL C C 124 175.603 175.603 178.328 -2.725 25342 4870 1 6 . 1 1 124 124 VAL CA C 124 64.680 64.680 67.517 -2.837 25342 4871 1 6 . 1 1 124 124 VAL CB C 124 29.289 29.289 31.259 -1.970 25342 4872 1 6 . 1 1 124 124 VAL H H 124 7.799 7.799 8.355 -0.556 25342 4873 1 6 . 1 1 125 125 SER N N 125 114.475 114.475 114.966 -0.491 25342 4874 1 6 . 1 1 125 125 SER HA H 125 4.032 4.032 4.155 -0.123 25342 4875 1 6 . 1 1 125 125 SER C C 125 174.849 174.849 176.863 -2.014 25342 4876 1 6 . 1 1 125 125 SER CA C 125 59.002 59.002 62.383 -3.381 25342 4877 1 6 . 1 1 125 125 SER CB C 125 59.613 59.613 62.884 -3.271 25342 4878 1 6 . 1 1 125 125 SER H H 125 7.766 7.766 8.155 -0.389 25342 4879 1 6 . 1 1 126 126 HIS N N 126 119.326 119.326 122.546 -3.220 25342 4880 1 6 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.341 -0.214 25342 4881 1 6 . 1 1 126 126 HIS C C 126 172.865 172.865 177.509 -4.644 25342 4882 1 6 . 1 1 126 126 HIS CA C 126 55.706 55.706 60.219 -4.513 25342 4883 1 6 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.383 -4.390 25342 4884 1 6 . 1 1 126 126 HIS H H 126 8.569 8.569 8.241 0.328 25342 4885 1 6 . 1 1 127 127 PHE N N 127 121.044 121.044 120.582 0.462 25342 4886 1 6 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.249 -1.075 25342 4887 1 6 . 1 1 127 127 PHE C C 127 173.378 173.378 176.985 -3.607 25342 4888 1 6 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.130 -0.263 25342 4889 1 6 . 1 1 127 127 PHE CB C 127 36.054 36.054 38.849 -2.795 25342 4890 1 6 . 1 1 127 127 PHE H H 127 9.139 9.139 8.920 0.219 25342 4891 1 6 . 1 1 128 128 ASN N N 128 114.893 114.893 117.133 -2.240 25342 4892 1 6 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.153 -0.113 25342 4893 1 6 . 1 1 128 128 ASN C C 128 175.230 175.230 177.525 -2.295 25342 4894 1 6 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.218 -1.918 25342 4895 1 6 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.339 -2.168 25342 4896 1 6 . 1 1 128 128 ASN H H 128 7.774 7.774 8.115 -0.341 25342 4897 1 6 . 1 1 129 129 GLU N N 129 119.804 119.804 121.338 -1.534 25342 4898 1 6 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.812 0.228 25342 4899 1 6 . 1 1 129 129 GLU C C 129 177.052 177.052 178.606 -1.554 25342 4900 1 6 . 1 1 129 129 GLU CA C 129 56.730 56.730 59.369 -2.639 25342 4901 1 6 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.317 -2.121 25342 4902 1 6 . 1 1 129 129 GLU H H 129 7.577 7.577 8.133 -0.556 25342 4903 1 6 . 1 1 130 130 TRP N N 130 120.979 120.979 117.303 3.676 25342 4904 1 6 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.332 0.124 25342 4905 1 6 . 1 1 130 130 TRP C C 130 174.329 174.329 174.849 -0.520 25342 4906 1 6 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.810 -2.122 25342 4907 1 6 . 1 1 130 130 TRP CB C 130 26.991 26.991 28.297 -1.306 25342 4908 1 6 . 1 1 130 130 TRP H H 130 8.225 8.225 8.020 0.205 25342 4909 1 6 . 1 1 131 131 ALA N N 131 120.450 120.450 119.426 1.024 25342 4910 1 6 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.278 -0.342 25342 4911 1 6 . 1 1 131 131 ALA C C 131 172.487 172.487 175.686 -3.199 25342 4912 1 6 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.560 -3.126 25342 4913 1 6 . 1 1 131 131 ALA CB C 131 16.288 16.288 20.183 -3.895 25342 4914 1 6 . 1 1 131 131 ALA H H 131 8.081 8.081 7.432 0.649 25342 4915 1 6 . 1 1 132 132 ASP N N 132 117.813 117.813 120.287 -2.474 25342 4916 1 6 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.365 -0.157 25342 4917 1 6 . 1 1 132 132 ASP C C 132 173.804 173.804 176.335 -2.531 25342 4918 1 6 . 1 1 132 132 ASP CA C 132 54.181 54.181 56.014 -1.833 25342 4919 1 6 . 1 1 132 132 ASP CB C 132 39.321 39.321 41.131 -1.810 25342 4920 1 6 . 1 1 132 132 ASP H H 132 6.772 6.772 7.586 -0.814 25342 4921 1 6 . 1 1 133 133 GLY N N 133 115.052 115.052 112.359 2.693 25342 4922 1 6 . 1 1 133 133 GLY C C 133 172.078 172.078 174.271 -2.193 25342 4923 1 6 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.657 -2.237 25342 4924 1 6 . 1 1 133 133 GLY H H 133 8.626 8.626 8.384 0.242 25342 4925 1 6 . 1 1 134 134 LEU N N 134 120.063 120.063 123.579 -3.516 25342 4926 1 6 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.245 0.227 25342 4927 1 6 . 1 1 134 134 LEU C C 134 174.079 174.079 176.161 -2.082 25342 4928 1 6 . 1 1 134 134 LEU CA C 134 50.964 50.964 54.217 -3.253 25342 4929 1 6 . 1 1 134 134 LEU CB C 134 40.370 40.370 42.516 -2.146 25342 4930 1 6 . 1 1 134 134 LEU H H 134 8.094 8.094 7.747 0.347 25342 4931 1 6 . 1 1 135 135 ASN N N 135 119.292 119.292 121.253 -1.961 25342 4932 1 6 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.583 0.040 25342 4933 1 6 . 1 1 135 135 ASN C C 135 170.527 170.527 174.451 -3.924 25342 4934 1 6 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.601 -4.599 25342 4935 1 6 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.410 -4.850 25342 4936 1 6 . 1 1 135 135 ASN H H 135 8.513 8.513 8.544 -0.031 25342 4937 1 6 . 1 1 136 136 VAL N N 136 125.412 125.412 123.960 1.452 25342 4938 1 6 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.640 -0.034 25342 4939 1 6 . 1 1 136 136 VAL C C 136 175.420 175.420 176.455 -1.035 25342 4940 1 6 . 1 1 136 136 VAL CA C 136 58.382 58.382 61.026 -2.644 25342 4941 1 6 . 1 1 136 136 VAL CB C 136 29.247 29.247 34.118 -4.872 25342 4942 1 6 . 1 1 136 136 VAL H H 136 7.648 7.648 8.312 -0.664 25342 4943 1 6 . 1 1 137 137 ILE N N 137 121.881 121.881 120.116 1.765 25342 4944 1 6 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.577 -0.144 25342 4945 1 6 . 1 1 137 137 ILE C C 137 173.906 173.906 174.993 -1.087 25342 4946 1 6 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.988 -2.010 25342 4947 1 6 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.788 -2.592 25342 4948 1 6 . 1 1 137 137 ILE H H 137 9.139 9.139 8.813 0.326 25342 4949 1 6 . 1 1 138 138 GLY N N 138 108.226 108.226 106.131 2.095 25342 4950 1 6 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.312 -1.921 25342 4951 1 6 . 1 1 138 138 GLY H H 138 6.645 6.645 7.445 -0.800 25342 4952 1 6 . 1 1 139 139 VAL N N 139 119.408 119.408 121.059 -1.651 25342 4953 1 6 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.376 0.981 25342 4954 1 6 . 1 1 139 139 VAL C C 139 172.327 172.327 175.441 -3.114 25342 4955 1 6 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.961 -3.694 25342 4956 1 6 . 1 1 139 139 VAL CB C 139 32.743 32.743 32.061 0.682 25342 4957 1 6 . 1 1 139 139 VAL H H 139 8.092 8.092 8.594 -0.502 25342 4958 1 6 . 1 1 140 140 ALA N N 140 127.415 127.415 130.840 -3.425 25342 4959 1 6 . 1 1 140 140 ALA HA H 140 4.445 4.445 4.910 -0.465 25342 4960 1 6 . 1 1 140 140 ALA C C 140 170.718 170.718 175.946 -5.228 25342 4961 1 6 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.657 -1.758 25342 4962 1 6 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.332 -1.273 25342 4963 1 6 . 1 1 140 140 ALA H H 140 9.093 9.093 8.458 0.635 25342 4964 1 6 . 1 1 141 141 ARG N N 141 119.287 119.287 119.787 -0.500 25342 4965 1 6 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.139 -2.652 25342 4966 1 6 . 1 1 141 141 ARG C C 141 173.375 173.375 176.525 -3.150 25342 4967 1 6 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.688 -3.804 25342 4968 1 6 . 1 1 141 141 ARG CB C 141 28.684 28.684 31.491 -2.807 25342 4969 1 6 . 1 1 141 141 ARG H H 141 7.620 7.620 8.549 -0.929 25342 4970 1 6 . 1 1 142 142 ASP N N 142 125.999 125.999 121.321 4.678 25342 4971 1 6 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.338 -0.614 25342 4972 1 6 . 1 1 142 142 ASP C C 142 169.292 169.292 176.433 -7.141 25342 4973 1 6 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.313 -2.975 25342 4974 1 6 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.353 -3.676 25342 4975 1 6 . 1 1 142 142 ASP H H 142 9.482 9.482 8.770 0.712 25342 4976 1 6 . 1 1 143 143 ASP N N 143 119.293 119.293 119.641 -0.348 25342 4977 1 6 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.375 -0.069 25342 4978 1 6 . 1 1 143 143 ASP C C 143 175.686 175.686 177.323 -1.637 25342 4979 1 6 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.468 -5.563 25342 4980 1 6 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.143 -3.831 25342 4981 1 6 . 1 1 143 143 ASP H H 143 8.108 8.108 8.527 -0.419 25342 4982 1 6 . 1 1 144 144 SER N N 144 115.303 115.303 115.395 -0.092 25342 4983 1 6 . 1 1 144 144 SER HA H 144 3.740 3.740 4.163 -0.423 25342 4984 1 6 . 1 1 144 144 SER C C 144 172.925 172.925 174.714 -1.789 25342 4985 1 6 . 1 1 144 144 SER CA C 144 59.213 59.213 60.860 -1.647 25342 4986 1 6 . 1 1 144 144 SER CB C 144 60.806 60.806 63.009 -2.203 25342 4987 1 6 . 1 1 144 144 SER H H 144 7.642 7.642 7.685 -0.043 25342 4988 1 6 . 1 1 145 145 GLU N N 145 119.523 119.523 119.295 0.228 25342 4989 1 6 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.095 0.211 25342 4990 1 6 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.588 -3.549 25342 4991 1 6 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.634 -2.834 25342 4992 1 6 . 1 1 145 145 GLU H H 145 7.771 7.771 7.743 0.028 25342 4993 1 6 . 1 1 146 146 VAL N N 146 118.683 118.683 120.674 -1.991 25342 4994 1 6 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.558 -0.617 25342 4995 1 6 . 1 1 146 146 VAL C C 146 174.591 174.591 176.807 -2.216 25342 4996 1 6 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.764 -2.832 25342 4997 1 6 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.659 -2.612 25342 4998 1 6 . 1 1 146 146 VAL H H 146 6.352 6.352 7.076 -0.724 25342 4999 1 6 . 1 1 147 147 ASP N N 147 119.312 119.312 115.006 4.306 25342 5000 1 6 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.344 -0.289 25342 5001 1 6 . 1 1 147 147 ASP C C 147 174.783 174.783 177.021 -2.238 25342 5002 1 6 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.316 -2.075 25342 5003 1 6 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.828 -3.595 25342 5004 1 6 . 1 1 147 147 ASP H H 147 8.370 8.370 8.479 -0.108 25342 5005 1 6 . 1 1 148 148 LYS N N 148 119.342 119.342 116.288 3.054 25342 5006 1 6 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.395 -0.458 25342 5007 1 6 . 1 1 148 148 LYS C C 148 176.384 176.384 179.120 -2.736 25342 5008 1 6 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.548 -1.842 25342 5009 1 6 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.501 -2.990 25342 5010 1 6 . 1 1 148 148 LYS H H 148 7.040 7.040 7.524 -0.484 25342 5011 1 6 . 1 1 149 149 TRP N N 149 118.258 118.258 120.892 -2.634 25342 5012 1 6 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.734 -0.143 25342 5013 1 6 . 1 1 149 149 TRP C C 149 174.212 174.212 177.261 -3.049 25342 5014 1 6 . 1 1 149 149 TRP CA C 149 53.745 53.745 57.208 -3.463 25342 5015 1 6 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.401 -1.461 25342 5016 1 6 . 1 1 149 149 TRP H H 149 7.811 7.811 8.066 -0.255 25342 5017 1 6 . 1 1 150 150 SER N N 150 109.618 109.618 111.117 -1.499 25342 5018 1 6 . 1 1 150 150 SER HA H 150 4.234 4.234 4.660 -0.426 25342 5019 1 6 . 1 1 150 150 SER C C 150 170.189 170.189 173.997 -3.808 25342 5020 1 6 . 1 1 150 150 SER CA C 150 56.695 56.695 57.508 -0.813 25342 5021 1 6 . 1 1 150 150 SER CB C 150 61.935 61.935 63.442 -1.507 25342 5022 1 6 . 1 1 150 150 SER H H 150 7.793 7.793 7.891 -0.098 25342 5023 1 7 . 1 1 3 3 ALA N N 3 125.638 125.638 122.119 3.519 25342 5024 1 7 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.527 -0.162 25342 5025 1 7 . 1 1 3 3 ALA CA C 3 49.298 49.298 51.473 -2.175 25342 5026 1 7 . 1 1 3 3 ALA CB C 3 16.859 16.859 18.839 -1.980 25342 5027 1 7 . 1 1 3 3 ALA H H 3 8.325 8.325 8.187 0.138 25342 5028 1 7 . 1 1 4 4 LYS N N 4 121.813 121.813 121.513 0.300 25342 5029 1 7 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.528 -0.301 25342 5030 1 7 . 1 1 4 4 LYS C C 4 174.574 174.574 174.702 -0.128 25342 5031 1 7 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.420 -1.639 25342 5032 1 7 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.044 -0.554 25342 5033 1 7 . 1 1 4 4 LYS H H 4 8.486 8.486 8.147 0.339 25342 5034 1 7 . 1 1 5 5 LYS N N 5 129.722 129.722 123.327 6.395 25342 5035 1 7 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.711 -0.193 25342 5036 1 7 . 1 1 5 5 LYS C C 5 174.720 174.720 174.739 -0.019 25342 5037 1 7 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.654 -0.932 25342 5038 1 7 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.585 -6.800 25342 5039 1 7 . 1 1 5 5 LYS H H 5 10.015 10.015 8.449 1.566 25342 5040 1 7 . 1 1 6 6 THR N N 6 126.254 126.254 118.698 7.556 25342 5041 1 7 . 1 1 6 6 THR HA H 6 5.654 5.654 5.162 0.492 25342 5042 1 7 . 1 1 6 6 THR C C 6 169.926 169.926 172.826 -2.900 25342 5043 1 7 . 1 1 6 6 THR CA C 6 60.598 60.598 61.876 -1.278 25342 5044 1 7 . 1 1 6 6 THR CB C 6 68.041 68.041 69.749 -1.708 25342 5045 1 7 . 1 1 6 6 THR H H 6 8.538 8.538 8.596 -0.058 25342 5046 1 7 . 1 1 7 7 LEU N N 7 130.775 130.775 129.851 0.924 25342 5047 1 7 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.710 -0.116 25342 5048 1 7 . 1 1 7 7 LEU C C 7 170.404 170.404 174.647 -4.243 25342 5049 1 7 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.211 -3.278 25342 5050 1 7 . 1 1 7 7 LEU CB C 7 40.728 40.728 42.933 -2.205 25342 5051 1 7 . 1 1 7 7 LEU H H 7 8.575 8.575 8.383 0.192 25342 5052 1 7 . 1 1 8 8 ILE N N 8 127.242 127.242 128.431 -1.189 25342 5053 1 7 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.426 0.422 25342 5054 1 7 . 1 1 8 8 ILE C C 8 170.936 170.936 174.843 -3.907 25342 5055 1 7 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.792 -3.540 25342 5056 1 7 . 1 1 8 8 ILE CB C 8 36.935 36.935 37.526 -0.591 25342 5057 1 7 . 1 1 8 8 ILE H H 8 9.217 9.217 7.917 1.300 25342 5058 1 7 . 1 1 9 9 LEU N N 9 127.183 127.183 128.576 -1.393 25342 5059 1 7 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.971 0.723 25342 5060 1 7 . 1 1 9 9 LEU C C 9 173.824 173.824 176.016 -2.192 25342 5061 1 7 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.853 -4.014 25342 5062 1 7 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.544 1.419 25342 5063 1 7 . 1 1 9 9 LEU H H 9 9.248 9.248 8.589 0.659 25342 5064 1 7 . 1 1 10 10 TYR N N 10 113.330 113.330 121.282 -7.952 25342 5065 1 7 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.491 0.023 25342 5066 1 7 . 1 1 10 10 TYR C C 10 167.898 167.898 172.995 -5.097 25342 5067 1 7 . 1 1 10 10 TYR CA C 10 52.875 52.875 54.282 -1.407 25342 5068 1 7 . 1 1 10 10 TYR CB C 10 38.436 38.436 41.510 -3.074 25342 5069 1 7 . 1 1 10 10 TYR H H 10 7.306 7.306 9.402 -2.096 25342 5070 1 7 . 1 1 11 11 TYR N N 11 121.297 121.297 123.835 -2.538 25342 5071 1 7 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.007 -0.245 25342 5072 1 7 . 1 1 11 11 TYR C C 11 169.698 169.698 174.447 -4.749 25342 5073 1 7 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.751 -0.704 25342 5074 1 7 . 1 1 11 11 TYR CB C 11 40.538 40.538 39.957 0.581 25342 5075 1 7 . 1 1 11 11 TYR H H 11 7.891 7.891 8.297 -0.406 25342 5076 1 7 . 1 1 12 12 SER N N 12 117.763 117.763 124.364 -6.601 25342 5077 1 7 . 1 1 12 12 SER HA H 12 4.679 4.679 4.219 0.460 25342 5078 1 7 . 1 1 12 12 SER C C 12 170.075 170.075 174.373 -4.298 25342 5079 1 7 . 1 1 12 12 SER CA C 12 53.619 53.619 56.805 -3.186 25342 5080 1 7 . 1 1 12 12 SER CB C 12 62.847 62.847 62.695 0.152 25342 5081 1 7 . 1 1 12 12 SER H H 12 7.557 7.557 8.305 -0.748 25342 5082 1 7 . 1 1 13 13 TRP N N 13 135.232 135.232 130.024 5.208 25342 5083 1 7 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.763 0.873 25342 5084 1 7 . 1 1 13 13 TRP C C 13 175.708 175.708 175.603 0.105 25342 5085 1 7 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.349 -2.233 25342 5086 1 7 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.460 -1.825 25342 5087 1 7 . 1 1 13 13 TRP H H 13 9.755 9.755 7.796 1.959 25342 5088 1 7 . 1 1 14 14 SER N N 14 113.789 113.789 110.412 3.377 25342 5089 1 7 . 1 1 14 14 SER HA H 14 4.223 4.223 4.504 -0.281 25342 5090 1 7 . 1 1 14 14 SER C C 14 172.747 172.747 173.621 -0.874 25342 5091 1 7 . 1 1 14 14 SER CA C 14 53.828 53.828 58.455 -4.627 25342 5092 1 7 . 1 1 14 14 SER CB C 14 60.037 60.037 64.084 -4.047 25342 5093 1 7 . 1 1 14 14 SER H H 14 10.026 10.026 8.447 1.579 25342 5094 1 7 . 1 1 15 15 GLY N N 15 110.489 110.489 108.760 1.729 25342 5095 1 7 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.350 -0.691 25342 5096 1 7 . 1 1 15 15 GLY H H 15 7.391 7.391 8.282 -0.891 25342 5097 1 7 . 1 1 16 16 GLU N N 16 129.005 129.005 119.953 9.052 25342 5098 1 7 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.354 -0.291 25342 5099 1 7 . 1 1 16 16 GLU CA C 16 56.761 56.761 56.548 0.213 25342 5100 1 7 . 1 1 16 16 GLU CB C 16 26.412 26.412 30.387 -3.975 25342 5101 1 7 . 1 1 16 16 GLU H H 16 11.550 11.550 8.134 3.416 25342 5102 1 7 . 1 1 17 17 THR N N 17 123.016 123.016 116.080 6.936 25342 5103 1 7 . 1 1 17 17 THR HA H 17 4.035 4.035 3.969 0.066 25342 5104 1 7 . 1 1 17 17 THR C C 17 173.360 173.360 176.198 -2.838 25342 5105 1 7 . 1 1 17 17 THR CA C 17 64.303 64.303 66.034 -1.731 25342 5106 1 7 . 1 1 17 17 THR CB C 17 63.999 63.999 68.490 -4.491 25342 5107 1 7 . 1 1 17 17 THR H H 17 11.293 11.293 8.298 2.995 25342 5108 1 7 . 1 1 18 18 LYS N N 18 120.156 120.156 120.141 0.015 25342 5109 1 7 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.332 -1.476 25342 5110 1 7 . 1 1 18 18 LYS C C 18 173.901 173.901 178.813 -4.912 25342 5111 1 7 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.274 -2.440 25342 5112 1 7 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.252 -2.771 25342 5113 1 7 . 1 1 18 18 LYS H H 18 6.940 6.940 8.294 -1.354 25342 5114 1 7 . 1 1 19 19 LYS N N 19 117.237 117.237 118.208 -0.971 25342 5115 1 7 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.042 -0.119 25342 5116 1 7 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.184 -2.860 25342 5117 1 7 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.167 -2.806 25342 5118 1 7 . 1 1 19 19 LYS H H 19 7.212 7.212 7.516 -0.304 25342 5119 1 7 . 1 1 20 20 MET N N 20 119.268 119.268 117.203 2.065 25342 5120 1 7 . 1 1 20 20 MET HA H 20 4.413 4.413 4.161 0.252 25342 5121 1 7 . 1 1 20 20 MET C C 20 173.625 173.625 176.990 -3.365 25342 5122 1 7 . 1 1 20 20 MET CA C 20 52.261 52.261 55.654 -3.393 25342 5123 1 7 . 1 1 20 20 MET CB C 20 26.680 26.680 31.854 -5.174 25342 5124 1 7 . 1 1 20 20 MET H H 20 7.600 7.600 7.700 -0.100 25342 5125 1 7 . 1 1 21 21 ALA N N 21 123.669 123.669 121.603 2.066 25342 5126 1 7 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.772 -0.290 25342 5127 1 7 . 1 1 21 21 ALA C C 21 176.628 176.628 178.748 -2.120 25342 5128 1 7 . 1 1 21 21 ALA CA C 21 52.374 52.374 54.708 -2.334 25342 5129 1 7 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.814 -1.319 25342 5130 1 7 . 1 1 21 21 ALA H H 21 8.738 8.738 7.321 1.417 25342 5131 1 7 . 1 1 22 22 GLU N N 22 117.242 117.242 118.796 -1.554 25342 5132 1 7 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.808 -0.135 25342 5133 1 7 . 1 1 22 22 GLU C C 22 176.698 176.698 178.754 -2.056 25342 5134 1 7 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.227 -2.688 25342 5135 1 7 . 1 1 22 22 GLU CB C 22 26.434 26.434 28.983 -2.549 25342 5136 1 7 . 1 1 22 22 GLU H H 22 7.959 7.959 7.809 0.150 25342 5137 1 7 . 1 1 23 23 LYS N N 23 123.302 123.302 120.393 2.909 25342 5138 1 7 . 1 1 23 23 LYS HA H 23 3.821 3.821 3.949 -0.128 25342 5139 1 7 . 1 1 23 23 LYS C C 23 177.389 177.389 178.749 -1.360 25342 5140 1 7 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.932 -3.010 25342 5141 1 7 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.317 -2.803 25342 5142 1 7 . 1 1 23 23 LYS H H 23 7.703 7.703 7.501 0.202 25342 5143 1 7 . 1 1 24 24 ILE N N 24 122.208 122.208 117.916 4.292 25342 5144 1 7 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.647 -0.364 25342 5145 1 7 . 1 1 24 24 ILE C C 24 174.934 174.934 177.430 -2.496 25342 5146 1 7 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.380 -1.088 25342 5147 1 7 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.628 -2.890 25342 5148 1 7 . 1 1 24 24 ILE H H 24 8.535 8.535 7.523 1.012 25342 5149 1 7 . 1 1 25 25 ASN N N 25 118.640 118.640 118.045 0.595 25342 5150 1 7 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.320 -0.093 25342 5151 1 7 . 1 1 25 25 ASN C C 25 173.530 173.530 177.379 -3.849 25342 5152 1 7 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.410 -4.199 25342 5153 1 7 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.917 -0.813 25342 5154 1 7 . 1 1 25 25 ASN H H 25 8.317 8.317 8.303 0.014 25342 5155 1 7 . 1 1 26 26 SER N N 26 111.990 111.990 116.294 -4.304 25342 5156 1 7 . 1 1 26 26 SER HA H 26 4.153 4.153 4.185 -0.032 25342 5157 1 7 . 1 1 26 26 SER C C 26 172.110 172.110 176.012 -3.902 25342 5158 1 7 . 1 1 26 26 SER CA C 26 57.905 57.905 61.131 -3.226 25342 5159 1 7 . 1 1 26 26 SER CB C 26 60.655 60.655 63.028 -2.373 25342 5160 1 7 . 1 1 26 26 SER H H 26 7.369 7.369 8.334 -0.965 25342 5161 1 7 . 1 1 27 27 GLU N N 27 120.201 120.201 117.535 2.666 25342 5162 1 7 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.238 -0.137 25342 5163 1 7 . 1 1 27 27 GLU C C 27 173.673 173.673 176.591 -2.918 25342 5164 1 7 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.918 -2.683 25342 5165 1 7 . 1 1 27 27 GLU CB C 27 26.601 26.601 29.909 -3.308 25342 5166 1 7 . 1 1 27 27 GLU H H 27 7.451 7.451 7.950 -0.499 25342 5167 1 7 . 1 1 28 28 ILE N N 28 118.762 118.762 120.199 -1.437 25342 5168 1 7 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.271 -0.072 25342 5169 1 7 . 1 1 28 28 ILE C C 28 172.487 172.487 174.921 -2.434 25342 5170 1 7 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.325 -2.593 25342 5171 1 7 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.396 -4.658 25342 5172 1 7 . 1 1 28 28 ILE H H 28 7.255 7.255 7.209 0.046 25342 5173 1 7 . 1 1 29 29 LYS N N 29 130.563 130.563 126.783 3.780 25342 5174 1 7 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.258 -0.256 25342 5175 1 7 . 1 1 29 29 LYS C C 29 174.386 174.386 176.337 -1.951 25342 5176 1 7 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.569 -2.034 25342 5177 1 7 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.156 -3.570 25342 5178 1 7 . 1 1 29 29 LYS H H 29 8.564 8.564 8.567 -0.003 25342 5179 1 7 . 1 1 30 30 ASP N N 30 119.357 119.357 119.090 0.267 25342 5180 1 7 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.432 -0.030 25342 5181 1 7 . 1 1 30 30 ASP C C 30 172.570 172.570 175.518 -2.948 25342 5182 1 7 . 1 1 30 30 ASP CA C 30 53.436 53.436 55.274 -1.838 25342 5183 1 7 . 1 1 30 30 ASP CB C 30 36.744 36.744 40.361 -3.617 25342 5184 1 7 . 1 1 30 30 ASP H H 30 8.920 8.920 8.734 0.186 25342 5185 1 7 . 1 1 31 31 SER N N 31 114.019 114.019 112.214 1.805 25342 5186 1 7 . 1 1 31 31 SER HA H 31 4.782 4.782 4.991 -0.209 25342 5187 1 7 . 1 1 31 31 SER C C 31 171.150 171.150 174.561 -3.411 25342 5188 1 7 . 1 1 31 31 SER CA C 31 55.551 55.551 57.846 -2.295 25342 5189 1 7 . 1 1 31 31 SER CB C 31 62.259 62.259 65.290 -3.031 25342 5190 1 7 . 1 1 31 31 SER H H 31 8.006 8.006 7.789 0.217 25342 5191 1 7 . 1 1 32 32 GLU N N 32 121.455 121.455 121.786 -0.331 25342 5192 1 7 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.627 0.113 25342 5193 1 7 . 1 1 32 32 GLU C C 32 171.185 171.185 174.975 -3.790 25342 5194 1 7 . 1 1 32 32 GLU CA C 32 52.081 52.081 54.528 -2.447 25342 5195 1 7 . 1 1 32 32 GLU CB C 32 30.827 30.827 33.679 -2.852 25342 5196 1 7 . 1 1 32 32 GLU H H 32 8.145 8.145 8.675 -0.530 25342 5197 1 7 . 1 1 33 33 LEU N N 33 126.176 126.176 121.163 5.013 25342 5198 1 7 . 1 1 33 33 LEU HA H 33 5.306 5.306 5.054 0.252 25342 5199 1 7 . 1 1 33 33 LEU C C 33 173.365 173.365 175.766 -2.401 25342 5200 1 7 . 1 1 33 33 LEU CA C 33 51.440 51.440 53.557 -2.117 25342 5201 1 7 . 1 1 33 33 LEU CB C 33 43.635 43.635 45.740 -2.105 25342 5202 1 7 . 1 1 33 33 LEU H H 33 8.589 8.589 8.414 0.175 25342 5203 1 7 . 1 1 34 34 LYS N N 34 127.200 127.200 122.104 5.096 25342 5204 1 7 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.843 -0.247 25342 5205 1 7 . 1 1 34 34 LYS C C 34 169.622 169.622 174.248 -4.626 25342 5206 1 7 . 1 1 34 34 LYS CA C 34 52.329 52.329 55.220 -2.891 25342 5207 1 7 . 1 1 34 34 LYS CB C 34 34.200 34.200 37.279 -3.079 25342 5208 1 7 . 1 1 34 34 LYS H H 34 9.380 9.380 9.141 0.239 25342 5209 1 7 . 1 1 35 35 GLU N N 35 122.324 122.324 124.067 -1.743 25342 5210 1 7 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.597 -2.264 25342 5211 1 7 . 1 1 35 35 GLU C C 35 172.734 172.734 175.426 -2.692 25342 5212 1 7 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.914 -2.302 25342 5213 1 7 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.397 -3.078 25342 5214 1 7 . 1 1 35 35 GLU H H 35 8.094 8.094 8.598 -0.504 25342 5215 1 7 . 1 1 36 36 VAL N N 36 126.781 126.781 120.314 6.467 25342 5216 1 7 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.405 -0.566 25342 5217 1 7 . 1 1 36 36 VAL C C 36 171.482 171.482 174.492 -3.010 25342 5218 1 7 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.860 -1.455 25342 5219 1 7 . 1 1 36 36 VAL CB C 36 29.348 29.348 34.846 -5.498 25342 5220 1 7 . 1 1 36 36 VAL H H 36 8.660 8.660 8.405 0.255 25342 5221 1 7 . 1 1 37 37 LYS N N 37 126.065 126.065 125.336 0.729 25342 5222 1 7 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.884 0.081 25342 5223 1 7 . 1 1 37 37 LYS C C 37 173.187 173.187 174.536 -1.349 25342 5224 1 7 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.596 -2.316 25342 5225 1 7 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.137 -2.216 25342 5226 1 7 . 1 1 37 37 LYS H H 37 7.809 7.809 8.259 -0.450 25342 5227 1 7 . 1 1 38 38 VAL N N 38 111.020 111.020 115.051 -4.031 25342 5228 1 7 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.760 0.064 25342 5229 1 7 . 1 1 38 38 VAL C C 38 173.604 173.604 175.212 -1.608 25342 5230 1 7 . 1 1 38 38 VAL CA C 38 56.383 56.383 58.455 -2.072 25342 5231 1 7 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.575 -2.199 25342 5232 1 7 . 1 1 38 38 VAL H H 38 8.305 8.305 8.127 0.178 25342 5233 1 7 . 1 1 39 39 SER N N 39 117.887 117.887 115.642 2.245 25342 5234 1 7 . 1 1 39 39 SER HA H 39 4.183 4.183 4.325 -0.142 25342 5235 1 7 . 1 1 39 39 SER C C 39 173.538 173.538 175.317 -1.779 25342 5236 1 7 . 1 1 39 39 SER CA C 39 56.279 56.279 58.699 -2.420 25342 5237 1 7 . 1 1 39 39 SER CB C 39 60.537 60.537 64.205 -3.668 25342 5238 1 7 . 1 1 39 39 SER H H 39 8.847 8.847 8.570 0.277 25342 5239 1 7 . 1 1 40 40 GLU N N 40 126.316 126.316 124.255 2.061 25342 5240 1 7 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.145 0.009 25342 5241 1 7 . 1 1 40 40 GLU C C 40 174.586 174.586 177.615 -3.029 25342 5242 1 7 . 1 1 40 40 GLU CA C 40 55.812 55.812 58.289 -2.477 25342 5243 1 7 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.828 -3.108 25342 5244 1 7 . 1 1 40 40 GLU H H 40 9.049 9.049 8.572 0.477 25342 5245 1 7 . 1 1 41 41 GLY N N 41 112.494 112.494 108.971 3.523 25342 5246 1 7 . 1 1 41 41 GLY C C 41 171.994 171.994 175.468 -3.474 25342 5247 1 7 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.683 -3.221 25342 5248 1 7 . 1 1 41 41 GLY H H 41 8.780 8.780 9.018 -0.238 25342 5249 1 7 . 1 1 42 42 THR N N 42 118.631 118.631 116.410 2.221 25342 5250 1 7 . 1 1 42 42 THR HA H 42 3.582 3.582 3.974 -0.392 25342 5251 1 7 . 1 1 42 42 THR C C 42 171.225 171.225 174.041 -2.816 25342 5252 1 7 . 1 1 42 42 THR CA C 42 64.104 64.104 65.421 -1.317 25342 5253 1 7 . 1 1 42 42 THR CB C 42 65.914 65.914 69.608 -3.694 25342 5254 1 7 . 1 1 42 42 THR H H 42 7.737 7.737 7.495 0.242 25342 5255 1 7 . 1 1 43 43 PHE N N 43 116.279 116.279 116.220 0.059 25342 5256 1 7 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.530 0.490 25342 5257 1 7 . 1 1 43 43 PHE C C 43 170.141 170.141 174.004 -3.863 25342 5258 1 7 . 1 1 43 43 PHE CA C 43 52.472 52.472 57.496 -5.024 25342 5259 1 7 . 1 1 43 43 PHE CB C 43 37.385 37.385 42.421 -5.036 25342 5260 1 7 . 1 1 43 43 PHE H H 43 8.114 8.114 7.950 0.164 25342 5261 1 7 . 1 1 44 44 ASP N N 44 121.513 121.513 120.217 1.296 25342 5262 1 7 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.743 0.108 25342 5263 1 7 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.885 -3.673 25342 5264 1 7 . 1 1 44 44 ASP CB C 44 44.385 44.385 41.888 2.497 25342 5265 1 7 . 1 1 44 44 ASP H H 44 7.774 7.774 8.558 -0.784 25342 5266 1 7 . 1 1 45 45 ALA N N 45 125.663 125.663 121.336 4.327 25342 5267 1 7 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.645 -0.434 25342 5268 1 7 . 1 1 45 45 ALA C C 45 175.139 175.139 176.267 -1.128 25342 5269 1 7 . 1 1 45 45 ALA CA C 45 51.436 51.436 53.330 -1.894 25342 5270 1 7 . 1 1 45 45 ALA CB C 45 16.232 16.232 17.774 -1.542 25342 5271 1 7 . 1 1 45 45 ALA H H 45 8.324 8.324 8.188 0.136 25342 5272 1 7 . 1 1 46 46 ASP N N 46 119.288 119.288 117.200 2.088 25342 5273 1 7 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.665 0.160 25342 5274 1 7 . 1 1 46 46 ASP C C 46 175.013 175.013 177.164 -2.151 25342 5275 1 7 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.546 -2.385 25342 5276 1 7 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.280 -1.047 25342 5277 1 7 . 1 1 46 46 ASP H H 46 9.618 9.618 8.050 1.568 25342 5278 1 7 . 1 1 47 47 MET N N 47 127.347 127.347 122.700 4.647 25342 5279 1 7 . 1 1 47 47 MET HA H 47 3.456 3.456 4.395 -0.939 25342 5280 1 7 . 1 1 47 47 MET C C 47 173.605 173.605 175.963 -2.358 25342 5281 1 7 . 1 1 47 47 MET CA C 47 56.699 56.699 58.202 -1.503 25342 5282 1 7 . 1 1 47 47 MET CB C 47 29.930 29.930 33.601 -3.671 25342 5283 1 7 . 1 1 47 47 MET H H 47 9.178 9.178 8.674 0.504 25342 5284 1 7 . 1 1 48 48 TYR N N 48 121.040 121.040 112.490 8.550 25342 5285 1 7 . 1 1 48 48 TYR HA H 48 3.872 3.872 5.015 -1.143 25342 5286 1 7 . 1 1 48 48 TYR CA C 48 58.712 58.712 56.456 2.256 25342 5287 1 7 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.488 -4.850 25342 5288 1 7 . 1 1 48 48 TYR H H 48 7.881 7.881 8.030 -0.149 25342 5289 1 7 . 1 1 49 49 LYS N N 49 121.754 121.754 120.914 0.840 25342 5290 1 7 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.122 -0.017 25342 5291 1 7 . 1 1 49 49 LYS CA C 49 56.385 56.385 58.996 -2.611 25342 5292 1 7 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.658 -3.494 25342 5293 1 7 . 1 1 49 49 LYS H H 49 8.365 8.365 8.294 0.071 25342 5294 1 7 . 1 1 50 50 THR N N 50 117.557 117.557 110.153 7.404 25342 5295 1 7 . 1 1 50 50 THR HA H 50 3.586 3.586 3.771 -0.185 25342 5296 1 7 . 1 1 50 50 THR CA C 50 65.634 65.634 65.922 -0.288 25342 5297 1 7 . 1 1 50 50 THR CB C 50 65.904 65.904 68.533 -2.629 25342 5298 1 7 . 1 1 50 50 THR H H 50 8.007 8.007 7.980 0.027 25342 5299 1 7 . 1 1 51 51 SER N N 51 115.110 115.110 115.070 0.040 25342 5300 1 7 . 1 1 51 51 SER HA H 51 3.974 3.974 4.320 -0.346 25342 5301 1 7 . 1 1 51 51 SER CA C 51 59.042 59.042 60.623 -1.581 25342 5302 1 7 . 1 1 51 51 SER CB C 51 59.835 59.835 62.771 -2.936 25342 5303 1 7 . 1 1 51 51 SER H H 51 7.606 7.606 8.402 -0.796 25342 5304 1 7 . 1 1 52 52 ASP N N 52 119.713 119.713 121.354 -1.641 25342 5305 1 7 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.620 -0.312 25342 5306 1 7 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.367 -1.841 25342 5307 1 7 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.671 -3.983 25342 5308 1 7 . 1 1 52 52 ASP H H 52 7.552 7.552 7.608 -0.056 25342 5309 1 7 . 1 1 53 53 ILE N N 53 121.982 121.982 120.809 1.173 25342 5310 1 7 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.417 0.305 25342 5311 1 7 . 1 1 53 53 ILE C C 53 175.325 175.325 177.611 -2.286 25342 5312 1 7 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.289 -2.745 25342 5313 1 7 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.474 -0.775 25342 5314 1 7 . 1 1 53 53 ILE H H 53 7.815 7.815 7.671 0.144 25342 5315 1 7 . 1 1 54 54 ALA N N 54 121.552 121.552 119.816 1.736 25342 5316 1 7 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.216 0.101 25342 5317 1 7 . 1 1 54 54 ALA C C 54 177.475 177.475 178.271 -0.796 25342 5318 1 7 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.514 -2.492 25342 5319 1 7 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.742 -2.758 25342 5320 1 7 . 1 1 54 54 ALA H H 54 8.332 8.332 7.757 0.575 25342 5321 1 7 . 1 1 55 55 LEU N N 55 117.176 117.176 118.981 -1.805 25342 5322 1 7 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.982 -0.048 25342 5323 1 7 . 1 1 55 55 LEU C C 55 176.532 176.532 177.948 -1.416 25342 5324 1 7 . 1 1 55 55 LEU CA C 55 55.331 55.331 56.642 -1.311 25342 5325 1 7 . 1 1 55 55 LEU CB C 55 38.428 38.428 42.187 -3.759 25342 5326 1 7 . 1 1 55 55 LEU H H 55 8.195 8.195 7.333 0.862 25342 5327 1 7 . 1 1 56 56 ASP N N 56 120.056 120.056 119.665 0.391 25342 5328 1 7 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.181 0.286 25342 5329 1 7 . 1 1 56 56 ASP C C 56 176.585 176.585 178.353 -1.768 25342 5330 1 7 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.436 -2.886 25342 5331 1 7 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.818 -2.513 25342 5332 1 7 . 1 1 56 56 ASP H H 56 7.806 7.806 8.064 -0.258 25342 5333 1 7 . 1 1 57 57 GLN N N 57 120.020 120.020 115.925 4.095 25342 5334 1 7 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.194 -0.071 25342 5335 1 7 . 1 1 57 57 GLN C C 57 175.689 175.689 176.706 -1.017 25342 5336 1 7 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.261 -1.855 25342 5337 1 7 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.546 -4.777 25342 5338 1 7 . 1 1 57 57 GLN H H 57 7.661 7.661 7.697 -0.036 25342 5339 1 7 . 1 1 58 58 ILE N N 58 120.644 120.644 119.795 0.849 25342 5340 1 7 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.073 -0.497 25342 5341 1 7 . 1 1 58 58 ILE C C 58 176.237 176.237 177.095 -0.858 25342 5342 1 7 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.401 0.105 25342 5343 1 7 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.965 -2.936 25342 5344 1 7 . 1 1 58 58 ILE H H 58 8.228 8.228 7.560 0.668 25342 5345 1 7 . 1 1 59 59 GLN N N 59 115.498 115.498 118.094 -2.596 25342 5346 1 7 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.224 -0.082 25342 5347 1 7 . 1 1 59 59 GLN C C 59 173.781 173.781 177.205 -3.424 25342 5348 1 7 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.296 -3.314 25342 5349 1 7 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.309 -2.698 25342 5350 1 7 . 1 1 59 59 GLN H H 59 8.331 8.331 8.224 0.107 25342 5351 1 7 . 1 1 60 60 GLY N N 60 106.623 106.623 106.096 0.527 25342 5352 1 7 . 1 1 60 60 GLY C C 60 172.068 172.068 175.135 -3.067 25342 5353 1 7 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.414 -2.541 25342 5354 1 7 . 1 1 60 60 GLY H H 60 7.611 7.611 8.404 -0.793 25342 5355 1 7 . 1 1 61 61 ASN N N 61 117.691 117.691 117.798 -0.107 25342 5356 1 7 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.671 -0.127 25342 5357 1 7 . 1 1 61 61 ASN C C 61 171.946 171.946 175.732 -3.786 25342 5358 1 7 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.296 -2.727 25342 5359 1 7 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.980 -2.620 25342 5360 1 7 . 1 1 61 61 ASN H H 61 8.151 8.151 8.174 -0.023 25342 5361 1 7 . 1 1 62 62 LYS N N 62 118.289 118.289 118.680 -0.391 25342 5362 1 7 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.525 -0.197 25342 5363 1 7 . 1 1 62 62 LYS C C 62 171.773 171.773 174.528 -2.755 25342 5364 1 7 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.088 -2.792 25342 5365 1 7 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.239 -0.556 25342 5366 1 7 . 1 1 62 62 LYS H H 62 7.242 7.242 7.473 -0.231 25342 5367 1 7 . 1 1 63 63 ASP N N 63 119.888 119.888 119.533 0.355 25342 5368 1 7 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.568 -0.152 25342 5369 1 7 . 1 1 63 63 ASP C C 63 174.476 174.476 176.591 -2.115 25342 5370 1 7 . 1 1 63 63 ASP CA C 63 51.461 51.461 52.786 -1.325 25342 5371 1 7 . 1 1 63 63 ASP CB C 63 38.515 38.515 42.340 -3.825 25342 5372 1 7 . 1 1 63 63 ASP H H 63 8.230 8.230 8.238 -0.008 25342 5373 1 7 . 1 1 64 64 PHE N N 64 119.789 119.789 117.222 2.567 25342 5374 1 7 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.802 -0.986 25342 5375 1 7 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.701 1.549 25342 5376 1 7 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.185 -3.151 25342 5377 1 7 . 1 1 64 64 PHE H H 64 8.428 8.428 7.162 1.266 25342 5378 1 7 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.502 -0.189 25342 5379 1 7 . 1 1 65 65 PRO C C 65 173.975 173.975 176.078 -2.103 25342 5380 1 7 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.697 -2.641 25342 5381 1 7 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.620 -3.099 25342 5382 1 7 . 1 1 66 66 GLU N N 66 121.326 121.326 120.035 1.291 25342 5383 1 7 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.554 -0.321 25342 5384 1 7 . 1 1 66 66 GLU C C 66 173.978 173.978 175.758 -1.780 25342 5385 1 7 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.791 -2.260 25342 5386 1 7 . 1 1 66 66 GLU CB C 66 27.700 27.700 30.885 -3.185 25342 5387 1 7 . 1 1 66 66 GLU H H 66 8.225 8.225 8.542 -0.317 25342 5388 1 7 . 1 1 67 67 ILE N N 67 113.897 113.897 114.607 -0.710 25342 5389 1 7 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.743 0.426 25342 5390 1 7 . 1 1 67 67 ILE C C 67 172.791 172.791 176.055 -3.264 25342 5391 1 7 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.281 -3.006 25342 5392 1 7 . 1 1 67 67 ILE CB C 67 39.016 39.016 40.587 -1.571 25342 5393 1 7 . 1 1 67 67 ILE H H 67 8.366 8.366 8.323 0.043 25342 5394 1 7 . 1 1 68 68 GLN N N 68 121.654 121.654 120.992 0.662 25342 5395 1 7 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.470 0.049 25342 5396 1 7 . 1 1 68 68 GLN C C 68 171.562 171.562 175.342 -3.780 25342 5397 1 7 . 1 1 68 68 GLN CA C 68 52.313 52.313 55.168 -2.855 25342 5398 1 7 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.842 -2.057 25342 5399 1 7 . 1 1 68 68 GLN H H 68 8.763 8.763 8.454 0.309 25342 5400 1 7 . 1 1 69 69 LEU N N 69 125.289 125.289 119.604 5.685 25342 5401 1 7 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.349 0.170 25342 5402 1 7 . 1 1 69 69 LEU C C 69 172.567 172.567 176.212 -3.645 25342 5403 1 7 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.906 -3.109 25342 5404 1 7 . 1 1 69 69 LEU CB C 69 42.742 42.742 42.887 -0.145 25342 5405 1 7 . 1 1 69 69 LEU H H 69 7.996 7.996 7.537 0.459 25342 5406 1 7 . 1 1 70 70 ASP N N 70 123.170 123.170 118.505 4.665 25342 5407 1 7 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.794 -0.388 25342 5408 1 7 . 1 1 70 70 ASP C C 70 171.978 171.978 174.894 -2.916 25342 5409 1 7 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.166 -1.484 25342 5410 1 7 . 1 1 70 70 ASP CB C 70 38.729 38.729 43.549 -4.820 25342 5411 1 7 . 1 1 70 70 ASP H H 70 8.278 8.278 8.286 -0.008 25342 5412 1 7 . 1 1 71 71 ASN N N 71 117.524 117.524 118.631 -1.107 25342 5413 1 7 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.737 -0.410 25342 5414 1 7 . 1 1 71 71 ASN C C 71 171.825 171.825 174.900 -3.075 25342 5415 1 7 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.398 -1.741 25342 5416 1 7 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.813 -3.583 25342 5417 1 7 . 1 1 71 71 ASN H H 71 8.372 8.372 8.392 -0.020 25342 5418 1 7 . 1 1 72 72 ILE N N 72 124.515 124.515 123.759 0.756 25342 5419 1 7 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.103 -0.174 25342 5420 1 7 . 1 1 72 72 ILE C C 72 171.607 171.607 174.341 -2.734 25342 5421 1 7 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.186 -2.897 25342 5422 1 7 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.362 -2.603 25342 5423 1 7 . 1 1 72 72 ILE H H 72 7.653 7.653 8.250 -0.597 25342 5424 1 7 . 1 1 73 73 ASP N N 73 125.182 125.182 127.376 -2.194 25342 5425 1 7 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.715 -0.087 25342 5426 1 7 . 1 1 73 73 ASP C C 73 173.980 173.980 175.831 -1.851 25342 5427 1 7 . 1 1 73 73 ASP CA C 73 49.214 49.214 53.934 -4.720 25342 5428 1 7 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.311 -3.409 25342 5429 1 7 . 1 1 73 73 ASP H H 73 8.382 8.382 8.629 -0.247 25342 5430 1 7 . 1 1 74 74 TYR N N 74 123.092 123.092 122.384 0.708 25342 5431 1 7 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.535 -0.670 25342 5432 1 7 . 1 1 74 74 TYR C C 74 173.582 173.582 177.045 -3.463 25342 5433 1 7 . 1 1 74 74 TYR CA C 74 59.486 59.486 59.578 -0.092 25342 5434 1 7 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.026 -3.217 25342 5435 1 7 . 1 1 74 74 TYR H H 74 7.348 7.348 7.916 -0.568 25342 5436 1 7 . 1 1 75 75 ASN N N 75 109.447 109.447 117.159 -7.712 25342 5437 1 7 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.791 0.134 25342 5438 1 7 . 1 1 75 75 ASN C C 75 172.570 172.570 175.291 -2.721 25342 5439 1 7 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.253 -1.635 25342 5440 1 7 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.077 -2.543 25342 5441 1 7 . 1 1 75 75 ASN H H 75 8.040 8.040 8.795 -0.755 25342 5442 1 7 . 1 1 76 76 ASN N N 76 117.411 117.411 115.683 1.728 25342 5443 1 7 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.654 -0.200 25342 5444 1 7 . 1 1 76 76 ASN C C 76 171.155 171.155 174.582 -3.427 25342 5445 1 7 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.453 -2.519 25342 5446 1 7 . 1 1 76 76 ASN CB C 76 35.658 35.658 40.469 -4.811 25342 5447 1 7 . 1 1 76 76 ASN H H 76 7.750 7.750 7.600 0.150 25342 5448 1 7 . 1 1 77 77 TYR N N 77 116.878 116.878 119.647 -2.769 25342 5449 1 7 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.537 -0.183 25342 5450 1 7 . 1 1 77 77 TYR C C 77 172.224 172.224 175.483 -3.259 25342 5451 1 7 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.789 -3.549 25342 5452 1 7 . 1 1 77 77 TYR CB C 77 37.113 37.113 38.997 -1.884 25342 5453 1 7 . 1 1 77 77 TYR H H 77 7.789 7.789 7.473 0.316 25342 5454 1 7 . 1 1 78 78 ASP N N 78 121.352 121.352 120.868 0.484 25342 5455 1 7 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.742 0.055 25342 5456 1 7 . 1 1 78 78 ASP C C 78 172.623 172.623 175.437 -2.814 25342 5457 1 7 . 1 1 78 78 ASP CA C 78 53.190 53.190 55.702 -2.512 25342 5458 1 7 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.165 -2.130 25342 5459 1 7 . 1 1 78 78 ASP H H 78 9.036 9.036 8.794 0.242 25342 5460 1 7 . 1 1 79 79 LEU N N 79 123.073 123.073 117.776 5.297 25342 5461 1 7 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.310 -0.202 25342 5462 1 7 . 1 1 79 79 LEU C C 79 170.730 170.730 174.247 -3.517 25342 5463 1 7 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.428 -3.171 25342 5464 1 7 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.258 -3.974 25342 5465 1 7 . 1 1 79 79 LEU H H 79 7.877 7.877 8.033 -0.156 25342 5466 1 7 . 1 1 80 80 ILE N N 80 126.348 126.348 124.583 1.765 25342 5467 1 7 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.663 0.406 25342 5468 1 7 . 1 1 80 80 ILE C C 80 171.584 171.584 174.221 -2.637 25342 5469 1 7 . 1 1 80 80 ILE CA C 80 57.415 57.415 59.992 -2.577 25342 5470 1 7 . 1 1 80 80 ILE CB C 80 37.998 37.998 39.613 -1.615 25342 5471 1 7 . 1 1 80 80 ILE H H 80 8.704 8.704 8.557 0.147 25342 5472 1 7 . 1 1 81 81 LEU N N 81 126.303 126.303 127.652 -1.349 25342 5473 1 7 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.104 1.019 25342 5474 1 7 . 1 1 81 81 LEU C C 81 172.779 172.779 174.872 -2.093 25342 5475 1 7 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.817 -4.308 25342 5476 1 7 . 1 1 81 81 LEU CB C 81 41.715 41.715 41.992 -0.277 25342 5477 1 7 . 1 1 81 81 LEU H H 81 9.202 9.202 8.070 1.132 25342 5478 1 7 . 1 1 82 82 ILE N N 82 120.931 120.931 121.382 -0.451 25342 5479 1 7 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.146 -0.299 25342 5480 1 7 . 1 1 82 82 ILE C C 82 172.796 172.796 174.826 -2.030 25342 5481 1 7 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.146 -2.265 25342 5482 1 7 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.118 -4.321 25342 5483 1 7 . 1 1 82 82 ILE H H 82 8.846 8.846 7.521 1.325 25342 5484 1 7 . 1 1 83 83 GLY N N 83 120.905 120.905 111.596 9.309 25342 5485 1 7 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.972 -3.416 25342 5486 1 7 . 1 1 83 83 GLY H H 83 9.558 9.558 8.524 1.034 25342 5487 1 7 . 1 1 84 84 SER N N 84 116.601 116.601 115.325 1.276 25342 5488 1 7 . 1 1 84 84 SER HA H 84 5.476 5.476 5.314 0.162 25342 5489 1 7 . 1 1 84 84 SER CA C 84 51.324 51.324 56.352 -5.028 25342 5490 1 7 . 1 1 84 84 SER CB C 84 64.271 64.271 64.318 -0.047 25342 5491 1 7 . 1 1 84 84 SER H H 84 7.533 7.533 8.087 -0.554 25342 5492 1 7 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.383 0.780 25342 5493 1 7 . 1 1 85 85 PRO C C 85 175.590 175.590 176.378 -0.788 25342 5494 1 7 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.633 -3.750 25342 5495 1 7 . 1 1 85 85 PRO CB C 85 30.474 30.474 31.833 -1.359 25342 5496 1 7 . 1 1 86 86 VAL N N 86 116.295 116.295 123.452 -7.157 25342 5497 1 7 . 1 1 86 86 VAL HA H 86 3.821 3.821 3.906 -0.085 25342 5498 1 7 . 1 1 86 86 VAL C C 86 172.692 172.692 176.222 -3.530 25342 5499 1 7 . 1 1 86 86 VAL CA C 86 59.812 59.812 63.975 -4.163 25342 5500 1 7 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.009 -1.926 25342 5501 1 7 . 1 1 86 86 VAL H H 86 7.246 7.246 7.515 -0.269 25342 5502 1 7 . 1 1 87 87 TRP N N 87 131.042 131.042 127.693 3.349 25342 5503 1 7 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.768 -0.457 25342 5504 1 7 . 1 1 87 87 TRP C C 87 173.323 173.323 176.586 -3.263 25342 5505 1 7 . 1 1 87 87 TRP CA C 87 50.887 50.887 56.155 -5.268 25342 5506 1 7 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.736 -4.426 25342 5507 1 7 . 1 1 87 87 TRP H H 87 9.555 9.555 8.263 1.292 25342 5508 1 7 . 1 1 88 88 SER N N 88 122.660 122.660 117.594 5.066 25342 5509 1 7 . 1 1 88 88 SER HA H 88 4.582 4.582 4.335 0.247 25342 5510 1 7 . 1 1 88 88 SER C C 88 172.096 172.096 175.305 -3.209 25342 5511 1 7 . 1 1 88 88 SER CA C 88 55.391 55.391 59.893 -4.502 25342 5512 1 7 . 1 1 88 88 SER CB C 88 57.813 57.813 61.933 -4.120 25342 5513 1 7 . 1 1 88 88 SER H H 88 10.257 10.257 9.113 1.144 25342 5514 1 7 . 1 1 89 89 GLY N N 89 128.381 128.381 111.060 17.321 25342 5515 1 7 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.791 -3.163 25342 5516 1 7 . 1 1 89 89 GLY H H 89 6.372 6.372 8.472 -2.100 25342 5517 1 7 . 1 1 90 90 TYR N N 90 120.345 120.345 117.849 2.496 25342 5518 1 7 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.470 -1.281 25342 5519 1 7 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.751 -1.202 25342 5520 1 7 . 1 1 90 90 TYR CB C 90 37.195 37.195 39.305 -2.110 25342 5521 1 7 . 1 1 90 90 TYR H H 90 8.113 8.113 7.837 0.276 25342 5522 1 7 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.680 0.154 25342 5523 1 7 . 1 1 91 91 PRO C C 91 170.911 170.911 177.206 -6.295 25342 5524 1 7 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.285 -3.450 25342 5525 1 7 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.833 -6.763 25342 5526 1 7 . 1 1 92 92 ALA N N 92 120.629 120.629 123.075 -2.446 25342 5527 1 7 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.718 -0.099 25342 5528 1 7 . 1 1 92 92 ALA C C 92 176.782 176.782 176.570 0.212 25342 5529 1 7 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.214 -1.797 25342 5530 1 7 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.202 -1.686 25342 5531 1 7 . 1 1 92 92 ALA H H 92 7.554 7.554 8.762 -1.208 25342 5532 1 7 . 1 1 93 93 THR N N 93 112.558 112.558 110.256 2.302 25342 5533 1 7 . 1 1 93 93 THR CB C 93 64.173 64.173 67.408 -3.235 25342 5534 1 7 . 1 1 93 93 THR H H 93 6.730 6.730 7.679 -0.949 25342 5535 1 7 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.339 -0.480 25342 5536 1 7 . 1 1 94 94 PRO C C 94 173.309 173.309 177.868 -4.559 25342 5537 1 7 . 1 1 94 94 PRO CA C 94 63.063 63.063 65.157 -2.094 25342 5538 1 7 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.114 -2.835 25342 5539 1 7 . 1 1 95 95 ILE N N 95 111.014 111.014 116.382 -5.368 25342 5540 1 7 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.190 -0.585 25342 5541 1 7 . 1 1 95 95 ILE C C 95 174.302 174.302 177.228 -2.926 25342 5542 1 7 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.878 -2.697 25342 5543 1 7 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.234 -4.451 25342 5544 1 7 . 1 1 95 95 ILE H H 95 7.995 7.995 8.314 -0.319 25342 5545 1 7 . 1 1 96 96 LYS N N 96 123.208 123.208 122.208 1.000 25342 5546 1 7 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.098 -1.006 25342 5547 1 7 . 1 1 96 96 LYS C C 96 174.451 174.451 178.171 -3.720 25342 5548 1 7 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.165 -2.124 25342 5549 1 7 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.675 -2.929 25342 5550 1 7 . 1 1 96 96 LYS H H 96 6.928 6.928 7.407 -0.479 25342 5551 1 7 . 1 1 97 97 THR N N 97 113.320 113.320 115.213 -1.893 25342 5552 1 7 . 1 1 97 97 THR HA H 97 3.436 3.436 3.973 -0.537 25342 5553 1 7 . 1 1 97 97 THR C C 97 173.221 173.221 176.567 -3.346 25342 5554 1 7 . 1 1 97 97 THR CA C 97 62.710 62.710 65.982 -3.272 25342 5555 1 7 . 1 1 97 97 THR CB C 97 65.562 65.562 68.490 -2.928 25342 5556 1 7 . 1 1 97 97 THR H H 97 6.325 6.325 7.751 -1.426 25342 5557 1 7 . 1 1 98 98 LEU N N 98 120.963 120.963 122.136 -1.173 25342 5558 1 7 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.121 -0.496 25342 5559 1 7 . 1 1 98 98 LEU C C 98 174.713 174.713 177.595 -2.882 25342 5560 1 7 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.457 -1.943 25342 5561 1 7 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.612 -1.884 25342 5562 1 7 . 1 1 98 98 LEU H H 98 7.536 7.536 7.683 -0.147 25342 5563 1 7 . 1 1 99 99 LEU N N 99 118.859 118.859 117.817 1.042 25342 5564 1 7 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.960 -0.288 25342 5565 1 7 . 1 1 99 99 LEU C C 99 177.458 177.458 178.157 -0.699 25342 5566 1 7 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.266 -3.121 25342 5567 1 7 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.298 -2.441 25342 5568 1 7 . 1 1 99 99 LEU H H 99 8.179 8.179 7.675 0.504 25342 5569 1 7 . 1 1 100 100 ASP N N 100 118.703 118.703 117.628 1.075 25342 5570 1 7 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.387 -0.166 25342 5571 1 7 . 1 1 100 100 ASP C C 100 176.472 176.472 177.556 -1.084 25342 5572 1 7 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.303 -1.996 25342 5573 1 7 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.812 -3.454 25342 5574 1 7 . 1 1 100 100 ASP H H 100 7.867 7.867 7.811 0.056 25342 5575 1 7 . 1 1 101 101 GLN N N 101 117.829 117.829 117.388 0.441 25342 5576 1 7 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.207 -0.007 25342 5577 1 7 . 1 1 101 101 GLN C C 101 174.508 174.508 178.080 -3.572 25342 5578 1 7 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.162 -3.474 25342 5579 1 7 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.343 -3.746 25342 5580 1 7 . 1 1 101 101 GLN H H 101 7.597 7.597 7.328 0.269 25342 5581 1 7 . 1 1 102 102 MET N N 102 118.406 118.406 117.223 1.183 25342 5582 1 7 . 1 1 102 102 MET HA H 102 3.864 3.864 4.198 -0.334 25342 5583 1 7 . 1 1 102 102 MET C C 102 172.820 172.820 177.806 -4.986 25342 5584 1 7 . 1 1 102 102 MET CA C 102 53.298 53.298 57.580 -4.282 25342 5585 1 7 . 1 1 102 102 MET CB C 102 31.207 31.207 31.523 -0.316 25342 5586 1 7 . 1 1 102 102 MET H H 102 7.434 7.434 8.371 -0.937 25342 5587 1 7 . 1 1 103 103 LYS N N 103 115.889 115.889 120.387 -4.498 25342 5588 1 7 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.074 -0.155 25342 5589 1 7 . 1 1 103 103 LYS C C 103 173.938 173.938 177.904 -3.966 25342 5590 1 7 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.735 -2.298 25342 5591 1 7 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.822 -2.559 25342 5592 1 7 . 1 1 103 103 LYS H H 103 6.881 6.881 7.896 -1.015 25342 5593 1 7 . 1 1 104 104 ASN N N 104 114.951 114.951 115.089 -0.138 25342 5594 1 7 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.574 0.157 25342 5595 1 7 . 1 1 104 104 ASN C C 104 172.617 172.617 176.035 -3.418 25342 5596 1 7 . 1 1 104 104 ASN CA C 104 50.266 50.266 54.117 -3.851 25342 5597 1 7 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.977 -3.194 25342 5598 1 7 . 1 1 104 104 ASN H H 104 8.493 8.493 7.876 0.617 25342 5599 1 7 . 1 1 105 105 TYR N N 105 122.680 122.680 123.309 -0.629 25342 5600 1 7 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.383 0.179 25342 5601 1 7 . 1 1 105 105 TYR CA C 105 55.433 55.433 59.303 -3.870 25342 5602 1 7 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.330 -3.498 25342 5603 1 7 . 1 1 105 105 TYR H H 105 8.217 8.217 8.047 0.170 25342 5604 1 7 . 1 1 106 106 ARG N N 106 128.872 128.872 124.770 4.102 25342 5605 1 7 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.328 -0.063 25342 5606 1 7 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.067 -2.085 25342 5607 1 7 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.935 -5.805 25342 5608 1 7 . 1 1 106 106 ARG H H 106 8.801 8.801 8.039 0.762 25342 5609 1 7 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.408 -2.007 25342 5610 1 7 . 1 1 108 108 GLU N N 108 117.000 117.000 120.243 -3.243 25342 5611 1 7 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.637 -0.011 25342 5612 1 7 . 1 1 108 108 GLU C C 108 174.125 174.125 175.961 -1.836 25342 5613 1 7 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.315 -2.527 25342 5614 1 7 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.857 -1.417 25342 5615 1 7 . 1 1 108 108 GLU H H 108 7.514 7.514 8.062 -0.548 25342 5616 1 7 . 1 1 109 109 VAL N N 109 123.398 123.398 121.801 1.597 25342 5617 1 7 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.957 0.380 25342 5618 1 7 . 1 1 109 109 VAL C C 109 170.606 170.606 173.650 -3.044 25342 5619 1 7 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.779 -3.499 25342 5620 1 7 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.391 -2.734 25342 5621 1 7 . 1 1 109 109 VAL H H 109 8.942 8.942 8.350 0.592 25342 5622 1 7 . 1 1 110 110 ALA N N 110 127.905 127.905 128.135 -0.230 25342 5623 1 7 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.794 -0.167 25342 5624 1 7 . 1 1 110 110 ALA C C 110 173.195 173.195 174.977 -1.782 25342 5625 1 7 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.309 -1.963 25342 5626 1 7 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.168 -3.843 25342 5627 1 7 . 1 1 110 110 ALA H H 110 8.776 8.776 8.228 0.548 25342 5628 1 7 . 1 1 111 111 SER N N 111 110.523 110.523 114.842 -4.319 25342 5629 1 7 . 1 1 111 111 SER HA H 111 5.562 5.562 4.703 0.859 25342 5630 1 7 . 1 1 111 111 SER C C 111 170.719 170.719 172.675 -1.956 25342 5631 1 7 . 1 1 111 111 SER CA C 111 51.314 51.314 56.128 -4.814 25342 5632 1 7 . 1 1 111 111 SER CB C 111 61.907 61.907 62.758 -0.850 25342 5633 1 7 . 1 1 111 111 SER H H 111 7.480 7.480 7.400 0.080 25342 5634 1 7 . 1 1 112 112 PHE N N 112 125.567 125.567 122.837 2.730 25342 5635 1 7 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.651 0.705 25342 5636 1 7 . 1 1 112 112 PHE C C 112 169.536 169.536 174.385 -4.849 25342 5637 1 7 . 1 1 112 112 PHE CA C 112 50.371 50.371 54.502 -4.131 25342 5638 1 7 . 1 1 112 112 PHE CB C 112 39.788 39.788 40.262 -0.474 25342 5639 1 7 . 1 1 112 112 PHE H H 112 7.848 7.848 7.891 -0.043 25342 5640 1 7 . 1 1 113 113 PHE N N 113 115.065 115.065 113.376 1.689 25342 5641 1 7 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.031 1.073 25342 5642 1 7 . 1 1 113 113 PHE C C 113 173.006 173.006 173.103 -0.097 25342 5643 1 7 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.171 -5.909 25342 5644 1 7 . 1 1 113 113 PHE CB C 113 38.749 38.749 39.447 -0.698 25342 5645 1 7 . 1 1 113 113 PHE H H 113 7.361 7.361 8.229 -0.868 25342 5646 1 7 . 1 1 114 114 THR N N 114 108.014 108.014 110.145 -2.131 25342 5647 1 7 . 1 1 114 114 THR HA H 114 4.999 4.999 4.640 0.359 25342 5648 1 7 . 1 1 114 114 THR C C 114 169.874 169.874 173.364 -3.490 25342 5649 1 7 . 1 1 114 114 THR CA C 114 56.500 56.500 60.568 -4.068 25342 5650 1 7 . 1 1 114 114 THR CB C 114 68.809 68.809 71.589 -2.780 25342 5651 1 7 . 1 1 114 114 THR H H 114 7.867 7.867 8.464 -0.597 25342 5652 1 7 . 1 1 115 115 SER N N 115 115.049 115.049 116.714 -1.665 25342 5653 1 7 . 1 1 115 115 SER HA H 115 5.613 5.613 4.519 1.094 25342 5654 1 7 . 1 1 115 115 SER C C 115 171.247 171.247 174.956 -3.709 25342 5655 1 7 . 1 1 115 115 SER CA C 115 54.830 54.830 57.338 -2.508 25342 5656 1 7 . 1 1 115 115 SER CB C 115 63.992 63.992 65.685 -1.693 25342 5657 1 7 . 1 1 115 115 SER H H 115 8.970 8.970 8.391 0.579 25342 5658 1 7 . 1 1 116 116 ALA N N 116 122.671 122.671 122.847 -0.176 25342 5659 1 7 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.439 0.546 25342 5660 1 7 . 1 1 116 116 ALA C C 116 176.180 176.180 178.527 -2.347 25342 5661 1 7 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.023 -2.823 25342 5662 1 7 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.268 -2.273 25342 5663 1 7 . 1 1 116 116 ALA H H 116 8.963 8.963 8.583 0.380 25342 5664 1 7 . 1 1 117 117 GLY N N 117 107.387 107.387 106.822 0.565 25342 5665 1 7 . 1 1 117 117 GLY C C 117 172.528 172.528 173.735 -1.207 25342 5666 1 7 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.778 -2.046 25342 5667 1 7 . 1 1 117 117 GLY H H 117 9.340 9.340 7.923 1.417 25342 5668 1 7 . 1 1 118 118 THR N N 118 113.481 113.481 110.581 2.900 25342 5669 1 7 . 1 1 118 118 THR HA H 118 4.651 4.651 4.523 0.128 25342 5670 1 7 . 1 1 118 118 THR C C 118 172.067 172.067 173.674 -1.607 25342 5671 1 7 . 1 1 118 118 THR CA C 118 57.357 57.357 60.336 -2.979 25342 5672 1 7 . 1 1 118 118 THR CB C 118 69.475 69.475 70.541 -1.066 25342 5673 1 7 . 1 1 118 118 THR H H 118 9.373 9.373 7.383 1.990 25342 5674 1 7 . 1 1 119 119 ASN N N 119 113.202 113.202 116.813 -3.611 25342 5675 1 7 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.453 0.165 25342 5676 1 7 . 1 1 119 119 ASN C C 119 173.114 173.114 176.364 -3.250 25342 5677 1 7 . 1 1 119 119 ASN CA C 119 51.684 51.684 53.580 -1.896 25342 5678 1 7 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.254 -3.524 25342 5679 1 7 . 1 1 119 119 ASN H H 119 8.908 8.908 8.789 0.119 25342 5680 1 7 . 1 1 120 120 HIS N N 120 117.315 117.315 117.619 -0.304 25342 5681 1 7 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.383 -0.597 25342 5682 1 7 . 1 1 120 120 HIS C C 120 174.381 174.381 176.355 -1.974 25342 5683 1 7 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.658 -4.142 25342 5684 1 7 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.778 -3.274 25342 5685 1 7 . 1 1 120 120 HIS H H 120 8.074 8.074 8.599 -0.525 25342 5686 1 7 . 1 1 121 121 LYS N N 121 118.678 118.678 118.665 0.013 25342 5687 1 7 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.568 0.266 25342 5688 1 7 . 1 1 121 121 LYS C C 121 176.564 176.564 178.155 -1.591 25342 5689 1 7 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.625 -1.330 25342 5690 1 7 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.422 -2.479 25342 5691 1 7 . 1 1 121 121 LYS H H 121 8.336 8.336 7.370 0.966 25342 5692 1 7 . 1 1 122 122 ALA N N 122 122.146 122.146 121.524 0.622 25342 5693 1 7 . 1 1 122 122 ALA HA H 122 3.695 3.695 3.546 0.149 25342 5694 1 7 . 1 1 122 122 ALA C C 122 175.163 175.163 179.036 -3.873 25342 5695 1 7 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.552 -2.860 25342 5696 1 7 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.830 -2.112 25342 5697 1 7 . 1 1 122 122 ALA H H 122 7.584 7.584 7.676 -0.092 25342 5698 1 7 . 1 1 123 123 TYR N N 123 119.730 119.730 118.076 1.654 25342 5699 1 7 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.138 -0.985 25342 5700 1 7 . 1 1 123 123 TYR C C 123 174.340 174.340 177.855 -3.515 25342 5701 1 7 . 1 1 123 123 TYR CA C 123 60.398 60.398 59.670 0.728 25342 5702 1 7 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.098 -2.435 25342 5703 1 7 . 1 1 123 123 TYR H H 123 7.317 7.317 8.042 -0.725 25342 5704 1 7 . 1 1 124 124 VAL N N 124 118.649 118.649 120.096 -1.447 25342 5705 1 7 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.612 -0.410 25342 5706 1 7 . 1 1 124 124 VAL C C 124 175.603 175.603 178.165 -2.562 25342 5707 1 7 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.353 -1.673 25342 5708 1 7 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.373 -1.084 25342 5709 1 7 . 1 1 124 124 VAL H H 124 7.799 7.799 6.987 0.812 25342 5710 1 7 . 1 1 125 125 SER N N 125 114.475 114.475 115.369 -0.894 25342 5711 1 7 . 1 1 125 125 SER HA H 125 4.032 4.032 4.040 -0.008 25342 5712 1 7 . 1 1 125 125 SER C C 125 174.849 174.849 176.450 -1.601 25342 5713 1 7 . 1 1 125 125 SER CA C 125 59.002 59.002 62.611 -3.609 25342 5714 1 7 . 1 1 125 125 SER CB C 125 59.613 59.613 63.255 -3.642 25342 5715 1 7 . 1 1 125 125 SER H H 125 7.766 7.766 7.559 0.207 25342 5716 1 7 . 1 1 126 126 HIS N N 126 119.326 119.326 119.118 0.208 25342 5717 1 7 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.420 -0.293 25342 5718 1 7 . 1 1 126 126 HIS C C 126 172.865 172.865 176.530 -3.665 25342 5719 1 7 . 1 1 126 126 HIS CA C 126 55.706 55.706 57.200 -1.494 25342 5720 1 7 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.077 -4.084 25342 5721 1 7 . 1 1 126 126 HIS H H 126 8.569 8.569 8.346 0.223 25342 5722 1 7 . 1 1 127 127 PHE N N 127 121.044 121.044 120.419 0.625 25342 5723 1 7 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.498 -1.324 25342 5724 1 7 . 1 1 127 127 PHE C C 127 173.378 173.378 176.548 -3.170 25342 5725 1 7 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.088 0.779 25342 5726 1 7 . 1 1 127 127 PHE CB C 127 36.054 36.054 40.583 -4.529 25342 5727 1 7 . 1 1 127 127 PHE H H 127 9.139 9.139 8.122 1.017 25342 5728 1 7 . 1 1 128 128 ASN N N 128 114.893 114.893 118.978 -4.085 25342 5729 1 7 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.034 0.006 25342 5730 1 7 . 1 1 128 128 ASN C C 128 175.230 175.230 177.489 -2.259 25342 5731 1 7 . 1 1 128 128 ASN CA C 128 54.300 54.300 57.114 -2.813 25342 5732 1 7 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.103 -1.932 25342 5733 1 7 . 1 1 128 128 ASN H H 128 7.774 7.774 8.603 -0.829 25342 5734 1 7 . 1 1 129 129 GLU N N 129 119.804 119.804 118.997 0.807 25342 5735 1 7 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.735 0.305 25342 5736 1 7 . 1 1 129 129 GLU C C 129 177.052 177.052 177.486 -0.434 25342 5737 1 7 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.705 -1.975 25342 5738 1 7 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.174 -1.978 25342 5739 1 7 . 1 1 129 129 GLU H H 129 7.577 7.577 8.156 -0.579 25342 5740 1 7 . 1 1 130 130 TRP N N 130 120.979 120.979 117.402 3.577 25342 5741 1 7 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.767 -0.310 25342 5742 1 7 . 1 1 130 130 TRP C C 130 174.329 174.329 174.641 -0.312 25342 5743 1 7 . 1 1 130 130 TRP CA C 130 54.688 54.688 55.796 -1.108 25342 5744 1 7 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.959 -2.968 25342 5745 1 7 . 1 1 130 130 TRP H H 130 8.225 8.225 7.373 0.852 25342 5746 1 7 . 1 1 131 131 ALA N N 131 120.450 120.450 119.970 0.480 25342 5747 1 7 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.375 -0.439 25342 5748 1 7 . 1 1 131 131 ALA C C 131 172.487 172.487 176.254 -3.767 25342 5749 1 7 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.933 -3.499 25342 5750 1 7 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.869 -3.580 25342 5751 1 7 . 1 1 131 131 ALA H H 131 8.081 8.081 7.957 0.124 25342 5752 1 7 . 1 1 132 132 ASP N N 132 117.813 117.813 120.897 -3.084 25342 5753 1 7 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.478 -0.270 25342 5754 1 7 . 1 1 132 132 ASP C C 132 173.804 173.804 175.837 -2.033 25342 5755 1 7 . 1 1 132 132 ASP CA C 132 54.181 54.181 54.733 -0.553 25342 5756 1 7 . 1 1 132 132 ASP CB C 132 39.321 39.321 39.356 -0.035 25342 5757 1 7 . 1 1 132 132 ASP H H 132 6.772 6.772 8.201 -1.429 25342 5758 1 7 . 1 1 133 133 GLY N N 133 115.052 115.052 107.497 7.555 25342 5759 1 7 . 1 1 133 133 GLY C C 133 172.078 172.078 173.683 -1.605 25342 5760 1 7 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.173 -2.753 25342 5761 1 7 . 1 1 133 133 GLY H H 133 8.626 8.626 8.178 0.448 25342 5762 1 7 . 1 1 134 134 LEU N N 134 120.063 120.063 120.399 -0.336 25342 5763 1 7 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.761 -0.289 25342 5764 1 7 . 1 1 134 134 LEU C C 134 174.079 174.079 175.401 -1.322 25342 5765 1 7 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.760 -2.796 25342 5766 1 7 . 1 1 134 134 LEU CB C 134 40.370 40.370 45.112 -4.742 25342 5767 1 7 . 1 1 134 134 LEU H H 134 8.094 8.094 7.366 0.728 25342 5768 1 7 . 1 1 135 135 ASN N N 135 119.292 119.292 121.532 -2.240 25342 5769 1 7 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.682 -0.059 25342 5770 1 7 . 1 1 135 135 ASN C C 135 170.527 170.527 174.801 -4.274 25342 5771 1 7 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.820 -3.818 25342 5772 1 7 . 1 1 135 135 ASN CB C 135 33.560 33.560 37.950 -4.390 25342 5773 1 7 . 1 1 135 135 ASN H H 135 8.513 8.513 8.850 -0.337 25342 5774 1 7 . 1 1 136 136 VAL N N 136 125.412 125.412 124.860 0.552 25342 5775 1 7 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.225 0.381 25342 5776 1 7 . 1 1 136 136 VAL C C 136 175.420 175.420 176.892 -1.472 25342 5777 1 7 . 1 1 136 136 VAL CA C 136 58.382 58.382 63.665 -5.283 25342 5778 1 7 . 1 1 136 136 VAL CB C 136 29.247 29.247 32.110 -2.863 25342 5779 1 7 . 1 1 136 136 VAL H H 136 7.648 7.648 7.989 -0.341 25342 5780 1 7 . 1 1 137 137 ILE N N 137 121.881 121.881 122.594 -0.713 25342 5781 1 7 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.503 -0.070 25342 5782 1 7 . 1 1 137 137 ILE C C 137 173.906 173.906 175.868 -1.962 25342 5783 1 7 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.228 -2.250 25342 5784 1 7 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.878 -2.682 25342 5785 1 7 . 1 1 137 137 ILE H H 137 9.139 9.139 8.528 0.611 25342 5786 1 7 . 1 1 138 138 GLY N N 138 108.226 108.226 107.764 0.462 25342 5787 1 7 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.294 -1.903 25342 5788 1 7 . 1 1 138 138 GLY H H 138 6.645 6.645 7.406 -0.761 25342 5789 1 7 . 1 1 139 139 VAL N N 139 119.408 119.408 120.771 -1.363 25342 5790 1 7 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.506 0.851 25342 5791 1 7 . 1 1 139 139 VAL C C 139 172.327 172.327 175.166 -2.839 25342 5792 1 7 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.515 -3.248 25342 5793 1 7 . 1 1 139 139 VAL CB C 139 32.743 32.743 33.572 -0.829 25342 5794 1 7 . 1 1 139 139 VAL H H 139 8.092 8.092 8.511 -0.419 25342 5795 1 7 . 1 1 140 140 ALA N N 140 127.415 127.415 129.341 -1.926 25342 5796 1 7 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.428 -0.983 25342 5797 1 7 . 1 1 140 140 ALA C C 140 170.718 170.718 177.236 -6.518 25342 5798 1 7 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.328 -1.428 25342 5799 1 7 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.256 -1.197 25342 5800 1 7 . 1 1 140 140 ALA H H 140 9.093 9.093 8.665 0.428 25342 5801 1 7 . 1 1 141 141 ARG N N 141 119.287 119.287 121.709 -2.422 25342 5802 1 7 . 1 1 141 141 ARG HA H 141 2.487 2.487 4.753 -2.266 25342 5803 1 7 . 1 1 141 141 ARG C C 141 173.375 173.375 176.915 -3.540 25342 5804 1 7 . 1 1 141 141 ARG CA C 141 51.884 51.884 57.176 -5.292 25342 5805 1 7 . 1 1 141 141 ARG CB C 141 28.684 28.684 31.072 -2.388 25342 5806 1 7 . 1 1 141 141 ARG H H 141 7.620 7.620 8.881 -1.261 25342 5807 1 7 . 1 1 142 142 ASP N N 142 125.999 125.999 118.033 7.966 25342 5808 1 7 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.258 -0.534 25342 5809 1 7 . 1 1 142 142 ASP C C 142 169.292 169.292 176.560 -7.268 25342 5810 1 7 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.467 -3.129 25342 5811 1 7 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.842 -4.165 25342 5812 1 7 . 1 1 142 142 ASP H H 142 9.482 9.482 8.878 0.604 25342 5813 1 7 . 1 1 143 143 ASP N N 143 119.293 119.293 119.335 -0.042 25342 5814 1 7 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.526 -0.220 25342 5815 1 7 . 1 1 143 143 ASP C C 143 175.686 175.686 177.608 -1.922 25342 5816 1 7 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.999 -6.094 25342 5817 1 7 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.594 -4.282 25342 5818 1 7 . 1 1 143 143 ASP H H 143 8.108 8.108 8.579 -0.471 25342 5819 1 7 . 1 1 144 144 SER N N 144 115.303 115.303 115.706 -0.403 25342 5820 1 7 . 1 1 144 144 SER HA H 144 3.740 3.740 4.187 -0.447 25342 5821 1 7 . 1 1 144 144 SER C C 144 172.925 172.925 175.039 -2.114 25342 5822 1 7 . 1 1 144 144 SER CA C 144 59.213 59.213 60.663 -1.450 25342 5823 1 7 . 1 1 144 144 SER CB C 144 60.806 60.806 63.065 -2.259 25342 5824 1 7 . 1 1 144 144 SER H H 144 7.642 7.642 8.198 -0.556 25342 5825 1 7 . 1 1 145 145 GLU N N 145 119.523 119.523 119.628 -0.105 25342 5826 1 7 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.117 0.189 25342 5827 1 7 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.443 -3.404 25342 5828 1 7 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.594 -2.794 25342 5829 1 7 . 1 1 145 145 GLU H H 145 7.771 7.771 7.928 -0.157 25342 5830 1 7 . 1 1 146 146 VAL N N 146 118.683 118.683 121.896 -3.213 25342 5831 1 7 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.720 -0.779 25342 5832 1 7 . 1 1 146 146 VAL C C 146 174.591 174.591 176.488 -1.897 25342 5833 1 7 . 1 1 146 146 VAL CA C 146 63.932 63.932 65.493 -1.561 25342 5834 1 7 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.856 -2.809 25342 5835 1 7 . 1 1 146 146 VAL H H 146 6.352 6.352 7.562 -1.210 25342 5836 1 7 . 1 1 147 147 ASP N N 147 119.312 119.312 116.619 2.693 25342 5837 1 7 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.422 -0.367 25342 5838 1 7 . 1 1 147 147 ASP C C 147 174.783 174.783 175.967 -1.184 25342 5839 1 7 . 1 1 147 147 ASP CA C 147 54.241 54.241 55.828 -1.587 25342 5840 1 7 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.561 -3.328 25342 5841 1 7 . 1 1 147 147 ASP H H 147 8.370 8.370 8.437 -0.067 25342 5842 1 7 . 1 1 148 148 LYS N N 148 119.342 119.342 115.019 4.323 25342 5843 1 7 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.524 -0.587 25342 5844 1 7 . 1 1 148 148 LYS C C 148 176.384 176.384 178.806 -2.422 25342 5845 1 7 . 1 1 148 148 LYS CA C 148 55.706 55.706 56.497 -0.791 25342 5846 1 7 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.929 -3.418 25342 5847 1 7 . 1 1 148 148 LYS H H 148 7.040 7.040 7.291 -0.251 25342 5848 1 7 . 1 1 149 149 TRP N N 149 118.258 118.258 121.735 -3.477 25342 5849 1 7 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.767 -0.176 25342 5850 1 7 . 1 1 149 149 TRP C C 149 174.212 174.212 177.015 -2.803 25342 5851 1 7 . 1 1 149 149 TRP CA C 149 53.745 53.745 57.416 -3.671 25342 5852 1 7 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.936 -1.996 25342 5853 1 7 . 1 1 149 149 TRP H H 149 7.811 7.811 7.582 0.229 25342 5854 1 7 . 1 1 150 150 SER N N 150 109.618 109.618 113.488 -3.870 25342 5855 1 7 . 1 1 150 150 SER HA H 150 4.234 4.234 4.701 -0.467 25342 5856 1 7 . 1 1 150 150 SER C C 150 170.189 170.189 173.317 -3.128 25342 5857 1 7 . 1 1 150 150 SER CA C 150 56.695 56.695 57.351 -0.656 25342 5858 1 7 . 1 1 150 150 SER CB C 150 61.935 61.935 63.046 -1.111 25342 5859 1 7 . 1 1 150 150 SER H H 150 7.793 7.793 8.116 -0.323 25342 5860 1 8 . 1 1 3 3 ALA N N 3 125.638 125.638 125.580 0.058 25342 5861 1 8 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.480 -0.115 25342 5862 1 8 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.696 -3.398 25342 5863 1 8 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.679 -2.820 25342 5864 1 8 . 1 1 3 3 ALA H H 3 8.325 8.325 8.130 0.195 25342 5865 1 8 . 1 1 4 4 LYS N N 4 121.813 121.813 119.983 1.830 25342 5866 1 8 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.450 -0.223 25342 5867 1 8 . 1 1 4 4 LYS C C 4 174.574 174.574 174.096 0.478 25342 5868 1 8 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.700 -1.919 25342 5869 1 8 . 1 1 4 4 LYS CB C 4 31.490 31.490 33.585 -2.095 25342 5870 1 8 . 1 1 4 4 LYS H H 4 8.486 8.486 7.942 0.544 25342 5871 1 8 . 1 1 5 5 LYS N N 5 129.722 129.722 122.645 7.077 25342 5872 1 8 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.538 -0.020 25342 5873 1 8 . 1 1 5 5 LYS C C 5 174.720 174.720 174.953 -0.233 25342 5874 1 8 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.134 -0.412 25342 5875 1 8 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.184 -6.399 25342 5876 1 8 . 1 1 5 5 LYS H H 5 10.015 10.015 8.114 1.901 25342 5877 1 8 . 1 1 6 6 THR N N 6 126.254 126.254 117.758 8.496 25342 5878 1 8 . 1 1 6 6 THR HA H 6 5.654 5.654 5.146 0.508 25342 5879 1 8 . 1 1 6 6 THR C C 6 169.926 169.926 172.904 -2.978 25342 5880 1 8 . 1 1 6 6 THR CA C 6 60.598 60.598 62.445 -1.847 25342 5881 1 8 . 1 1 6 6 THR CB C 6 68.041 68.041 69.692 -1.651 25342 5882 1 8 . 1 1 6 6 THR H H 6 8.538 8.538 8.842 -0.304 25342 5883 1 8 . 1 1 7 7 LEU N N 7 130.775 130.775 128.414 2.361 25342 5884 1 8 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.901 -0.307 25342 5885 1 8 . 1 1 7 7 LEU C C 7 170.404 170.404 174.275 -3.871 25342 5886 1 8 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.287 -3.354 25342 5887 1 8 . 1 1 7 7 LEU CB C 7 40.728 40.728 44.923 -4.195 25342 5888 1 8 . 1 1 7 7 LEU H H 7 8.575 8.575 8.260 0.315 25342 5889 1 8 . 1 1 8 8 ILE N N 8 127.242 127.242 124.752 2.490 25342 5890 1 8 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.581 0.267 25342 5891 1 8 . 1 1 8 8 ILE C C 8 170.936 170.936 173.995 -3.059 25342 5892 1 8 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.181 -2.929 25342 5893 1 8 . 1 1 8 8 ILE CB C 8 36.935 36.935 39.795 -2.860 25342 5894 1 8 . 1 1 8 8 ILE H H 8 9.217 9.217 8.567 0.650 25342 5895 1 8 . 1 1 9 9 LEU N N 9 127.183 127.183 128.561 -1.378 25342 5896 1 8 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.838 0.856 25342 5897 1 8 . 1 1 9 9 LEU C C 9 173.824 173.824 175.643 -1.819 25342 5898 1 8 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.461 -3.622 25342 5899 1 8 . 1 1 9 9 LEU CB C 9 43.963 43.963 41.002 2.961 25342 5900 1 8 . 1 1 9 9 LEU H H 9 9.248 9.248 8.325 0.923 25342 5901 1 8 . 1 1 10 10 TYR N N 10 113.330 113.330 122.666 -9.336 25342 5902 1 8 . 1 1 10 10 TYR HA H 10 5.514 5.514 4.964 0.550 25342 5903 1 8 . 1 1 10 10 TYR C C 10 167.898 167.898 174.921 -7.023 25342 5904 1 8 . 1 1 10 10 TYR CA C 10 52.875 52.875 54.823 -1.948 25342 5905 1 8 . 1 1 10 10 TYR CB C 10 38.436 38.436 42.250 -3.814 25342 5906 1 8 . 1 1 10 10 TYR H H 10 7.306 7.306 8.054 -0.748 25342 5907 1 8 . 1 1 11 11 TYR N N 11 121.297 121.297 123.837 -2.540 25342 5908 1 8 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.147 -0.385 25342 5909 1 8 . 1 1 11 11 TYR C C 11 169.698 169.698 175.427 -5.729 25342 5910 1 8 . 1 1 11 11 TYR CA C 11 54.047 54.047 56.370 -2.323 25342 5911 1 8 . 1 1 11 11 TYR CB C 11 40.538 40.538 39.565 0.973 25342 5912 1 8 . 1 1 11 11 TYR H H 11 7.891 7.891 8.516 -0.625 25342 5913 1 8 . 1 1 12 12 SER N N 12 117.763 117.763 123.558 -5.795 25342 5914 1 8 . 1 1 12 12 SER HA H 12 4.679 4.679 4.219 0.460 25342 5915 1 8 . 1 1 12 12 SER C C 12 170.075 170.075 174.051 -3.976 25342 5916 1 8 . 1 1 12 12 SER CA C 12 53.619 53.619 57.063 -3.444 25342 5917 1 8 . 1 1 12 12 SER CB C 12 62.847 62.847 62.316 0.532 25342 5918 1 8 . 1 1 12 12 SER H H 12 7.557 7.557 8.449 -0.892 25342 5919 1 8 . 1 1 13 13 TRP N N 13 135.232 135.232 131.087 4.145 25342 5920 1 8 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.038 0.598 25342 5921 1 8 . 1 1 13 13 TRP C C 13 175.708 175.708 176.350 -0.642 25342 5922 1 8 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.816 -1.700 25342 5923 1 8 . 1 1 13 13 TRP CB C 13 27.635 27.635 30.087 -2.452 25342 5924 1 8 . 1 1 13 13 TRP H H 13 9.755 9.755 8.375 1.380 25342 5925 1 8 . 1 1 14 14 SER N N 14 113.789 113.789 112.138 1.651 25342 5926 1 8 . 1 1 14 14 SER HA H 14 4.223 4.223 4.535 -0.312 25342 5927 1 8 . 1 1 14 14 SER C C 14 172.747 172.747 174.691 -1.944 25342 5928 1 8 . 1 1 14 14 SER CA C 14 53.828 53.828 57.395 -3.567 25342 5929 1 8 . 1 1 14 14 SER CB C 14 60.037 60.037 62.462 -2.425 25342 5930 1 8 . 1 1 14 14 SER H H 14 10.026 10.026 8.115 1.911 25342 5931 1 8 . 1 1 15 15 GLY N N 15 110.489 110.489 114.407 -3.918 25342 5932 1 8 . 1 1 15 15 GLY CA C 15 44.659 44.659 46.658 -1.999 25342 5933 1 8 . 1 1 15 15 GLY H H 15 7.391 7.391 9.014 -1.623 25342 5934 1 8 . 1 1 16 16 GLU N N 16 129.005 129.005 121.616 7.389 25342 5935 1 8 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.098 -0.035 25342 5936 1 8 . 1 1 16 16 GLU CA C 16 56.761 56.761 59.332 -2.571 25342 5937 1 8 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.535 -3.123 25342 5938 1 8 . 1 1 16 16 GLU H H 16 11.550 11.550 8.127 3.423 25342 5939 1 8 . 1 1 17 17 THR N N 17 123.016 123.016 110.948 12.068 25342 5940 1 8 . 1 1 17 17 THR HA H 17 4.035 4.035 4.201 -0.166 25342 5941 1 8 . 1 1 17 17 THR C C 17 173.360 173.360 175.701 -2.341 25342 5942 1 8 . 1 1 17 17 THR CA C 17 64.303 64.303 64.405 -0.102 25342 5943 1 8 . 1 1 17 17 THR CB C 17 63.999 63.999 68.041 -4.042 25342 5944 1 8 . 1 1 17 17 THR H H 17 11.293 11.293 8.455 2.838 25342 5945 1 8 . 1 1 18 18 LYS N N 18 120.156 120.156 120.961 -0.805 25342 5946 1 8 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.130 -1.274 25342 5947 1 8 . 1 1 18 18 LYS C C 18 173.901 173.901 178.021 -4.120 25342 5948 1 8 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.128 -2.294 25342 5949 1 8 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.768 -3.287 25342 5950 1 8 . 1 1 18 18 LYS H H 18 6.940 6.940 7.524 -0.584 25342 5951 1 8 . 1 1 19 19 LYS N N 19 117.237 117.237 118.300 -1.063 25342 5952 1 8 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.111 -0.188 25342 5953 1 8 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.679 -2.355 25342 5954 1 8 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.360 -2.999 25342 5955 1 8 . 1 1 19 19 LYS H H 19 7.212 7.212 8.054 -0.842 25342 5956 1 8 . 1 1 20 20 MET N N 20 119.268 119.268 118.647 0.621 25342 5957 1 8 . 1 1 20 20 MET HA H 20 4.413 4.413 4.338 0.075 25342 5958 1 8 . 1 1 20 20 MET C C 20 173.625 173.625 174.614 -0.989 25342 5959 1 8 . 1 1 20 20 MET CA C 20 52.261 52.261 54.424 -2.163 25342 5960 1 8 . 1 1 20 20 MET CB C 20 26.680 26.680 30.885 -4.205 25342 5961 1 8 . 1 1 20 20 MET H H 20 7.600 7.600 7.838 -0.238 25342 5962 1 8 . 1 1 21 21 ALA N N 21 123.669 123.669 122.682 0.987 25342 5963 1 8 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.804 -1.322 25342 5964 1 8 . 1 1 21 21 ALA C C 21 176.628 176.628 178.001 -1.373 25342 5965 1 8 . 1 1 21 21 ALA CA C 21 52.374 52.374 53.608 -1.234 25342 5966 1 8 . 1 1 21 21 ALA CB C 21 16.495 16.495 20.474 -3.979 25342 5967 1 8 . 1 1 21 21 ALA H H 21 8.738 8.738 8.328 0.410 25342 5968 1 8 . 1 1 22 22 GLU N N 22 117.242 117.242 120.494 -3.252 25342 5969 1 8 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.935 -0.262 25342 5970 1 8 . 1 1 22 22 GLU C C 22 176.698 176.698 178.572 -1.874 25342 5971 1 8 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.176 -2.636 25342 5972 1 8 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.435 -3.001 25342 5973 1 8 . 1 1 22 22 GLU H H 22 7.959 7.959 8.107 -0.148 25342 5974 1 8 . 1 1 23 23 LYS N N 23 123.302 123.302 121.157 2.145 25342 5975 1 8 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.023 -0.202 25342 5976 1 8 . 1 1 23 23 LYS C C 23 177.389 177.389 178.707 -1.318 25342 5977 1 8 . 1 1 23 23 LYS CA C 23 56.922 56.922 58.831 -1.909 25342 5978 1 8 . 1 1 23 23 LYS CB C 23 29.514 29.514 31.834 -2.320 25342 5979 1 8 . 1 1 23 23 LYS H H 23 7.703 7.703 7.354 0.349 25342 5980 1 8 . 1 1 24 24 ILE N N 24 122.208 122.208 118.249 3.959 25342 5981 1 8 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.740 -0.457 25342 5982 1 8 . 1 1 24 24 ILE C C 24 174.934 174.934 178.129 -3.195 25342 5983 1 8 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.449 -1.157 25342 5984 1 8 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.533 -2.795 25342 5985 1 8 . 1 1 24 24 ILE H H 24 8.535 8.535 8.063 0.472 25342 5986 1 8 . 1 1 25 25 ASN N N 25 118.640 118.640 118.529 0.111 25342 5987 1 8 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.372 -0.145 25342 5988 1 8 . 1 1 25 25 ASN C C 25 173.530 173.530 177.738 -4.208 25342 5989 1 8 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.316 -4.105 25342 5990 1 8 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.541 -0.437 25342 5991 1 8 . 1 1 25 25 ASN H H 25 8.317 8.317 8.422 -0.105 25342 5992 1 8 . 1 1 26 26 SER N N 26 111.990 111.990 115.973 -3.983 25342 5993 1 8 . 1 1 26 26 SER HA H 26 4.153 4.153 4.280 -0.127 25342 5994 1 8 . 1 1 26 26 SER C C 26 172.110 172.110 175.637 -3.527 25342 5995 1 8 . 1 1 26 26 SER CA C 26 57.905 57.905 61.074 -3.169 25342 5996 1 8 . 1 1 26 26 SER CB C 26 60.655 60.655 63.100 -2.445 25342 5997 1 8 . 1 1 26 26 SER H H 26 7.369 7.369 7.868 -0.499 25342 5998 1 8 . 1 1 27 27 GLU N N 27 120.201 120.201 118.648 1.553 25342 5999 1 8 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.375 -0.274 25342 6000 1 8 . 1 1 27 27 GLU C C 27 173.673 173.673 175.979 -2.306 25342 6001 1 8 . 1 1 27 27 GLU CA C 27 54.235 54.235 55.760 -1.525 25342 6002 1 8 . 1 1 27 27 GLU CB C 27 26.601 26.601 29.819 -3.218 25342 6003 1 8 . 1 1 27 27 GLU H H 27 7.451 7.451 7.835 -0.384 25342 6004 1 8 . 1 1 28 28 ILE N N 28 118.762 118.762 120.519 -1.757 25342 6005 1 8 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.291 -0.092 25342 6006 1 8 . 1 1 28 28 ILE C C 28 172.487 172.487 174.924 -2.437 25342 6007 1 8 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.198 -2.466 25342 6008 1 8 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.988 -5.250 25342 6009 1 8 . 1 1 28 28 ILE H H 28 7.255 7.255 7.257 -0.002 25342 6010 1 8 . 1 1 29 29 LYS N N 29 130.563 130.563 128.296 2.267 25342 6011 1 8 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.238 -0.236 25342 6012 1 8 . 1 1 29 29 LYS C C 29 174.386 174.386 176.103 -1.717 25342 6013 1 8 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.199 -1.664 25342 6014 1 8 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.057 -3.471 25342 6015 1 8 . 1 1 29 29 LYS H H 29 8.564 8.564 8.987 -0.423 25342 6016 1 8 . 1 1 30 30 ASP N N 30 119.357 119.357 121.141 -1.784 25342 6017 1 8 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.350 0.052 25342 6018 1 8 . 1 1 30 30 ASP C C 30 172.570 172.570 176.248 -3.678 25342 6019 1 8 . 1 1 30 30 ASP CA C 30 53.436 53.436 55.601 -2.165 25342 6020 1 8 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.821 -3.077 25342 6021 1 8 . 1 1 30 30 ASP H H 30 8.920 8.920 8.695 0.225 25342 6022 1 8 . 1 1 31 31 SER N N 31 114.019 114.019 114.015 0.004 25342 6023 1 8 . 1 1 31 31 SER HA H 31 4.782 4.782 4.825 -0.043 25342 6024 1 8 . 1 1 31 31 SER C C 31 171.150 171.150 174.658 -3.508 25342 6025 1 8 . 1 1 31 31 SER CA C 31 55.551 55.551 58.541 -2.990 25342 6026 1 8 . 1 1 31 31 SER CB C 31 62.259 62.259 65.606 -3.346 25342 6027 1 8 . 1 1 31 31 SER H H 31 8.006 8.006 7.566 0.440 25342 6028 1 8 . 1 1 32 32 GLU N N 32 121.455 121.455 118.612 2.843 25342 6029 1 8 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.653 0.087 25342 6030 1 8 . 1 1 32 32 GLU C C 32 171.185 171.185 174.326 -3.141 25342 6031 1 8 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.591 -3.510 25342 6032 1 8 . 1 1 32 32 GLU CB C 32 30.827 30.827 34.230 -3.403 25342 6033 1 8 . 1 1 32 32 GLU H H 32 8.145 8.145 8.488 -0.343 25342 6034 1 8 . 1 1 33 33 LEU N N 33 126.176 126.176 121.861 4.315 25342 6035 1 8 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.945 0.361 25342 6036 1 8 . 1 1 33 33 LEU C C 33 173.365 173.365 175.833 -2.468 25342 6037 1 8 . 1 1 33 33 LEU CA C 33 51.440 51.440 53.628 -2.188 25342 6038 1 8 . 1 1 33 33 LEU CB C 33 43.635 43.635 45.304 -1.669 25342 6039 1 8 . 1 1 33 33 LEU H H 33 8.589 8.589 8.487 0.102 25342 6040 1 8 . 1 1 34 34 LYS N N 34 127.200 127.200 121.850 5.350 25342 6041 1 8 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.827 -0.231 25342 6042 1 8 . 1 1 34 34 LYS C C 34 169.622 169.622 174.326 -4.704 25342 6043 1 8 . 1 1 34 34 LYS CA C 34 52.329 52.329 53.854 -1.525 25342 6044 1 8 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.649 -2.449 25342 6045 1 8 . 1 1 34 34 LYS H H 34 9.380 9.380 8.869 0.511 25342 6046 1 8 . 1 1 35 35 GLU N N 35 122.324 122.324 117.911 4.413 25342 6047 1 8 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.475 -2.142 25342 6048 1 8 . 1 1 35 35 GLU C C 35 172.734 172.734 174.595 -1.861 25342 6049 1 8 . 1 1 35 35 GLU CA C 35 52.612 52.612 55.142 -2.530 25342 6050 1 8 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.116 -3.797 25342 6051 1 8 . 1 1 35 35 GLU H H 35 8.094 8.094 8.543 -0.450 25342 6052 1 8 . 1 1 36 36 VAL N N 36 126.781 126.781 118.309 8.472 25342 6053 1 8 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.598 -0.759 25342 6054 1 8 . 1 1 36 36 VAL C C 36 171.482 171.482 174.876 -3.394 25342 6055 1 8 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.184 -0.779 25342 6056 1 8 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.468 -6.120 25342 6057 1 8 . 1 1 36 36 VAL H H 36 8.660 8.660 8.535 0.125 25342 6058 1 8 . 1 1 37 37 LYS N N 37 126.065 126.065 121.544 4.521 25342 6059 1 8 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.861 0.104 25342 6060 1 8 . 1 1 37 37 LYS C C 37 173.187 173.187 174.739 -1.552 25342 6061 1 8 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.790 -2.510 25342 6062 1 8 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.241 -2.320 25342 6063 1 8 . 1 1 37 37 LYS H H 37 7.809 7.809 8.362 -0.553 25342 6064 1 8 . 1 1 38 38 VAL N N 38 111.020 111.020 116.826 -5.806 25342 6065 1 8 . 1 1 38 38 VAL HA H 38 4.824 4.824 5.072 -0.248 25342 6066 1 8 . 1 1 38 38 VAL C C 38 173.604 173.604 176.156 -2.552 25342 6067 1 8 . 1 1 38 38 VAL CA C 38 56.383 56.383 58.864 -2.481 25342 6068 1 8 . 1 1 38 38 VAL CB C 38 32.376 32.376 32.585 -0.209 25342 6069 1 8 . 1 1 38 38 VAL H H 38 8.305 8.305 8.034 0.271 25342 6070 1 8 . 1 1 39 39 SER N N 39 117.887 117.887 116.073 1.814 25342 6071 1 8 . 1 1 39 39 SER HA H 39 4.183 4.183 4.302 -0.119 25342 6072 1 8 . 1 1 39 39 SER C C 39 173.538 173.538 174.110 -0.572 25342 6073 1 8 . 1 1 39 39 SER CA C 39 56.279 56.279 58.682 -2.404 25342 6074 1 8 . 1 1 39 39 SER CB C 39 60.537 60.537 63.566 -3.029 25342 6075 1 8 . 1 1 39 39 SER H H 39 8.847 8.847 8.323 0.524 25342 6076 1 8 . 1 1 40 40 GLU N N 40 126.316 126.316 120.781 5.535 25342 6077 1 8 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.353 -0.199 25342 6078 1 8 . 1 1 40 40 GLU C C 40 174.586 174.586 175.494 -0.908 25342 6079 1 8 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.360 -0.548 25342 6080 1 8 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.056 -2.336 25342 6081 1 8 . 1 1 40 40 GLU H H 40 9.049 9.049 8.622 0.427 25342 6082 1 8 . 1 1 41 41 GLY N N 41 112.494 112.494 108.540 3.954 25342 6083 1 8 . 1 1 41 41 GLY C C 41 171.994 171.994 174.200 -2.206 25342 6084 1 8 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.774 -3.312 25342 6085 1 8 . 1 1 41 41 GLY H H 41 8.780 8.780 8.051 0.729 25342 6086 1 8 . 1 1 42 42 THR N N 42 118.631 118.631 115.326 3.305 25342 6087 1 8 . 1 1 42 42 THR HA H 42 3.582 3.582 4.263 -0.681 25342 6088 1 8 . 1 1 42 42 THR C C 42 171.225 171.225 173.440 -2.215 25342 6089 1 8 . 1 1 42 42 THR CA C 42 64.104 64.104 62.080 2.024 25342 6090 1 8 . 1 1 42 42 THR CB C 42 65.914 65.914 69.801 -3.887 25342 6091 1 8 . 1 1 42 42 THR H H 42 7.737 7.737 7.934 -0.197 25342 6092 1 8 . 1 1 43 43 PHE N N 43 116.279 116.279 116.803 -0.524 25342 6093 1 8 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.798 0.222 25342 6094 1 8 . 1 1 43 43 PHE C C 43 170.141 170.141 173.387 -3.246 25342 6095 1 8 . 1 1 43 43 PHE CA C 43 52.472 52.472 55.959 -3.487 25342 6096 1 8 . 1 1 43 43 PHE CB C 43 37.385 37.385 40.432 -3.047 25342 6097 1 8 . 1 1 43 43 PHE H H 43 8.114 8.114 6.970 1.144 25342 6098 1 8 . 1 1 44 44 ASP N N 44 121.513 121.513 120.107 1.406 25342 6099 1 8 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.958 -0.107 25342 6100 1 8 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.271 -2.059 25342 6101 1 8 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.218 0.168 25342 6102 1 8 . 1 1 44 44 ASP H H 44 7.774 7.774 8.510 -0.736 25342 6103 1 8 . 1 1 45 45 ALA N N 45 125.663 125.663 121.188 4.475 25342 6104 1 8 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.727 -0.516 25342 6105 1 8 . 1 1 45 45 ALA C C 45 175.139 175.139 177.747 -2.608 25342 6106 1 8 . 1 1 45 45 ALA CA C 45 51.436 51.436 53.149 -1.713 25342 6107 1 8 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.335 -3.103 25342 6108 1 8 . 1 1 45 45 ALA H H 45 8.324 8.324 8.429 -0.105 25342 6109 1 8 . 1 1 46 46 ASP N N 46 119.288 119.288 119.367 -0.079 25342 6110 1 8 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.774 0.051 25342 6111 1 8 . 1 1 46 46 ASP C C 46 175.013 175.013 177.637 -2.624 25342 6112 1 8 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.315 -2.154 25342 6113 1 8 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.096 -0.863 25342 6114 1 8 . 1 1 46 46 ASP H H 46 9.618 9.618 7.818 1.800 25342 6115 1 8 . 1 1 47 47 MET N N 47 127.347 127.347 121.590 5.757 25342 6116 1 8 . 1 1 47 47 MET HA H 47 3.456 3.456 4.351 -0.895 25342 6117 1 8 . 1 1 47 47 MET C C 47 173.605 173.605 178.455 -4.850 25342 6118 1 8 . 1 1 47 47 MET CA C 47 56.699 56.699 58.926 -2.227 25342 6119 1 8 . 1 1 47 47 MET CB C 47 29.930 29.930 32.441 -2.511 25342 6120 1 8 . 1 1 47 47 MET H H 47 9.178 9.178 8.375 0.803 25342 6121 1 8 . 1 1 48 48 TYR N N 48 121.040 121.040 118.585 2.455 25342 6122 1 8 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.164 -0.292 25342 6123 1 8 . 1 1 48 48 TYR CA C 48 58.712 58.712 61.157 -2.446 25342 6124 1 8 . 1 1 48 48 TYR CB C 48 33.638 33.638 36.538 -2.900 25342 6125 1 8 . 1 1 48 48 TYR H H 48 7.881 7.881 8.223 -0.342 25342 6126 1 8 . 1 1 49 49 LYS N N 49 121.754 121.754 119.107 2.647 25342 6127 1 8 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.001 0.104 25342 6128 1 8 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.324 -2.939 25342 6129 1 8 . 1 1 49 49 LYS CB C 49 29.164 29.164 31.884 -2.720 25342 6130 1 8 . 1 1 49 49 LYS H H 49 8.365 8.365 7.072 1.293 25342 6131 1 8 . 1 1 50 50 THR N N 50 117.557 117.557 111.880 5.677 25342 6132 1 8 . 1 1 50 50 THR HA H 50 3.586 3.586 4.162 -0.576 25342 6133 1 8 . 1 1 50 50 THR CA C 50 65.634 65.634 65.483 0.152 25342 6134 1 8 . 1 1 50 50 THR CB C 50 65.904 65.904 67.835 -1.931 25342 6135 1 8 . 1 1 50 50 THR H H 50 8.007 8.007 7.662 0.345 25342 6136 1 8 . 1 1 51 51 SER N N 51 115.110 115.110 118.124 -3.014 25342 6137 1 8 . 1 1 51 51 SER HA H 51 3.974 3.974 4.167 -0.193 25342 6138 1 8 . 1 1 51 51 SER CA C 51 59.042 59.042 62.716 -3.674 25342 6139 1 8 . 1 1 51 51 SER CB C 51 59.835 59.835 62.674 -2.839 25342 6140 1 8 . 1 1 51 51 SER H H 51 7.606 7.606 8.139 -0.533 25342 6141 1 8 . 1 1 52 52 ASP N N 52 119.713 119.713 121.781 -2.068 25342 6142 1 8 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.549 -0.241 25342 6143 1 8 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.737 -2.211 25342 6144 1 8 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.817 -3.129 25342 6145 1 8 . 1 1 52 52 ASP H H 52 7.552 7.552 7.532 0.020 25342 6146 1 8 . 1 1 53 53 ILE N N 53 121.982 121.982 120.314 1.668 25342 6147 1 8 . 1 1 53 53 ILE HA H 53 3.722 3.722 4.051 -0.329 25342 6148 1 8 . 1 1 53 53 ILE C C 53 175.325 175.325 177.825 -2.500 25342 6149 1 8 . 1 1 53 53 ILE CA C 53 62.544 62.544 64.895 -2.351 25342 6150 1 8 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.898 -1.199 25342 6151 1 8 . 1 1 53 53 ILE H H 53 7.815 7.815 7.424 0.391 25342 6152 1 8 . 1 1 54 54 ALA N N 54 121.552 121.552 119.422 2.130 25342 6153 1 8 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.111 0.206 25342 6154 1 8 . 1 1 54 54 ALA C C 54 177.475 177.475 177.548 -0.073 25342 6155 1 8 . 1 1 54 54 ALA CA C 54 52.022 52.022 53.701 -1.679 25342 6156 1 8 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.729 -2.745 25342 6157 1 8 . 1 1 54 54 ALA H H 54 8.332 8.332 8.099 0.233 25342 6158 1 8 . 1 1 55 55 LEU N N 55 117.176 117.176 118.098 -0.922 25342 6159 1 8 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.520 -0.586 25342 6160 1 8 . 1 1 55 55 LEU C C 55 176.532 176.532 177.664 -1.132 25342 6161 1 8 . 1 1 55 55 LEU CA C 55 55.331 55.331 56.335 -1.004 25342 6162 1 8 . 1 1 55 55 LEU CB C 55 38.428 38.428 43.324 -4.896 25342 6163 1 8 . 1 1 55 55 LEU H H 55 8.195 8.195 7.163 1.032 25342 6164 1 8 . 1 1 56 56 ASP N N 56 120.056 120.056 121.098 -1.042 25342 6165 1 8 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.276 0.191 25342 6166 1 8 . 1 1 56 56 ASP C C 56 176.585 176.585 178.224 -1.639 25342 6167 1 8 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.438 -2.888 25342 6168 1 8 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.194 -1.889 25342 6169 1 8 . 1 1 56 56 ASP H H 56 7.806 7.806 8.424 -0.618 25342 6170 1 8 . 1 1 57 57 GLN N N 57 120.020 120.020 117.098 2.922 25342 6171 1 8 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.408 -0.285 25342 6172 1 8 . 1 1 57 57 GLN C C 57 175.689 175.689 176.467 -0.778 25342 6173 1 8 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.428 -2.023 25342 6174 1 8 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.714 -4.945 25342 6175 1 8 . 1 1 57 57 GLN H H 57 7.661 7.661 8.076 -0.415 25342 6176 1 8 . 1 1 58 58 ILE N N 58 120.644 120.644 119.201 1.443 25342 6177 1 8 . 1 1 58 58 ILE HA H 58 3.576 3.576 3.867 -0.291 25342 6178 1 8 . 1 1 58 58 ILE C C 58 176.237 176.237 177.421 -1.184 25342 6179 1 8 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.589 -0.083 25342 6180 1 8 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.706 -2.677 25342 6181 1 8 . 1 1 58 58 ILE H H 58 8.228 8.228 7.567 0.661 25342 6182 1 8 . 1 1 59 59 GLN N N 59 115.498 115.498 118.723 -3.225 25342 6183 1 8 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.236 -0.094 25342 6184 1 8 . 1 1 59 59 GLN C C 59 173.781 173.781 176.899 -3.118 25342 6185 1 8 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.821 -2.839 25342 6186 1 8 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.147 -2.536 25342 6187 1 8 . 1 1 59 59 GLN H H 59 8.331 8.331 8.018 0.313 25342 6188 1 8 . 1 1 60 60 GLY N N 60 106.623 106.623 106.536 0.087 25342 6189 1 8 . 1 1 60 60 GLY C C 60 172.068 172.068 174.694 -2.626 25342 6190 1 8 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.457 -2.584 25342 6191 1 8 . 1 1 60 60 GLY H H 60 7.611 7.611 8.477 -0.866 25342 6192 1 8 . 1 1 61 61 ASN N N 61 117.691 117.691 117.906 -0.215 25342 6193 1 8 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.811 -0.267 25342 6194 1 8 . 1 1 61 61 ASN C C 61 171.946 171.946 175.802 -3.856 25342 6195 1 8 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.054 -2.485 25342 6196 1 8 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.325 -2.965 25342 6197 1 8 . 1 1 61 61 ASN H H 61 8.151 8.151 8.124 0.027 25342 6198 1 8 . 1 1 62 62 LYS N N 62 118.289 118.289 119.170 -0.881 25342 6199 1 8 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.612 -0.284 25342 6200 1 8 . 1 1 62 62 LYS C C 62 171.773 171.773 175.031 -3.258 25342 6201 1 8 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.731 -3.435 25342 6202 1 8 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.087 -0.404 25342 6203 1 8 . 1 1 62 62 LYS H H 62 7.242 7.242 8.142 -0.900 25342 6204 1 8 . 1 1 63 63 ASP N N 63 119.888 119.888 119.059 0.829 25342 6205 1 8 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.521 -0.104 25342 6206 1 8 . 1 1 63 63 ASP C C 63 174.476 174.476 175.711 -1.235 25342 6207 1 8 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.943 -2.482 25342 6208 1 8 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.217 -2.702 25342 6209 1 8 . 1 1 63 63 ASP H H 63 8.230 8.230 8.205 0.025 25342 6210 1 8 . 1 1 64 64 PHE N N 64 119.789 119.789 112.356 7.433 25342 6211 1 8 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.850 -1.034 25342 6212 1 8 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.042 2.208 25342 6213 1 8 . 1 1 64 64 PHE CB C 64 35.034 35.034 39.799 -4.765 25342 6214 1 8 . 1 1 64 64 PHE H H 64 8.428 8.428 7.526 0.902 25342 6215 1 8 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.490 -0.177 25342 6216 1 8 . 1 1 65 65 PRO C C 65 173.975 173.975 176.400 -2.425 25342 6217 1 8 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.632 -2.576 25342 6218 1 8 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.586 -3.066 25342 6219 1 8 . 1 1 66 66 GLU N N 66 121.326 121.326 123.366 -2.040 25342 6220 1 8 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.337 -0.104 25342 6221 1 8 . 1 1 66 66 GLU C C 66 173.978 173.978 176.042 -2.064 25342 6222 1 8 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.644 -3.113 25342 6223 1 8 . 1 1 66 66 GLU CB C 66 27.700 27.700 29.874 -2.174 25342 6224 1 8 . 1 1 66 66 GLU H H 66 8.225 8.225 8.657 -0.432 25342 6225 1 8 . 1 1 67 67 ILE N N 67 113.897 113.897 120.682 -6.785 25342 6226 1 8 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.566 0.603 25342 6227 1 8 . 1 1 67 67 ILE C C 67 172.791 172.791 176.570 -3.779 25342 6228 1 8 . 1 1 67 67 ILE CA C 67 56.275 56.275 60.842 -4.567 25342 6229 1 8 . 1 1 67 67 ILE CB C 67 39.016 39.016 39.069 -0.053 25342 6230 1 8 . 1 1 67 67 ILE H H 67 8.366 8.366 8.377 -0.011 25342 6231 1 8 . 1 1 68 68 GLN N N 68 121.654 121.654 120.569 1.085 25342 6232 1 8 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.507 0.012 25342 6233 1 8 . 1 1 68 68 GLN C C 68 171.562 171.562 174.519 -2.957 25342 6234 1 8 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.628 -2.315 25342 6235 1 8 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.172 -1.387 25342 6236 1 8 . 1 1 68 68 GLN H H 68 8.763 8.763 8.432 0.331 25342 6237 1 8 . 1 1 69 69 LEU N N 69 125.289 125.289 119.591 5.698 25342 6238 1 8 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.621 -0.102 25342 6239 1 8 . 1 1 69 69 LEU C C 69 172.567 172.567 175.706 -3.139 25342 6240 1 8 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.172 -2.375 25342 6241 1 8 . 1 1 69 69 LEU CB C 69 42.742 42.742 44.188 -1.446 25342 6242 1 8 . 1 1 69 69 LEU H H 69 7.996 7.996 7.540 0.456 25342 6243 1 8 . 1 1 70 70 ASP N N 70 123.170 123.170 122.572 0.598 25342 6244 1 8 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.697 -0.291 25342 6245 1 8 . 1 1 70 70 ASP C C 70 171.978 171.978 174.881 -2.903 25342 6246 1 8 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.096 -2.413 25342 6247 1 8 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.660 -2.931 25342 6248 1 8 . 1 1 70 70 ASP H H 70 8.278 8.278 8.402 -0.124 25342 6249 1 8 . 1 1 71 71 ASN N N 71 117.524 117.524 118.385 -0.861 25342 6250 1 8 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.820 -0.493 25342 6251 1 8 . 1 1 71 71 ASN C C 71 171.825 171.825 174.981 -3.156 25342 6252 1 8 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.217 -1.560 25342 6253 1 8 . 1 1 71 71 ASN CB C 71 35.230 35.230 39.402 -4.172 25342 6254 1 8 . 1 1 71 71 ASN H H 71 8.372 8.372 8.389 -0.017 25342 6255 1 8 . 1 1 72 72 ILE N N 72 124.515 124.515 122.896 1.619 25342 6256 1 8 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.066 -0.137 25342 6257 1 8 . 1 1 72 72 ILE C C 72 171.607 171.607 174.481 -2.874 25342 6258 1 8 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.065 -2.776 25342 6259 1 8 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.960 -3.200 25342 6260 1 8 . 1 1 72 72 ILE H H 72 7.653 7.653 8.169 -0.516 25342 6261 1 8 . 1 1 73 73 ASP N N 73 125.182 125.182 125.621 -0.439 25342 6262 1 8 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.736 -0.108 25342 6263 1 8 . 1 1 73 73 ASP C C 73 173.980 173.980 176.408 -2.428 25342 6264 1 8 . 1 1 73 73 ASP CA C 73 49.214 49.214 53.623 -4.409 25342 6265 1 8 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.435 -3.533 25342 6266 1 8 . 1 1 73 73 ASP H H 73 8.382 8.382 8.564 -0.182 25342 6267 1 8 . 1 1 74 74 TYR N N 74 123.092 123.092 123.162 -0.070 25342 6268 1 8 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.386 -0.521 25342 6269 1 8 . 1 1 74 74 TYR C C 74 173.582 173.582 177.231 -3.649 25342 6270 1 8 . 1 1 74 74 TYR CA C 74 59.486 59.486 59.694 -0.208 25342 6271 1 8 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.026 -3.218 25342 6272 1 8 . 1 1 74 74 TYR H H 74 7.348 7.348 7.822 -0.474 25342 6273 1 8 . 1 1 75 75 ASN N N 75 109.447 109.447 115.952 -6.505 25342 6274 1 8 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.489 0.436 25342 6275 1 8 . 1 1 75 75 ASN C C 75 172.570 172.570 175.838 -3.268 25342 6276 1 8 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.373 -2.755 25342 6277 1 8 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.376 -2.842 25342 6278 1 8 . 1 1 75 75 ASN H H 75 8.040 8.040 8.551 -0.511 25342 6279 1 8 . 1 1 76 76 ASN N N 76 117.411 117.411 116.155 1.256 25342 6280 1 8 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.552 -0.098 25342 6281 1 8 . 1 1 76 76 ASN C C 76 171.155 171.155 174.605 -3.450 25342 6282 1 8 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.852 -2.918 25342 6283 1 8 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.620 -2.962 25342 6284 1 8 . 1 1 76 76 ASN H H 76 7.750 7.750 7.700 0.050 25342 6285 1 8 . 1 1 77 77 TYR N N 77 116.878 116.878 118.618 -1.740 25342 6286 1 8 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.617 -0.263 25342 6287 1 8 . 1 1 77 77 TYR C C 77 172.224 172.224 174.634 -2.410 25342 6288 1 8 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.815 -2.575 25342 6289 1 8 . 1 1 77 77 TYR CB C 77 37.113 37.113 40.786 -3.673 25342 6290 1 8 . 1 1 77 77 TYR H H 77 7.789 7.789 7.465 0.324 25342 6291 1 8 . 1 1 78 78 ASP N N 78 121.352 121.352 122.229 -0.877 25342 6292 1 8 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.653 0.144 25342 6293 1 8 . 1 1 78 78 ASP C C 78 172.623 172.623 175.461 -2.838 25342 6294 1 8 . 1 1 78 78 ASP CA C 78 53.190 53.190 55.355 -2.165 25342 6295 1 8 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.802 -1.767 25342 6296 1 8 . 1 1 78 78 ASP H H 78 9.036 9.036 8.763 0.273 25342 6297 1 8 . 1 1 79 79 LEU N N 79 123.073 123.073 117.270 5.803 25342 6298 1 8 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.106 0.002 25342 6299 1 8 . 1 1 79 79 LEU C C 79 170.730 170.730 174.141 -3.411 25342 6300 1 8 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.056 -2.799 25342 6301 1 8 . 1 1 79 79 LEU CB C 79 42.284 42.284 45.920 -3.636 25342 6302 1 8 . 1 1 79 79 LEU H H 79 7.877 7.877 7.822 0.055 25342 6303 1 8 . 1 1 80 80 ILE N N 80 126.348 126.348 123.662 2.686 25342 6304 1 8 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.835 0.234 25342 6305 1 8 . 1 1 80 80 ILE C C 80 171.584 171.584 175.039 -3.455 25342 6306 1 8 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.187 -2.772 25342 6307 1 8 . 1 1 80 80 ILE CB C 80 37.998 37.998 39.977 -1.979 25342 6308 1 8 . 1 1 80 80 ILE H H 80 8.704 8.704 8.608 0.096 25342 6309 1 8 . 1 1 81 81 LEU N N 81 126.303 126.303 128.493 -2.190 25342 6310 1 8 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.693 0.430 25342 6311 1 8 . 1 1 81 81 LEU C C 81 172.779 172.779 175.854 -3.075 25342 6312 1 8 . 1 1 81 81 LEU CA C 81 49.509 49.509 55.156 -5.646 25342 6313 1 8 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.542 -1.827 25342 6314 1 8 . 1 1 81 81 LEU H H 81 9.202 9.202 7.944 1.258 25342 6315 1 8 . 1 1 82 82 ILE N N 82 120.931 120.931 119.168 1.763 25342 6316 1 8 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.310 -0.463 25342 6317 1 8 . 1 1 82 82 ILE C C 82 172.796 172.796 175.139 -2.343 25342 6318 1 8 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.822 -2.941 25342 6319 1 8 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.648 -4.851 25342 6320 1 8 . 1 1 82 82 ILE H H 82 8.846 8.846 8.176 0.670 25342 6321 1 8 . 1 1 83 83 GLY N N 83 120.905 120.905 110.023 10.882 25342 6322 1 8 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.692 -3.135 25342 6323 1 8 . 1 1 83 83 GLY H H 83 9.558 9.558 8.241 1.317 25342 6324 1 8 . 1 1 84 84 SER N N 84 116.601 116.601 112.826 3.775 25342 6325 1 8 . 1 1 84 84 SER HA H 84 5.476 5.476 5.025 0.451 25342 6326 1 8 . 1 1 84 84 SER CA C 84 51.324 51.324 56.669 -5.345 25342 6327 1 8 . 1 1 84 84 SER CB C 84 64.271 64.271 64.396 -0.125 25342 6328 1 8 . 1 1 84 84 SER H H 84 7.533 7.533 7.566 -0.033 25342 6329 1 8 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.425 0.738 25342 6330 1 8 . 1 1 85 85 PRO C C 85 175.590 175.590 176.370 -0.780 25342 6331 1 8 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.953 -4.070 25342 6332 1 8 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.140 -1.666 25342 6333 1 8 . 1 1 86 86 VAL N N 86 116.295 116.295 120.511 -4.216 25342 6334 1 8 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.246 -0.425 25342 6335 1 8 . 1 1 86 86 VAL C C 86 172.692 172.692 175.628 -2.936 25342 6336 1 8 . 1 1 86 86 VAL CA C 86 59.812 59.812 63.500 -3.688 25342 6337 1 8 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.147 -2.064 25342 6338 1 8 . 1 1 86 86 VAL H H 86 7.246 7.246 8.180 -0.934 25342 6339 1 8 . 1 1 87 87 TRP N N 87 131.042 131.042 122.000 9.042 25342 6340 1 8 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.726 -0.415 25342 6341 1 8 . 1 1 87 87 TRP C C 87 173.323 173.323 175.628 -2.305 25342 6342 1 8 . 1 1 87 87 TRP CA C 87 50.887 50.887 56.002 -5.115 25342 6343 1 8 . 1 1 87 87 TRP CB C 87 27.310 27.310 33.454 -6.144 25342 6344 1 8 . 1 1 87 87 TRP H H 87 9.555 9.555 7.740 1.815 25342 6345 1 8 . 1 1 88 88 SER N N 88 122.660 122.660 116.960 5.700 25342 6346 1 8 . 1 1 88 88 SER HA H 88 4.582 4.582 4.197 0.385 25342 6347 1 8 . 1 1 88 88 SER C C 88 172.096 172.096 175.139 -3.043 25342 6348 1 8 . 1 1 88 88 SER CA C 88 55.391 55.391 60.124 -4.733 25342 6349 1 8 . 1 1 88 88 SER CB C 88 57.813 57.813 61.958 -4.145 25342 6350 1 8 . 1 1 88 88 SER H H 88 10.257 10.257 9.106 1.151 25342 6351 1 8 . 1 1 89 89 GLY N N 89 128.381 128.381 112.459 15.922 25342 6352 1 8 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.927 -2.298 25342 6353 1 8 . 1 1 89 89 GLY H H 89 6.372 6.372 8.392 -2.020 25342 6354 1 8 . 1 1 90 90 TYR N N 90 120.345 120.345 119.108 1.237 25342 6355 1 8 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.657 -0.468 25342 6356 1 8 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.694 -0.145 25342 6357 1 8 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.998 -1.802 25342 6358 1 8 . 1 1 90 90 TYR H H 90 8.113 8.113 6.984 1.129 25342 6359 1 8 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.749 0.085 25342 6360 1 8 . 1 1 91 91 PRO C C 91 170.911 170.911 177.141 -6.230 25342 6361 1 8 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.476 -3.641 25342 6362 1 8 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.428 -6.358 25342 6363 1 8 . 1 1 92 92 ALA N N 92 120.629 120.629 122.726 -2.097 25342 6364 1 8 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.861 -0.242 25342 6365 1 8 . 1 1 92 92 ALA C C 92 176.782 176.782 176.622 0.160 25342 6366 1 8 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.856 -1.440 25342 6367 1 8 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.914 -1.398 25342 6368 1 8 . 1 1 92 92 ALA H H 92 7.554 7.554 8.690 -1.136 25342 6369 1 8 . 1 1 93 93 THR N N 93 112.558 112.558 109.916 2.642 25342 6370 1 8 . 1 1 93 93 THR CB C 93 64.173 64.173 67.376 -3.203 25342 6371 1 8 . 1 1 93 93 THR H H 93 6.730 6.730 7.478 -0.748 25342 6372 1 8 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.436 -0.577 25342 6373 1 8 . 1 1 94 94 PRO C C 94 173.309 173.309 177.149 -3.840 25342 6374 1 8 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.548 -1.485 25342 6375 1 8 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.982 -2.703 25342 6376 1 8 . 1 1 95 95 ILE N N 95 111.014 111.014 114.568 -3.554 25342 6377 1 8 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.411 -0.806 25342 6378 1 8 . 1 1 95 95 ILE C C 95 174.302 174.302 176.959 -2.657 25342 6379 1 8 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.589 -2.408 25342 6380 1 8 . 1 1 95 95 ILE CB C 95 31.783 31.783 37.145 -5.362 25342 6381 1 8 . 1 1 95 95 ILE H H 95 7.995 7.995 8.208 -0.213 25342 6382 1 8 . 1 1 96 96 LYS N N 96 123.208 123.208 122.934 0.274 25342 6383 1 8 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.927 -0.835 25342 6384 1 8 . 1 1 96 96 LYS C C 96 174.451 174.451 178.459 -4.008 25342 6385 1 8 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.443 -2.402 25342 6386 1 8 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.671 -2.924 25342 6387 1 8 . 1 1 96 96 LYS H H 96 6.928 6.928 7.613 -0.685 25342 6388 1 8 . 1 1 97 97 THR N N 97 113.320 113.320 114.583 -1.263 25342 6389 1 8 . 1 1 97 97 THR HA H 97 3.436 3.436 3.703 -0.267 25342 6390 1 8 . 1 1 97 97 THR C C 97 173.221 173.221 176.333 -3.112 25342 6391 1 8 . 1 1 97 97 THR CA C 97 62.710 62.710 65.442 -2.732 25342 6392 1 8 . 1 1 97 97 THR CB C 97 65.562 65.562 68.816 -3.254 25342 6393 1 8 . 1 1 97 97 THR H H 97 6.325 6.325 7.908 -1.583 25342 6394 1 8 . 1 1 98 98 LEU N N 98 120.963 120.963 121.975 -1.012 25342 6395 1 8 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.167 -0.542 25342 6396 1 8 . 1 1 98 98 LEU C C 98 174.713 174.713 178.245 -3.532 25342 6397 1 8 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.464 -1.950 25342 6398 1 8 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.842 -2.114 25342 6399 1 8 . 1 1 98 98 LEU H H 98 7.536 7.536 7.719 -0.183 25342 6400 1 8 . 1 1 99 99 LEU N N 99 118.859 118.859 118.398 0.461 25342 6401 1 8 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.819 -0.147 25342 6402 1 8 . 1 1 99 99 LEU C C 99 177.458 177.458 178.610 -1.152 25342 6403 1 8 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.155 -3.010 25342 6404 1 8 . 1 1 99 99 LEU CB C 99 38.857 38.857 40.778 -1.921 25342 6405 1 8 . 1 1 99 99 LEU H H 99 8.179 8.179 8.447 -0.268 25342 6406 1 8 . 1 1 100 100 ASP N N 100 118.703 118.703 118.433 0.270 25342 6407 1 8 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.261 -0.040 25342 6408 1 8 . 1 1 100 100 ASP C C 100 176.472 176.472 177.960 -1.488 25342 6409 1 8 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.895 -2.588 25342 6410 1 8 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.657 -3.299 25342 6411 1 8 . 1 1 100 100 ASP H H 100 7.867 7.867 7.915 -0.048 25342 6412 1 8 . 1 1 101 101 GLN N N 101 117.829 117.829 116.500 1.329 25342 6413 1 8 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.407 -0.207 25342 6414 1 8 . 1 1 101 101 GLN C C 101 174.508 174.508 176.104 -1.596 25342 6415 1 8 . 1 1 101 101 GLN CA C 101 54.688 54.688 55.568 -0.880 25342 6416 1 8 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.114 -3.517 25342 6417 1 8 . 1 1 101 101 GLN H H 101 7.597 7.597 7.575 0.022 25342 6418 1 8 . 1 1 102 102 MET N N 102 118.406 118.406 115.660 2.746 25342 6419 1 8 . 1 1 102 102 MET HA H 102 3.864 3.864 5.043 -1.179 25342 6420 1 8 . 1 1 102 102 MET C C 102 172.820 172.820 176.211 -3.391 25342 6421 1 8 . 1 1 102 102 MET CA C 102 53.298 53.298 54.500 -1.202 25342 6422 1 8 . 1 1 102 102 MET CB C 102 31.207 31.207 33.414 -2.207 25342 6423 1 8 . 1 1 102 102 MET H H 102 7.434 7.434 7.751 -0.317 25342 6424 1 8 . 1 1 103 103 LYS N N 103 115.889 115.889 121.528 -5.639 25342 6425 1 8 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.873 0.046 25342 6426 1 8 . 1 1 103 103 LYS C C 103 173.938 173.938 177.174 -3.236 25342 6427 1 8 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.635 -3.197 25342 6428 1 8 . 1 1 103 103 LYS CB C 103 29.263 29.263 32.317 -3.054 25342 6429 1 8 . 1 1 103 103 LYS H H 103 6.881 6.881 7.999 -1.118 25342 6430 1 8 . 1 1 104 104 ASN N N 104 114.951 114.951 114.531 0.420 25342 6431 1 8 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.604 0.127 25342 6432 1 8 . 1 1 104 104 ASN C C 104 172.617 172.617 175.640 -3.023 25342 6433 1 8 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.411 -3.145 25342 6434 1 8 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.021 -2.238 25342 6435 1 8 . 1 1 104 104 ASN H H 104 8.493 8.493 8.227 0.266 25342 6436 1 8 . 1 1 105 105 TYR N N 105 122.680 122.680 121.611 1.069 25342 6437 1 8 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.388 0.174 25342 6438 1 8 . 1 1 105 105 TYR CA C 105 55.433 55.433 59.496 -4.063 25342 6439 1 8 . 1 1 105 105 TYR CB C 105 35.832 35.832 38.841 -3.009 25342 6440 1 8 . 1 1 105 105 TYR H H 105 8.217 8.217 7.570 0.647 25342 6441 1 8 . 1 1 106 106 ARG N N 106 128.872 128.872 122.402 6.470 25342 6442 1 8 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.542 -0.277 25342 6443 1 8 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.741 -2.759 25342 6444 1 8 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.902 -4.772 25342 6445 1 8 . 1 1 106 106 ARG H H 106 8.801 8.801 8.436 0.365 25342 6446 1 8 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.764 -2.364 25342 6447 1 8 . 1 1 108 108 GLU N N 108 117.000 117.000 120.764 -3.764 25342 6448 1 8 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.542 0.084 25342 6449 1 8 . 1 1 108 108 GLU C C 108 174.125 174.125 175.548 -1.423 25342 6450 1 8 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.134 -2.346 25342 6451 1 8 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.539 -1.099 25342 6452 1 8 . 1 1 108 108 GLU H H 108 7.514 7.514 8.506 -0.992 25342 6453 1 8 . 1 1 109 109 VAL N N 109 123.398 123.398 120.373 3.025 25342 6454 1 8 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.851 0.486 25342 6455 1 8 . 1 1 109 109 VAL C C 109 170.606 170.606 174.225 -3.619 25342 6456 1 8 . 1 1 109 109 VAL CA C 109 57.280 57.280 61.512 -4.232 25342 6457 1 8 . 1 1 109 109 VAL CB C 109 32.657 32.657 36.092 -3.435 25342 6458 1 8 . 1 1 109 109 VAL H H 109 8.942 8.942 8.333 0.609 25342 6459 1 8 . 1 1 110 110 ALA N N 110 127.905 127.905 128.358 -0.453 25342 6460 1 8 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.206 -0.579 25342 6461 1 8 . 1 1 110 110 ALA C C 110 173.195 173.195 175.186 -1.991 25342 6462 1 8 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.428 -2.082 25342 6463 1 8 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.054 -3.729 25342 6464 1 8 . 1 1 110 110 ALA H H 110 8.776 8.776 8.004 0.772 25342 6465 1 8 . 1 1 111 111 SER N N 111 110.523 110.523 113.308 -2.785 25342 6466 1 8 . 1 1 111 111 SER HA H 111 5.562 5.562 5.547 0.015 25342 6467 1 8 . 1 1 111 111 SER C C 111 170.719 170.719 173.045 -2.326 25342 6468 1 8 . 1 1 111 111 SER CA C 111 51.314 51.314 55.156 -3.842 25342 6469 1 8 . 1 1 111 111 SER CB C 111 61.907 61.907 65.561 -3.654 25342 6470 1 8 . 1 1 111 111 SER H H 111 7.480 7.480 8.066 -0.586 25342 6471 1 8 . 1 1 112 112 PHE N N 112 125.567 125.567 119.786 5.781 25342 6472 1 8 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.183 1.173 25342 6473 1 8 . 1 1 112 112 PHE C C 112 169.536 169.536 172.234 -2.698 25342 6474 1 8 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.327 -4.956 25342 6475 1 8 . 1 1 112 112 PHE CB C 112 39.788 39.788 41.839 -2.051 25342 6476 1 8 . 1 1 112 112 PHE H H 112 7.848 7.848 7.507 0.341 25342 6477 1 8 . 1 1 113 113 PHE N N 113 115.065 115.065 115.257 -0.192 25342 6478 1 8 . 1 1 113 113 PHE HA H 113 6.104 6.104 4.982 1.122 25342 6479 1 8 . 1 1 113 113 PHE C C 113 173.006 173.006 175.854 -2.848 25342 6480 1 8 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.236 -4.974 25342 6481 1 8 . 1 1 113 113 PHE CB C 113 38.749 38.749 42.058 -3.309 25342 6482 1 8 . 1 1 113 113 PHE H H 113 7.361 7.361 7.604 -0.243 25342 6483 1 8 . 1 1 114 114 THR N N 114 108.014 108.014 112.305 -4.291 25342 6484 1 8 . 1 1 114 114 THR HA H 114 4.999 4.999 4.590 0.409 25342 6485 1 8 . 1 1 114 114 THR C C 114 169.874 169.874 174.352 -4.478 25342 6486 1 8 . 1 1 114 114 THR CA C 114 56.500 56.500 61.256 -4.756 25342 6487 1 8 . 1 1 114 114 THR CB C 114 68.809 68.809 69.198 -0.389 25342 6488 1 8 . 1 1 114 114 THR H H 114 7.867 7.867 8.588 -0.721 25342 6489 1 8 . 1 1 115 115 SER N N 115 115.049 115.049 117.678 -2.629 25342 6490 1 8 . 1 1 115 115 SER HA H 115 5.613 5.613 4.247 1.366 25342 6491 1 8 . 1 1 115 115 SER C C 115 171.247 171.247 175.872 -4.625 25342 6492 1 8 . 1 1 115 115 SER CA C 115 54.830 54.830 58.127 -3.297 25342 6493 1 8 . 1 1 115 115 SER CB C 115 63.992 63.992 63.556 0.437 25342 6494 1 8 . 1 1 115 115 SER H H 115 8.970 8.970 7.721 1.249 25342 6495 1 8 . 1 1 116 116 ALA N N 116 122.671 122.671 124.830 -2.159 25342 6496 1 8 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.244 0.741 25342 6497 1 8 . 1 1 116 116 ALA C C 116 176.180 176.180 177.216 -1.036 25342 6498 1 8 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.309 -3.110 25342 6499 1 8 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.267 -1.272 25342 6500 1 8 . 1 1 116 116 ALA H H 116 8.963 8.963 8.751 0.212 25342 6501 1 8 . 1 1 117 117 GLY N N 117 107.387 107.387 107.810 -0.423 25342 6502 1 8 . 1 1 117 117 GLY C C 117 172.528 172.528 174.314 -1.786 25342 6503 1 8 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.272 -1.540 25342 6504 1 8 . 1 1 117 117 GLY H H 117 9.340 9.340 8.091 1.249 25342 6505 1 8 . 1 1 118 118 THR N N 118 113.481 113.481 112.259 1.222 25342 6506 1 8 . 1 1 118 118 THR HA H 118 4.651 4.651 4.358 0.293 25342 6507 1 8 . 1 1 118 118 THR C C 118 172.067 172.067 174.782 -2.715 25342 6508 1 8 . 1 1 118 118 THR CA C 118 57.357 57.357 60.364 -3.007 25342 6509 1 8 . 1 1 118 118 THR CB C 118 69.475 69.475 69.895 -0.421 25342 6510 1 8 . 1 1 118 118 THR H H 118 9.373 9.373 7.469 1.904 25342 6511 1 8 . 1 1 119 119 ASN N N 119 113.202 113.202 116.340 -3.138 25342 6512 1 8 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.256 0.362 25342 6513 1 8 . 1 1 119 119 ASN C C 119 173.114 173.114 176.215 -3.101 25342 6514 1 8 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.574 -2.890 25342 6515 1 8 . 1 1 119 119 ASN CB C 119 33.730 33.730 36.735 -3.005 25342 6516 1 8 . 1 1 119 119 ASN H H 119 8.908 8.908 8.824 0.084 25342 6517 1 8 . 1 1 120 120 HIS N N 120 117.315 117.315 117.618 -0.303 25342 6518 1 8 . 1 1 120 120 HIS HA H 120 3.786 3.786 3.825 -0.039 25342 6519 1 8 . 1 1 120 120 HIS C C 120 174.381 174.381 176.476 -2.095 25342 6520 1 8 . 1 1 120 120 HIS CA C 120 54.516 54.516 59.189 -4.673 25342 6521 1 8 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.479 -2.975 25342 6522 1 8 . 1 1 120 120 HIS H H 120 8.074 8.074 8.351 -0.277 25342 6523 1 8 . 1 1 121 121 LYS N N 121 118.678 118.678 119.634 -0.956 25342 6524 1 8 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.934 -0.100 25342 6525 1 8 . 1 1 121 121 LYS C C 121 176.564 176.564 178.046 -1.482 25342 6526 1 8 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.622 -1.327 25342 6527 1 8 . 1 1 121 121 LYS CB C 121 28.942 28.942 30.988 -2.046 25342 6528 1 8 . 1 1 121 121 LYS H H 121 8.336 8.336 7.918 0.418 25342 6529 1 8 . 1 1 122 122 ALA N N 122 122.146 122.146 123.156 -1.010 25342 6530 1 8 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.088 -0.393 25342 6531 1 8 . 1 1 122 122 ALA C C 122 175.163 175.163 179.526 -4.363 25342 6532 1 8 . 1 1 122 122 ALA CA C 122 51.692 51.692 55.093 -3.401 25342 6533 1 8 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.991 -2.273 25342 6534 1 8 . 1 1 122 122 ALA H H 122 7.584 7.584 7.853 -0.269 25342 6535 1 8 . 1 1 123 123 TYR N N 123 119.730 119.730 119.825 -0.095 25342 6536 1 8 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.139 -0.986 25342 6537 1 8 . 1 1 123 123 TYR C C 123 174.340 174.340 178.000 -3.660 25342 6538 1 8 . 1 1 123 123 TYR CA C 123 60.398 60.398 61.196 -0.798 25342 6539 1 8 . 1 1 123 123 TYR CB C 123 34.663 34.663 38.161 -3.498 25342 6540 1 8 . 1 1 123 123 TYR H H 123 7.317 7.317 7.939 -0.622 25342 6541 1 8 . 1 1 124 124 VAL N N 124 118.649 118.649 118.372 0.277 25342 6542 1 8 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.653 -0.451 25342 6543 1 8 . 1 1 124 124 VAL C C 124 175.603 175.603 178.333 -2.730 25342 6544 1 8 . 1 1 124 124 VAL CA C 124 64.680 64.680 67.290 -2.610 25342 6545 1 8 . 1 1 124 124 VAL CB C 124 29.289 29.289 31.639 -2.350 25342 6546 1 8 . 1 1 124 124 VAL H H 124 7.799 7.799 7.962 -0.163 25342 6547 1 8 . 1 1 125 125 SER N N 125 114.475 114.475 113.800 0.675 25342 6548 1 8 . 1 1 125 125 SER HA H 125 4.032 4.032 4.125 -0.093 25342 6549 1 8 . 1 1 125 125 SER C C 125 174.849 174.849 176.411 -1.562 25342 6550 1 8 . 1 1 125 125 SER CA C 125 59.002 59.002 62.034 -3.032 25342 6551 1 8 . 1 1 125 125 SER CB C 125 59.613 59.613 63.209 -3.596 25342 6552 1 8 . 1 1 125 125 SER H H 125 7.766 7.766 8.161 -0.395 25342 6553 1 8 . 1 1 126 126 HIS N N 126 119.326 119.326 120.459 -1.133 25342 6554 1 8 . 1 1 126 126 HIS HA H 126 4.127 4.127 3.681 0.446 25342 6555 1 8 . 1 1 126 126 HIS C C 126 172.865 172.865 177.209 -4.344 25342 6556 1 8 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.445 -3.739 25342 6557 1 8 . 1 1 126 126 HIS CB C 126 25.993 25.993 29.415 -3.422 25342 6558 1 8 . 1 1 126 126 HIS H H 126 8.569 8.569 8.334 0.235 25342 6559 1 8 . 1 1 127 127 PHE N N 127 121.044 121.044 120.508 0.536 25342 6560 1 8 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.220 -1.046 25342 6561 1 8 . 1 1 127 127 PHE C C 127 173.378 173.378 176.929 -3.551 25342 6562 1 8 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.698 -0.831 25342 6563 1 8 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.337 -3.283 25342 6564 1 8 . 1 1 127 127 PHE H H 127 9.139 9.139 8.943 0.196 25342 6565 1 8 . 1 1 128 128 ASN N N 128 114.893 114.893 117.864 -2.971 25342 6566 1 8 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.313 -0.273 25342 6567 1 8 . 1 1 128 128 ASN C C 128 175.230 175.230 177.818 -2.588 25342 6568 1 8 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.131 -1.831 25342 6569 1 8 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.419 -2.248 25342 6570 1 8 . 1 1 128 128 ASN H H 128 7.774 7.774 8.193 -0.419 25342 6571 1 8 . 1 1 129 129 GLU N N 129 119.804 119.804 121.828 -2.024 25342 6572 1 8 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.992 0.048 25342 6573 1 8 . 1 1 129 129 GLU C C 129 177.052 177.052 178.949 -1.897 25342 6574 1 8 . 1 1 129 129 GLU CA C 129 56.730 56.730 59.596 -2.866 25342 6575 1 8 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.509 -2.312 25342 6576 1 8 . 1 1 129 129 GLU H H 129 7.577 7.577 7.728 -0.151 25342 6577 1 8 . 1 1 130 130 TRP N N 130 120.979 120.979 117.303 3.676 25342 6578 1 8 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.429 0.028 25342 6579 1 8 . 1 1 130 130 TRP C C 130 174.329 174.329 176.040 -1.711 25342 6580 1 8 . 1 1 130 130 TRP CA C 130 54.688 54.688 57.508 -2.820 25342 6581 1 8 . 1 1 130 130 TRP CB C 130 26.991 26.991 28.514 -1.523 25342 6582 1 8 . 1 1 130 130 TRP H H 130 8.225 8.225 7.990 0.235 25342 6583 1 8 . 1 1 131 131 ALA N N 131 120.450 120.450 116.214 4.236 25342 6584 1 8 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.372 -0.436 25342 6585 1 8 . 1 1 131 131 ALA C C 131 172.487 172.487 175.392 -2.905 25342 6586 1 8 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.060 -2.626 25342 6587 1 8 . 1 1 131 131 ALA CB C 131 16.288 16.288 20.095 -3.807 25342 6588 1 8 . 1 1 131 131 ALA H H 131 8.081 8.081 6.985 1.096 25342 6589 1 8 . 1 1 132 132 ASP N N 132 117.813 117.813 120.908 -3.095 25342 6590 1 8 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.354 -0.146 25342 6591 1 8 . 1 1 132 132 ASP C C 132 173.804 173.804 177.276 -3.472 25342 6592 1 8 . 1 1 132 132 ASP CA C 132 54.181 54.181 56.072 -1.891 25342 6593 1 8 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.442 -1.121 25342 6594 1 8 . 1 1 132 132 ASP H H 132 6.772 6.772 7.525 -0.753 25342 6595 1 8 . 1 1 133 133 GLY N N 133 115.052 115.052 113.922 1.130 25342 6596 1 8 . 1 1 133 133 GLY C C 133 172.078 172.078 173.596 -1.518 25342 6597 1 8 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.856 -2.436 25342 6598 1 8 . 1 1 133 133 GLY H H 133 8.626 8.626 8.506 0.120 25342 6599 1 8 . 1 1 134 134 LEU N N 134 120.063 120.063 122.354 -2.291 25342 6600 1 8 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.739 -0.267 25342 6601 1 8 . 1 1 134 134 LEU C C 134 174.079 174.079 176.248 -2.169 25342 6602 1 8 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.716 -2.752 25342 6603 1 8 . 1 1 134 134 LEU CB C 134 40.370 40.370 43.420 -3.050 25342 6604 1 8 . 1 1 134 134 LEU H H 134 8.094 8.094 7.685 0.409 25342 6605 1 8 . 1 1 135 135 ASN N N 135 119.292 119.292 121.524 -2.232 25342 6606 1 8 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.591 0.032 25342 6607 1 8 . 1 1 135 135 ASN C C 135 170.527 170.527 174.902 -4.375 25342 6608 1 8 . 1 1 135 135 ASN CA C 135 49.002 49.002 54.012 -5.010 25342 6609 1 8 . 1 1 135 135 ASN CB C 135 33.560 33.560 39.183 -5.623 25342 6610 1 8 . 1 1 135 135 ASN H H 135 8.513 8.513 8.509 0.004 25342 6611 1 8 . 1 1 136 136 VAL N N 136 125.412 125.412 123.267 2.145 25342 6612 1 8 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.562 0.044 25342 6613 1 8 . 1 1 136 136 VAL C C 136 175.420 175.420 175.990 -0.570 25342 6614 1 8 . 1 1 136 136 VAL CA C 136 58.382 58.382 61.360 -2.978 25342 6615 1 8 . 1 1 136 136 VAL CB C 136 29.247 29.247 34.136 -4.888 25342 6616 1 8 . 1 1 136 136 VAL H H 136 7.648 7.648 8.383 -0.735 25342 6617 1 8 . 1 1 137 137 ILE N N 137 121.881 121.881 122.478 -0.597 25342 6618 1 8 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.285 0.148 25342 6619 1 8 . 1 1 137 137 ILE C C 137 173.906 173.906 176.208 -2.302 25342 6620 1 8 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.945 -2.967 25342 6621 1 8 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.248 -2.052 25342 6622 1 8 . 1 1 137 137 ILE H H 137 9.139 9.139 8.456 0.683 25342 6623 1 8 . 1 1 138 138 GLY N N 138 108.226 108.226 106.904 1.322 25342 6624 1 8 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.188 -1.797 25342 6625 1 8 . 1 1 138 138 GLY H H 138 6.645 6.645 7.308 -0.663 25342 6626 1 8 . 1 1 139 139 VAL N N 139 119.408 119.408 118.569 0.839 25342 6627 1 8 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.320 0.037 25342 6628 1 8 . 1 1 139 139 VAL C C 139 172.327 172.327 173.709 -1.382 25342 6629 1 8 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.169 -1.902 25342 6630 1 8 . 1 1 139 139 VAL CB C 139 32.743 32.743 34.460 -1.717 25342 6631 1 8 . 1 1 139 139 VAL H H 139 8.092 8.092 8.642 -0.550 25342 6632 1 8 . 1 1 140 140 ALA N N 140 127.415 127.415 129.285 -1.870 25342 6633 1 8 . 1 1 140 140 ALA HA H 140 4.445 4.445 4.852 -0.407 25342 6634 1 8 . 1 1 140 140 ALA C C 140 170.718 170.718 174.761 -4.043 25342 6635 1 8 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.932 -3.032 25342 6636 1 8 . 1 1 140 140 ALA CB C 140 21.059 21.059 21.468 -0.409 25342 6637 1 8 . 1 1 140 140 ALA H H 140 9.093 9.093 8.295 0.798 25342 6638 1 8 . 1 1 141 141 ARG N N 141 119.287 119.287 119.508 -0.221 25342 6639 1 8 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.157 -2.670 25342 6640 1 8 . 1 1 141 141 ARG C C 141 173.375 173.375 176.151 -2.776 25342 6641 1 8 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.937 -3.053 25342 6642 1 8 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.105 -4.421 25342 6643 1 8 . 1 1 141 141 ARG H H 141 7.620 7.620 8.442 -0.822 25342 6644 1 8 . 1 1 142 142 ASP N N 142 125.999 125.999 121.247 4.752 25342 6645 1 8 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.429 -0.705 25342 6646 1 8 . 1 1 142 142 ASP C C 142 169.292 169.292 175.749 -6.457 25342 6647 1 8 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.311 -2.973 25342 6648 1 8 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.487 -3.810 25342 6649 1 8 . 1 1 142 142 ASP H H 142 9.482 9.482 8.596 0.886 25342 6650 1 8 . 1 1 143 143 ASP N N 143 119.293 119.293 119.466 -0.173 25342 6651 1 8 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.666 -0.360 25342 6652 1 8 . 1 1 143 143 ASP C C 143 175.686 175.686 176.912 -1.226 25342 6653 1 8 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.446 -4.541 25342 6654 1 8 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.808 -4.496 25342 6655 1 8 . 1 1 143 143 ASP H H 143 8.108 8.108 8.608 -0.500 25342 6656 1 8 . 1 1 144 144 SER N N 144 115.303 115.303 117.678 -2.375 25342 6657 1 8 . 1 1 144 144 SER HA H 144 3.740 3.740 4.077 -0.337 25342 6658 1 8 . 1 1 144 144 SER C C 144 172.925 172.925 175.582 -2.657 25342 6659 1 8 . 1 1 144 144 SER CA C 144 59.213 59.213 60.699 -1.486 25342 6660 1 8 . 1 1 144 144 SER CB C 144 60.806 60.806 63.265 -2.459 25342 6661 1 8 . 1 1 144 144 SER H H 144 7.642 7.642 8.086 -0.444 25342 6662 1 8 . 1 1 145 145 GLU N N 145 119.523 119.523 120.587 -1.064 25342 6663 1 8 . 1 1 145 145 GLU HA H 145 4.306 4.306 3.941 0.365 25342 6664 1 8 . 1 1 145 145 GLU CA C 145 52.039 52.039 56.228 -4.189 25342 6665 1 8 . 1 1 145 145 GLU CB C 145 26.800 26.800 27.954 -1.154 25342 6666 1 8 . 1 1 145 145 GLU H H 145 7.771 7.771 8.173 -0.402 25342 6667 1 8 . 1 1 146 146 VAL N N 146 118.683 118.683 120.003 -1.320 25342 6668 1 8 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.793 -0.852 25342 6669 1 8 . 1 1 146 146 VAL C C 146 174.591 174.591 177.184 -2.593 25342 6670 1 8 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.335 -2.403 25342 6671 1 8 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.602 -2.555 25342 6672 1 8 . 1 1 146 146 VAL H H 146 6.352 6.352 7.374 -1.022 25342 6673 1 8 . 1 1 147 147 ASP N N 147 119.312 119.312 120.221 -0.909 25342 6674 1 8 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.307 -0.252 25342 6675 1 8 . 1 1 147 147 ASP C C 147 174.783 174.783 177.756 -2.973 25342 6676 1 8 . 1 1 147 147 ASP CA C 147 54.241 54.241 57.160 -2.919 25342 6677 1 8 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.821 -3.588 25342 6678 1 8 . 1 1 147 147 ASP H H 147 8.370 8.370 8.443 -0.073 25342 6679 1 8 . 1 1 148 148 LYS N N 148 119.342 119.342 117.471 1.871 25342 6680 1 8 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.316 -0.379 25342 6681 1 8 . 1 1 148 148 LYS C C 148 176.384 176.384 179.071 -2.687 25342 6682 1 8 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.842 -2.136 25342 6683 1 8 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.551 -3.040 25342 6684 1 8 . 1 1 148 148 LYS H H 148 7.040 7.040 7.599 -0.559 25342 6685 1 8 . 1 1 149 149 TRP N N 149 118.258 118.258 120.332 -2.074 25342 6686 1 8 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.936 -0.345 25342 6687 1 8 . 1 1 149 149 TRP C C 149 174.212 174.212 176.087 -1.875 25342 6688 1 8 . 1 1 149 149 TRP CA C 149 53.745 53.745 54.893 -1.148 25342 6689 1 8 . 1 1 149 149 TRP CB C 149 26.940 26.940 27.591 -0.651 25342 6690 1 8 . 1 1 149 149 TRP H H 149 7.811 7.811 7.882 -0.071 25342 6691 1 8 . 1 1 150 150 SER N N 150 109.618 109.618 113.288 -3.670 25342 6692 1 8 . 1 1 150 150 SER HA H 150 4.234 4.234 4.624 -0.390 25342 6693 1 8 . 1 1 150 150 SER C C 150 170.189 170.189 174.380 -4.191 25342 6694 1 8 . 1 1 150 150 SER CA C 150 56.695 56.695 58.058 -1.363 25342 6695 1 8 . 1 1 150 150 SER CB C 150 61.935 61.935 64.001 -2.066 25342 6696 1 8 . 1 1 150 150 SER H H 150 7.793 7.793 7.734 0.059 25342 6697 1 9 . 1 1 3 3 ALA N N 3 125.638 125.638 126.863 -1.225 25342 6698 1 9 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.665 -0.300 25342 6699 1 9 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.289 -2.991 25342 6700 1 9 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.569 -2.710 25342 6701 1 9 . 1 1 3 3 ALA H H 3 8.325 8.325 8.163 0.162 25342 6702 1 9 . 1 1 4 4 LYS N N 4 121.813 121.813 119.607 2.206 25342 6703 1 9 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.469 -0.242 25342 6704 1 9 . 1 1 4 4 LYS C C 4 174.574 174.574 176.047 -1.473 25342 6705 1 9 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.672 -1.891 25342 6706 1 9 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.009 -0.519 25342 6707 1 9 . 1 1 4 4 LYS H H 4 8.486 8.486 7.986 0.500 25342 6708 1 9 . 1 1 5 5 LYS N N 5 129.722 129.722 120.589 9.133 25342 6709 1 9 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.413 0.105 25342 6710 1 9 . 1 1 5 5 LYS C C 5 174.720 174.720 176.042 -1.322 25342 6711 1 9 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.963 -1.241 25342 6712 1 9 . 1 1 5 5 LYS CB C 5 29.785 29.785 33.593 -3.808 25342 6713 1 9 . 1 1 5 5 LYS H H 5 10.015 10.015 8.215 1.800 25342 6714 1 9 . 1 1 6 6 THR N N 6 126.254 126.254 114.501 11.753 25342 6715 1 9 . 1 1 6 6 THR HA H 6 5.654 5.654 4.895 0.759 25342 6716 1 9 . 1 1 6 6 THR C C 6 169.926 169.926 172.863 -2.937 25342 6717 1 9 . 1 1 6 6 THR CA C 6 60.598 60.598 61.957 -1.359 25342 6718 1 9 . 1 1 6 6 THR CB C 6 68.041 68.041 70.709 -2.668 25342 6719 1 9 . 1 1 6 6 THR H H 6 8.538 8.538 8.557 -0.019 25342 6720 1 9 . 1 1 7 7 LEU N N 7 130.775 130.775 130.011 0.764 25342 6721 1 9 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.643 -0.049 25342 6722 1 9 . 1 1 7 7 LEU C C 7 170.404 170.404 174.363 -3.959 25342 6723 1 9 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.761 -3.828 25342 6724 1 9 . 1 1 7 7 LEU CB C 7 40.728 40.728 42.689 -1.961 25342 6725 1 9 . 1 1 7 7 LEU H H 7 8.575 8.575 8.513 0.062 25342 6726 1 9 . 1 1 8 8 ILE N N 8 127.242 127.242 127.565 -0.323 25342 6727 1 9 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.437 0.411 25342 6728 1 9 . 1 1 8 8 ILE C C 8 170.936 170.936 174.962 -4.026 25342 6729 1 9 . 1 1 8 8 ILE CA C 8 57.252 57.252 61.478 -4.226 25342 6730 1 9 . 1 1 8 8 ILE CB C 8 36.935 36.935 38.551 -1.616 25342 6731 1 9 . 1 1 8 8 ILE H H 8 9.217 9.217 8.891 0.326 25342 6732 1 9 . 1 1 9 9 LEU N N 9 127.183 127.183 126.412 0.771 25342 6733 1 9 . 1 1 9 9 LEU HA H 9 5.694 5.694 5.207 0.487 25342 6734 1 9 . 1 1 9 9 LEU C C 9 173.824 173.824 175.634 -1.810 25342 6735 1 9 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.854 -4.015 25342 6736 1 9 . 1 1 9 9 LEU CB C 9 43.963 43.963 45.286 -1.323 25342 6737 1 9 . 1 1 9 9 LEU H H 9 9.248 9.248 8.753 0.495 25342 6738 1 9 . 1 1 10 10 TYR N N 10 113.330 113.330 118.540 -5.210 25342 6739 1 9 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.423 0.091 25342 6740 1 9 . 1 1 10 10 TYR C C 10 167.898 167.898 172.616 -4.718 25342 6741 1 9 . 1 1 10 10 TYR CA C 10 52.875 52.875 55.121 -2.246 25342 6742 1 9 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.889 -2.454 25342 6743 1 9 . 1 1 10 10 TYR H H 10 7.306 7.306 8.520 -1.214 25342 6744 1 9 . 1 1 11 11 TYR N N 11 121.297 121.297 122.407 -1.110 25342 6745 1 9 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.979 -0.217 25342 6746 1 9 . 1 1 11 11 TYR C C 11 169.698 169.698 174.380 -4.682 25342 6747 1 9 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.519 -0.472 25342 6748 1 9 . 1 1 11 11 TYR CB C 11 40.538 40.538 39.826 0.712 25342 6749 1 9 . 1 1 11 11 TYR H H 11 7.891 7.891 7.821 0.070 25342 6750 1 9 . 1 1 12 12 SER N N 12 117.763 117.763 124.435 -6.672 25342 6751 1 9 . 1 1 12 12 SER HA H 12 4.679 4.679 4.183 0.496 25342 6752 1 9 . 1 1 12 12 SER C C 12 170.075 170.075 173.988 -3.913 25342 6753 1 9 . 1 1 12 12 SER CA C 12 53.619 53.619 57.513 -3.894 25342 6754 1 9 . 1 1 12 12 SER CB C 12 62.847 62.847 62.882 -0.035 25342 6755 1 9 . 1 1 12 12 SER H H 12 7.557 7.557 8.436 -0.879 25342 6756 1 9 . 1 1 13 13 TRP N N 13 135.232 135.232 129.051 6.181 25342 6757 1 9 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.445 1.191 25342 6758 1 9 . 1 1 13 13 TRP C C 13 175.708 175.708 175.412 0.296 25342 6759 1 9 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.134 -2.018 25342 6760 1 9 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.238 -1.603 25342 6761 1 9 . 1 1 13 13 TRP H H 13 9.755 9.755 7.572 2.183 25342 6762 1 9 . 1 1 14 14 SER N N 14 113.789 113.789 109.104 4.685 25342 6763 1 9 . 1 1 14 14 SER HA H 14 4.223 4.223 4.316 -0.093 25342 6764 1 9 . 1 1 14 14 SER C C 14 172.747 172.747 174.112 -1.365 25342 6765 1 9 . 1 1 14 14 SER CA C 14 53.828 53.828 58.000 -4.172 25342 6766 1 9 . 1 1 14 14 SER CB C 14 60.037 60.037 63.548 -3.511 25342 6767 1 9 . 1 1 14 14 SER H H 14 10.026 10.026 8.168 1.859 25342 6768 1 9 . 1 1 15 15 GLY N N 15 110.489 110.489 108.466 2.023 25342 6769 1 9 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.621 -0.962 25342 6770 1 9 . 1 1 15 15 GLY H H 15 7.391 7.391 8.326 -0.935 25342 6771 1 9 . 1 1 16 16 GLU N N 16 129.005 129.005 120.803 8.202 25342 6772 1 9 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.197 -0.134 25342 6773 1 9 . 1 1 16 16 GLU CA C 16 56.761 56.761 58.978 -2.217 25342 6774 1 9 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.688 -3.276 25342 6775 1 9 . 1 1 16 16 GLU H H 16 11.550 11.550 8.566 2.984 25342 6776 1 9 . 1 1 17 17 THR N N 17 123.016 123.016 114.409 8.607 25342 6777 1 9 . 1 1 17 17 THR HA H 17 4.035 4.035 4.061 -0.026 25342 6778 1 9 . 1 1 17 17 THR C C 17 173.360 173.360 176.187 -2.827 25342 6779 1 9 . 1 1 17 17 THR CA C 17 64.303 64.303 65.688 -1.385 25342 6780 1 9 . 1 1 17 17 THR CB C 17 63.999 63.999 68.378 -4.379 25342 6781 1 9 . 1 1 17 17 THR H H 17 11.293 11.293 8.562 2.731 25342 6782 1 9 . 1 1 18 18 LYS N N 18 120.156 120.156 121.094 -0.938 25342 6783 1 9 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.310 -1.454 25342 6784 1 9 . 1 1 18 18 LYS C C 18 173.901 173.901 178.181 -4.280 25342 6785 1 9 . 1 1 18 18 LYS CA C 18 56.834 56.834 58.658 -1.824 25342 6786 1 9 . 1 1 18 18 LYS CB C 18 29.481 29.481 31.778 -2.297 25342 6787 1 9 . 1 1 18 18 LYS H H 18 6.940 6.940 8.254 -1.314 25342 6788 1 9 . 1 1 19 19 LYS N N 19 117.237 117.237 119.687 -2.450 25342 6789 1 9 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.085 -0.162 25342 6790 1 9 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.021 -2.697 25342 6791 1 9 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.236 -2.875 25342 6792 1 9 . 1 1 19 19 LYS H H 19 7.212 7.212 7.938 -0.726 25342 6793 1 9 . 1 1 20 20 MET N N 20 119.268 119.268 117.880 1.388 25342 6794 1 9 . 1 1 20 20 MET HA H 20 4.413 4.413 4.350 0.063 25342 6795 1 9 . 1 1 20 20 MET C C 20 173.625 173.625 174.592 -0.967 25342 6796 1 9 . 1 1 20 20 MET CA C 20 52.261 52.261 54.298 -2.037 25342 6797 1 9 . 1 1 20 20 MET CB C 20 26.680 26.680 30.357 -3.677 25342 6798 1 9 . 1 1 20 20 MET H H 20 7.600 7.600 8.112 -0.512 25342 6799 1 9 . 1 1 21 21 ALA N N 21 123.669 123.669 122.572 1.097 25342 6800 1 9 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.368 -0.886 25342 6801 1 9 . 1 1 21 21 ALA C C 21 176.628 176.628 178.481 -1.853 25342 6802 1 9 . 1 1 21 21 ALA CA C 21 52.374 52.374 53.002 -0.628 25342 6803 1 9 . 1 1 21 21 ALA CB C 21 16.495 16.495 19.583 -3.088 25342 6804 1 9 . 1 1 21 21 ALA H H 21 8.738 8.738 8.141 0.597 25342 6805 1 9 . 1 1 22 22 GLU N N 22 117.242 117.242 120.616 -3.374 25342 6806 1 9 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.761 -0.088 25342 6807 1 9 . 1 1 22 22 GLU C C 22 176.698 176.698 178.745 -2.047 25342 6808 1 9 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.389 -2.849 25342 6809 1 9 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.569 -3.135 25342 6810 1 9 . 1 1 22 22 GLU H H 22 7.959 7.959 7.815 0.144 25342 6811 1 9 . 1 1 23 23 LYS N N 23 123.302 123.302 119.619 3.683 25342 6812 1 9 . 1 1 23 23 LYS HA H 23 3.821 3.821 3.950 -0.129 25342 6813 1 9 . 1 1 23 23 LYS C C 23 177.389 177.389 178.872 -1.483 25342 6814 1 9 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.809 -2.887 25342 6815 1 9 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.232 -2.718 25342 6816 1 9 . 1 1 23 23 LYS H H 23 7.703 7.703 7.583 0.120 25342 6817 1 9 . 1 1 24 24 ILE N N 24 122.208 122.208 117.266 4.942 25342 6818 1 9 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.678 -0.395 25342 6819 1 9 . 1 1 24 24 ILE C C 24 174.934 174.934 177.403 -2.469 25342 6820 1 9 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.223 -0.931 25342 6821 1 9 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.641 -2.903 25342 6822 1 9 . 1 1 24 24 ILE H H 24 8.535 8.535 7.893 0.642 25342 6823 1 9 . 1 1 25 25 ASN N N 25 118.640 118.640 116.102 2.538 25342 6824 1 9 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.468 -0.241 25342 6825 1 9 . 1 1 25 25 ASN C C 25 173.530 173.530 175.986 -2.456 25342 6826 1 9 . 1 1 25 25 ASN CA C 25 52.211 52.211 54.869 -2.658 25342 6827 1 9 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.611 -0.507 25342 6828 1 9 . 1 1 25 25 ASN H H 25 8.317 8.317 8.189 0.128 25342 6829 1 9 . 1 1 26 26 SER N N 26 111.990 111.990 115.571 -3.581 25342 6830 1 9 . 1 1 26 26 SER HA H 26 4.153 4.153 4.504 -0.351 25342 6831 1 9 . 1 1 26 26 SER C C 26 172.110 172.110 175.062 -2.952 25342 6832 1 9 . 1 1 26 26 SER CA C 26 57.905 57.905 59.876 -1.971 25342 6833 1 9 . 1 1 26 26 SER CB C 26 60.655 60.655 64.506 -3.851 25342 6834 1 9 . 1 1 26 26 SER H H 26 7.369 7.369 7.786 -0.417 25342 6835 1 9 . 1 1 27 27 GLU N N 27 120.201 120.201 119.953 0.248 25342 6836 1 9 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.280 -0.179 25342 6837 1 9 . 1 1 27 27 GLU C C 27 173.673 173.673 177.728 -4.055 25342 6838 1 9 . 1 1 27 27 GLU CA C 27 54.235 54.235 57.281 -3.046 25342 6839 1 9 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.101 -3.500 25342 6840 1 9 . 1 1 27 27 GLU H H 27 7.451 7.451 7.983 -0.532 25342 6841 1 9 . 1 1 28 28 ILE N N 28 118.762 118.762 120.515 -1.753 25342 6842 1 9 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.071 0.128 25342 6843 1 9 . 1 1 28 28 ILE C C 28 172.487 172.487 177.136 -4.649 25342 6844 1 9 . 1 1 28 28 ILE CA C 28 57.732 57.732 61.193 -3.461 25342 6845 1 9 . 1 1 28 28 ILE CB C 28 35.738 35.738 38.551 -2.813 25342 6846 1 9 . 1 1 28 28 ILE H H 28 7.255 7.255 7.804 -0.549 25342 6847 1 9 . 1 1 29 29 LYS N N 29 130.563 130.563 122.483 8.080 25342 6848 1 9 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.118 -0.116 25342 6849 1 9 . 1 1 29 29 LYS C C 29 174.386 174.386 177.189 -2.803 25342 6850 1 9 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.517 -0.981 25342 6851 1 9 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.927 -3.341 25342 6852 1 9 . 1 1 29 29 LYS H H 29 8.564 8.564 8.797 -0.233 25342 6853 1 9 . 1 1 30 30 ASP N N 30 119.357 119.357 120.276 -0.919 25342 6854 1 9 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.583 -0.181 25342 6855 1 9 . 1 1 30 30 ASP C C 30 172.570 172.570 175.568 -2.998 25342 6856 1 9 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.526 -1.090 25342 6857 1 9 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.394 -2.650 25342 6858 1 9 . 1 1 30 30 ASP H H 30 8.920 8.920 8.685 0.235 25342 6859 1 9 . 1 1 31 31 SER N N 31 114.019 114.019 116.380 -2.361 25342 6860 1 9 . 1 1 31 31 SER HA H 31 4.782 4.782 4.629 0.153 25342 6861 1 9 . 1 1 31 31 SER C C 31 171.150 171.150 174.032 -2.882 25342 6862 1 9 . 1 1 31 31 SER CA C 31 55.551 55.551 57.703 -2.152 25342 6863 1 9 . 1 1 31 31 SER CB C 31 62.259 62.259 65.372 -3.113 25342 6864 1 9 . 1 1 31 31 SER H H 31 8.006 8.006 8.165 -0.159 25342 6865 1 9 . 1 1 32 32 GLU N N 32 121.455 121.455 118.892 2.563 25342 6866 1 9 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.644 0.096 25342 6867 1 9 . 1 1 32 32 GLU C C 32 171.185 171.185 174.183 -2.998 25342 6868 1 9 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.099 -3.018 25342 6869 1 9 . 1 1 32 32 GLU CB C 32 30.827 30.827 33.338 -2.511 25342 6870 1 9 . 1 1 32 32 GLU H H 32 8.145 8.145 8.771 -0.626 25342 6871 1 9 . 1 1 33 33 LEU N N 33 126.176 126.176 124.118 2.058 25342 6872 1 9 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.842 0.464 25342 6873 1 9 . 1 1 33 33 LEU C C 33 173.365 173.365 175.405 -2.040 25342 6874 1 9 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.319 -2.879 25342 6875 1 9 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.667 -0.032 25342 6876 1 9 . 1 1 33 33 LEU H H 33 8.589 8.589 8.547 0.042 25342 6877 1 9 . 1 1 34 34 LYS N N 34 127.200 127.200 125.685 1.515 25342 6878 1 9 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.669 -0.073 25342 6879 1 9 . 1 1 34 34 LYS C C 34 169.622 169.622 175.156 -5.534 25342 6880 1 9 . 1 1 34 34 LYS CA C 34 52.329 52.329 55.476 -3.147 25342 6881 1 9 . 1 1 34 34 LYS CB C 34 34.200 34.200 34.404 -0.203 25342 6882 1 9 . 1 1 34 34 LYS H H 34 9.380 9.380 8.962 0.418 25342 6883 1 9 . 1 1 35 35 GLU N N 35 122.324 122.324 119.712 2.612 25342 6884 1 9 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.325 -1.992 25342 6885 1 9 . 1 1 35 35 GLU C C 35 172.734 172.734 175.435 -2.701 25342 6886 1 9 . 1 1 35 35 GLU CA C 35 52.612 52.612 55.050 -2.438 25342 6887 1 9 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.858 -3.539 25342 6888 1 9 . 1 1 35 35 GLU H H 35 8.094 8.094 8.405 -0.311 25342 6889 1 9 . 1 1 36 36 VAL N N 36 126.781 126.781 116.838 9.943 25342 6890 1 9 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.449 -0.610 25342 6891 1 9 . 1 1 36 36 VAL C C 36 171.482 171.482 174.451 -2.969 25342 6892 1 9 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.693 -1.288 25342 6893 1 9 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.908 -6.560 25342 6894 1 9 . 1 1 36 36 VAL H H 36 8.660 8.660 8.663 -0.003 25342 6895 1 9 . 1 1 37 37 LYS N N 37 126.065 126.065 122.236 3.829 25342 6896 1 9 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.489 0.476 25342 6897 1 9 . 1 1 37 37 LYS C C 37 173.187 173.187 173.881 -0.694 25342 6898 1 9 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.946 -2.666 25342 6899 1 9 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.992 -3.071 25342 6900 1 9 . 1 1 37 37 LYS H H 37 7.809 7.809 8.152 -0.343 25342 6901 1 9 . 1 1 38 38 VAL N N 38 111.020 111.020 114.492 -3.472 25342 6902 1 9 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.782 0.042 25342 6903 1 9 . 1 1 38 38 VAL C C 38 173.604 173.604 176.127 -2.523 25342 6904 1 9 . 1 1 38 38 VAL CA C 38 56.383 56.383 60.309 -3.926 25342 6905 1 9 . 1 1 38 38 VAL CB C 38 32.376 32.376 33.218 -0.842 25342 6906 1 9 . 1 1 38 38 VAL H H 38 8.305 8.305 7.971 0.334 25342 6907 1 9 . 1 1 39 39 SER N N 39 117.887 117.887 116.443 1.444 25342 6908 1 9 . 1 1 39 39 SER HA H 39 4.183 4.183 4.397 -0.214 25342 6909 1 9 . 1 1 39 39 SER C C 39 173.538 173.538 174.782 -1.244 25342 6910 1 9 . 1 1 39 39 SER CA C 39 56.279 56.279 58.827 -2.548 25342 6911 1 9 . 1 1 39 39 SER CB C 39 60.537 60.537 63.975 -3.438 25342 6912 1 9 . 1 1 39 39 SER H H 39 8.847 8.847 8.401 0.446 25342 6913 1 9 . 1 1 40 40 GLU N N 40 126.316 126.316 120.853 5.463 25342 6914 1 9 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.198 -0.044 25342 6915 1 9 . 1 1 40 40 GLU C C 40 174.586 174.586 177.829 -3.243 25342 6916 1 9 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.382 -1.570 25342 6917 1 9 . 1 1 40 40 GLU CB C 40 26.720 26.720 30.149 -3.429 25342 6918 1 9 . 1 1 40 40 GLU H H 40 9.049 9.049 8.609 0.440 25342 6919 1 9 . 1 1 41 41 GLY N N 41 112.494 112.494 109.859 2.635 25342 6920 1 9 . 1 1 41 41 GLY C C 41 171.994 171.994 175.231 -3.237 25342 6921 1 9 . 1 1 41 41 GLY CA C 41 42.462 42.462 46.458 -3.996 25342 6922 1 9 . 1 1 41 41 GLY H H 41 8.780 8.780 8.857 -0.077 25342 6923 1 9 . 1 1 42 42 THR N N 42 118.631 118.631 114.282 4.349 25342 6924 1 9 . 1 1 42 42 THR HA H 42 3.582 3.582 3.945 -0.363 25342 6925 1 9 . 1 1 42 42 THR C C 42 171.225 171.225 173.648 -2.423 25342 6926 1 9 . 1 1 42 42 THR CA C 42 64.104 64.104 64.337 -0.233 25342 6927 1 9 . 1 1 42 42 THR CB C 42 65.914 65.914 69.035 -3.121 25342 6928 1 9 . 1 1 42 42 THR H H 42 7.737 7.737 8.135 -0.398 25342 6929 1 9 . 1 1 43 43 PHE N N 43 116.279 116.279 117.290 -1.011 25342 6930 1 9 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.850 0.170 25342 6931 1 9 . 1 1 43 43 PHE C C 43 170.141 170.141 173.964 -3.823 25342 6932 1 9 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.906 -4.434 25342 6933 1 9 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.279 -3.894 25342 6934 1 9 . 1 1 43 43 PHE H H 43 8.114 8.114 7.541 0.573 25342 6935 1 9 . 1 1 44 44 ASP N N 44 121.513 121.513 118.994 2.519 25342 6936 1 9 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.961 -0.110 25342 6937 1 9 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.538 -3.326 25342 6938 1 9 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.220 0.165 25342 6939 1 9 . 1 1 44 44 ASP H H 44 7.774 7.774 8.724 -0.950 25342 6940 1 9 . 1 1 45 45 ALA N N 45 125.663 125.663 120.208 5.455 25342 6941 1 9 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.877 -0.666 25342 6942 1 9 . 1 1 45 45 ALA C C 45 175.139 175.139 176.852 -1.713 25342 6943 1 9 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.077 -0.641 25342 6944 1 9 . 1 1 45 45 ALA CB C 45 16.232 16.232 20.535 -4.303 25342 6945 1 9 . 1 1 45 45 ALA H H 45 8.324 8.324 8.488 -0.164 25342 6946 1 9 . 1 1 46 46 ASP N N 46 119.288 119.288 120.071 -0.783 25342 6947 1 9 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.548 0.277 25342 6948 1 9 . 1 1 46 46 ASP C C 46 175.013 175.013 177.185 -2.172 25342 6949 1 9 . 1 1 46 46 ASP CA C 46 51.161 51.161 54.669 -3.508 25342 6950 1 9 . 1 1 46 46 ASP CB C 46 41.233 41.233 41.521 -0.288 25342 6951 1 9 . 1 1 46 46 ASP H H 46 9.618 9.618 7.837 1.781 25342 6952 1 9 . 1 1 47 47 MET N N 47 127.347 127.347 122.604 4.743 25342 6953 1 9 . 1 1 47 47 MET HA H 47 3.456 3.456 4.075 -0.619 25342 6954 1 9 . 1 1 47 47 MET C C 47 173.605 173.605 177.174 -3.569 25342 6955 1 9 . 1 1 47 47 MET CA C 47 56.699 56.699 59.599 -2.900 25342 6956 1 9 . 1 1 47 47 MET CB C 47 29.930 29.930 32.944 -3.014 25342 6957 1 9 . 1 1 47 47 MET H H 47 9.178 9.178 8.288 0.890 25342 6958 1 9 . 1 1 48 48 TYR N N 48 121.040 121.040 115.007 6.033 25342 6959 1 9 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.236 -0.364 25342 6960 1 9 . 1 1 48 48 TYR CA C 48 58.712 58.712 60.076 -1.364 25342 6961 1 9 . 1 1 48 48 TYR CB C 48 33.638 33.638 36.748 -3.110 25342 6962 1 9 . 1 1 48 48 TYR H H 48 7.881 7.881 8.189 -0.308 25342 6963 1 9 . 1 1 49 49 LYS N N 49 121.754 121.754 120.253 1.501 25342 6964 1 9 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.064 0.041 25342 6965 1 9 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.143 -2.758 25342 6966 1 9 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.040 -2.876 25342 6967 1 9 . 1 1 49 49 LYS H H 49 8.365 8.365 7.444 0.921 25342 6968 1 9 . 1 1 50 50 THR N N 50 117.557 117.557 111.910 5.647 25342 6969 1 9 . 1 1 50 50 THR HA H 50 3.586 3.586 4.211 -0.625 25342 6970 1 9 . 1 1 50 50 THR CA C 50 65.634 65.634 65.455 0.179 25342 6971 1 9 . 1 1 50 50 THR CB C 50 65.904 65.904 67.759 -1.855 25342 6972 1 9 . 1 1 50 50 THR H H 50 8.007 8.007 7.998 0.009 25342 6973 1 9 . 1 1 51 51 SER N N 51 115.110 115.110 116.948 -1.838 25342 6974 1 9 . 1 1 51 51 SER HA H 51 3.974 3.974 4.265 -0.291 25342 6975 1 9 . 1 1 51 51 SER CA C 51 59.042 59.042 61.226 -2.184 25342 6976 1 9 . 1 1 51 51 SER CB C 51 59.835 59.835 62.854 -3.019 25342 6977 1 9 . 1 1 51 51 SER H H 51 7.606 7.606 8.463 -0.857 25342 6978 1 9 . 1 1 52 52 ASP N N 52 119.713 119.713 121.017 -1.304 25342 6979 1 9 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.695 -0.387 25342 6980 1 9 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.123 -1.597 25342 6981 1 9 . 1 1 52 52 ASP CB C 52 37.688 37.688 42.266 -4.578 25342 6982 1 9 . 1 1 52 52 ASP H H 52 7.552 7.552 7.483 0.069 25342 6983 1 9 . 1 1 53 53 ILE N N 53 121.982 121.982 120.802 1.180 25342 6984 1 9 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.665 0.057 25342 6985 1 9 . 1 1 53 53 ILE C C 53 175.325 175.325 178.094 -2.769 25342 6986 1 9 . 1 1 53 53 ILE CA C 53 62.544 62.544 66.073 -3.529 25342 6987 1 9 . 1 1 53 53 ILE CB C 53 36.699 36.699 38.278 -1.579 25342 6988 1 9 . 1 1 53 53 ILE H H 53 7.815 7.815 8.133 -0.318 25342 6989 1 9 . 1 1 54 54 ALA N N 54 121.552 121.552 121.399 0.153 25342 6990 1 9 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.213 0.104 25342 6991 1 9 . 1 1 54 54 ALA C C 54 177.475 177.475 179.302 -1.827 25342 6992 1 9 . 1 1 54 54 ALA CA C 54 52.022 52.022 55.236 -3.214 25342 6993 1 9 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.532 -2.548 25342 6994 1 9 . 1 1 54 54 ALA H H 54 8.332 8.332 7.577 0.755 25342 6995 1 9 . 1 1 55 55 LEU N N 55 117.176 117.176 119.753 -2.577 25342 6996 1 9 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.820 0.114 25342 6997 1 9 . 1 1 55 55 LEU C C 55 176.532 176.532 178.481 -1.949 25342 6998 1 9 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.913 -2.583 25342 6999 1 9 . 1 1 55 55 LEU CB C 55 38.428 38.428 40.964 -2.536 25342 7000 1 9 . 1 1 55 55 LEU H H 55 8.195 8.195 8.038 0.157 25342 7001 1 9 . 1 1 56 56 ASP N N 56 120.056 120.056 118.618 1.438 25342 7002 1 9 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.305 0.162 25342 7003 1 9 . 1 1 56 56 ASP C C 56 176.585 176.585 178.768 -2.183 25342 7004 1 9 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.755 -3.205 25342 7005 1 9 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.564 -2.259 25342 7006 1 9 . 1 1 56 56 ASP H H 56 7.806 7.806 8.113 -0.307 25342 7007 1 9 . 1 1 57 57 GLN N N 57 120.020 120.020 118.378 1.642 25342 7008 1 9 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.134 -0.011 25342 7009 1 9 . 1 1 57 57 GLN C C 57 175.689 175.689 178.908 -3.219 25342 7010 1 9 . 1 1 57 57 GLN CA C 57 54.405 54.405 58.634 -4.229 25342 7011 1 9 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.809 -5.040 25342 7012 1 9 . 1 1 57 57 GLN H H 57 7.661 7.661 7.532 0.129 25342 7013 1 9 . 1 1 58 58 ILE N N 58 120.644 120.644 121.866 -1.222 25342 7014 1 9 . 1 1 58 58 ILE HA H 58 3.576 3.576 3.042 0.534 25342 7015 1 9 . 1 1 58 58 ILE C C 58 176.237 176.237 177.796 -1.559 25342 7016 1 9 . 1 1 58 58 ILE CA C 58 62.506 62.506 64.444 -1.938 25342 7017 1 9 . 1 1 58 58 ILE CB C 58 36.029 36.029 37.648 -1.619 25342 7018 1 9 . 1 1 58 58 ILE H H 58 8.228 8.228 8.452 -0.224 25342 7019 1 9 . 1 1 59 59 GLN N N 59 115.498 115.498 116.574 -1.076 25342 7020 1 9 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.093 0.049 25342 7021 1 9 . 1 1 59 59 GLN C C 59 173.781 173.781 176.999 -3.218 25342 7022 1 9 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.895 -2.913 25342 7023 1 9 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.154 -2.543 25342 7024 1 9 . 1 1 59 59 GLN H H 59 8.331 8.331 8.113 0.218 25342 7025 1 9 . 1 1 60 60 GLY N N 60 106.623 106.623 106.519 0.104 25342 7026 1 9 . 1 1 60 60 GLY C C 60 172.068 172.068 175.162 -3.094 25342 7027 1 9 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.621 -2.748 25342 7028 1 9 . 1 1 60 60 GLY H H 60 7.611 7.611 7.796 -0.185 25342 7029 1 9 . 1 1 61 61 ASN N N 61 117.691 117.691 117.704 -0.013 25342 7030 1 9 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.674 -0.130 25342 7031 1 9 . 1 1 61 61 ASN C C 61 171.946 171.946 175.808 -3.862 25342 7032 1 9 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.123 -2.554 25342 7033 1 9 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.960 -2.600 25342 7034 1 9 . 1 1 61 61 ASN H H 61 8.151 8.151 8.083 0.068 25342 7035 1 9 . 1 1 62 62 LYS N N 62 118.289 118.289 119.150 -0.861 25342 7036 1 9 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.727 -0.399 25342 7037 1 9 . 1 1 62 62 LYS C C 62 171.773 171.773 175.383 -3.610 25342 7038 1 9 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.304 -3.008 25342 7039 1 9 . 1 1 62 62 LYS CB C 62 34.683 34.683 34.678 0.005 25342 7040 1 9 . 1 1 62 62 LYS H H 62 7.242 7.242 7.736 -0.494 25342 7041 1 9 . 1 1 63 63 ASP N N 63 119.888 119.888 118.941 0.947 25342 7042 1 9 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.342 0.074 25342 7043 1 9 . 1 1 63 63 ASP C C 63 174.476 174.476 175.231 -0.755 25342 7044 1 9 . 1 1 63 63 ASP CA C 63 51.461 51.461 54.392 -2.930 25342 7045 1 9 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.825 -3.310 25342 7046 1 9 . 1 1 63 63 ASP H H 63 8.230 8.230 8.413 -0.183 25342 7047 1 9 . 1 1 64 64 PHE N N 64 119.789 119.789 113.798 5.991 25342 7048 1 9 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.981 -1.165 25342 7049 1 9 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.404 1.846 25342 7050 1 9 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.376 -3.342 25342 7051 1 9 . 1 1 64 64 PHE H H 64 8.428 8.428 7.662 0.766 25342 7052 1 9 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.690 -0.377 25342 7053 1 9 . 1 1 65 65 PRO C C 65 173.975 173.975 175.523 -1.548 25342 7054 1 9 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.482 -2.426 25342 7055 1 9 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.674 -3.154 25342 7056 1 9 . 1 1 66 66 GLU N N 66 121.326 121.326 117.966 3.360 25342 7057 1 9 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.621 -0.388 25342 7058 1 9 . 1 1 66 66 GLU C C 66 173.978 173.978 174.836 -0.858 25342 7059 1 9 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.026 -1.495 25342 7060 1 9 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.663 -3.963 25342 7061 1 9 . 1 1 66 66 GLU H H 66 8.225 8.225 8.520 -0.295 25342 7062 1 9 . 1 1 67 67 ILE N N 67 113.897 113.897 116.290 -2.393 25342 7063 1 9 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.778 0.391 25342 7064 1 9 . 1 1 67 67 ILE C C 67 172.791 172.791 175.342 -2.551 25342 7065 1 9 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.822 -2.547 25342 7066 1 9 . 1 1 67 67 ILE CB C 67 39.016 39.016 42.084 -3.068 25342 7067 1 9 . 1 1 67 67 ILE H H 67 8.366 8.366 8.125 0.241 25342 7068 1 9 . 1 1 68 68 GLN N N 68 121.654 121.654 122.983 -1.329 25342 7069 1 9 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.675 -0.156 25342 7070 1 9 . 1 1 68 68 GLN C C 68 171.562 171.562 174.026 -2.464 25342 7071 1 9 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.662 -2.349 25342 7072 1 9 . 1 1 68 68 GLN CB C 68 26.785 26.785 27.370 -0.585 25342 7073 1 9 . 1 1 68 68 GLN H H 68 8.763 8.763 8.679 0.084 25342 7074 1 9 . 1 1 69 69 LEU N N 69 125.289 125.289 121.449 3.840 25342 7075 1 9 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.696 -0.177 25342 7076 1 9 . 1 1 69 69 LEU C C 69 172.567 172.567 175.608 -3.041 25342 7077 1 9 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.667 -2.870 25342 7078 1 9 . 1 1 69 69 LEU CB C 69 42.742 42.742 44.038 -1.296 25342 7079 1 9 . 1 1 69 69 LEU H H 69 7.996 7.996 7.401 0.595 25342 7080 1 9 . 1 1 70 70 ASP N N 70 123.170 123.170 123.276 -0.106 25342 7081 1 9 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.759 -0.353 25342 7082 1 9 . 1 1 70 70 ASP C C 70 171.978 171.978 175.578 -3.600 25342 7083 1 9 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.678 -1.996 25342 7084 1 9 . 1 1 70 70 ASP CB C 70 38.729 38.729 42.995 -4.266 25342 7085 1 9 . 1 1 70 70 ASP H H 70 8.278 8.278 8.371 -0.093 25342 7086 1 9 . 1 1 71 71 ASN N N 71 117.524 117.524 118.533 -1.009 25342 7087 1 9 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.798 -0.471 25342 7088 1 9 . 1 1 71 71 ASN C C 71 171.825 171.825 174.434 -2.609 25342 7089 1 9 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.125 -1.468 25342 7090 1 9 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.910 -3.679 25342 7091 1 9 . 1 1 71 71 ASN H H 71 8.372 8.372 8.425 -0.053 25342 7092 1 9 . 1 1 72 72 ILE N N 72 124.515 124.515 122.818 1.697 25342 7093 1 9 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.156 -0.227 25342 7094 1 9 . 1 1 72 72 ILE C C 72 171.607 171.607 173.914 -2.307 25342 7095 1 9 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.114 -2.825 25342 7096 1 9 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.924 -3.164 25342 7097 1 9 . 1 1 72 72 ILE H H 72 7.653 7.653 8.131 -0.478 25342 7098 1 9 . 1 1 73 73 ASP N N 73 125.182 125.182 126.536 -1.354 25342 7099 1 9 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.566 0.062 25342 7100 1 9 . 1 1 73 73 ASP C C 73 173.980 173.980 176.049 -2.069 25342 7101 1 9 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.368 -5.154 25342 7102 1 9 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.255 -4.353 25342 7103 1 9 . 1 1 73 73 ASP H H 73 8.382 8.382 8.521 -0.139 25342 7104 1 9 . 1 1 74 74 TYR N N 74 123.092 123.092 122.411 0.681 25342 7105 1 9 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.686 -0.821 25342 7106 1 9 . 1 1 74 74 TYR C C 74 173.582 173.582 176.844 -3.262 25342 7107 1 9 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.980 1.506 25342 7108 1 9 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.284 -3.476 25342 7109 1 9 . 1 1 74 74 TYR H H 74 7.348 7.348 8.251 -0.903 25342 7110 1 9 . 1 1 75 75 ASN N N 75 109.447 109.447 117.736 -8.289 25342 7111 1 9 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.723 0.202 25342 7112 1 9 . 1 1 75 75 ASN C C 75 172.570 172.570 175.455 -2.885 25342 7113 1 9 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.675 -2.057 25342 7114 1 9 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.190 -2.656 25342 7115 1 9 . 1 1 75 75 ASN H H 75 8.040 8.040 8.638 -0.598 25342 7116 1 9 . 1 1 76 76 ASN N N 76 117.411 117.411 116.891 0.520 25342 7117 1 9 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.746 -0.292 25342 7118 1 9 . 1 1 76 76 ASN C C 76 171.155 171.155 174.133 -2.978 25342 7119 1 9 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.613 -2.679 25342 7120 1 9 . 1 1 76 76 ASN CB C 76 35.658 35.658 39.694 -4.036 25342 7121 1 9 . 1 1 76 76 ASN H H 76 7.750 7.750 8.385 -0.635 25342 7122 1 9 . 1 1 77 77 TYR N N 77 116.878 116.878 119.803 -2.925 25342 7123 1 9 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.742 -0.388 25342 7124 1 9 . 1 1 77 77 TYR C C 77 172.224 172.224 175.007 -2.783 25342 7125 1 9 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.551 -2.311 25342 7126 1 9 . 1 1 77 77 TYR CB C 77 37.113 37.113 40.114 -3.001 25342 7127 1 9 . 1 1 77 77 TYR H H 77 7.789 7.789 7.738 0.051 25342 7128 1 9 . 1 1 78 78 ASP N N 78 121.352 121.352 125.515 -4.163 25342 7129 1 9 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.568 0.229 25342 7130 1 9 . 1 1 78 78 ASP C C 78 172.623 172.623 175.310 -2.687 25342 7131 1 9 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.798 -3.608 25342 7132 1 9 . 1 1 78 78 ASP CB C 78 41.035 41.035 41.552 -0.517 25342 7133 1 9 . 1 1 78 78 ASP H H 78 9.036 9.036 9.056 -0.020 25342 7134 1 9 . 1 1 79 79 LEU N N 79 123.073 123.073 116.203 6.870 25342 7135 1 9 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.401 -0.293 25342 7136 1 9 . 1 1 79 79 LEU C C 79 170.730 170.730 174.682 -3.952 25342 7137 1 9 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.775 -2.518 25342 7138 1 9 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.223 -3.939 25342 7139 1 9 . 1 1 79 79 LEU H H 79 7.877 7.877 7.438 0.439 25342 7140 1 9 . 1 1 80 80 ILE N N 80 126.348 126.348 121.281 5.067 25342 7141 1 9 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.921 0.148 25342 7142 1 9 . 1 1 80 80 ILE C C 80 171.584 171.584 174.086 -2.502 25342 7143 1 9 . 1 1 80 80 ILE CA C 80 57.415 57.415 59.820 -2.405 25342 7144 1 9 . 1 1 80 80 ILE CB C 80 37.998 37.998 41.554 -3.556 25342 7145 1 9 . 1 1 80 80 ILE H H 80 8.704 8.704 8.273 0.431 25342 7146 1 9 . 1 1 81 81 LEU N N 81 126.303 126.303 125.848 0.455 25342 7147 1 9 . 1 1 81 81 LEU HA H 81 5.123 5.123 5.087 0.036 25342 7148 1 9 . 1 1 81 81 LEU C C 81 172.779 172.779 175.358 -2.579 25342 7149 1 9 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.745 -4.236 25342 7150 1 9 . 1 1 81 81 LEU CB C 81 41.715 41.715 46.063 -4.348 25342 7151 1 9 . 1 1 81 81 LEU H H 81 9.202 9.202 8.826 0.376 25342 7152 1 9 . 1 1 82 82 ILE N N 82 120.931 120.931 121.344 -0.413 25342 7153 1 9 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.122 -0.275 25342 7154 1 9 . 1 1 82 82 ILE C C 82 172.796 172.796 175.416 -2.620 25342 7155 1 9 . 1 1 82 82 ILE CA C 82 56.881 56.881 60.142 -3.261 25342 7156 1 9 . 1 1 82 82 ILE CB C 82 37.797 37.797 41.443 -3.646 25342 7157 1 9 . 1 1 82 82 ILE H H 82 8.846 8.846 8.060 0.786 25342 7158 1 9 . 1 1 83 83 GLY N N 83 120.905 120.905 114.346 6.559 25342 7159 1 9 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.648 -3.091 25342 7160 1 9 . 1 1 83 83 GLY H H 83 9.558 9.558 9.184 0.374 25342 7161 1 9 . 1 1 84 84 SER N N 84 116.601 116.601 115.300 1.301 25342 7162 1 9 . 1 1 84 84 SER HA H 84 5.476 5.476 4.820 0.656 25342 7163 1 9 . 1 1 84 84 SER CA C 84 51.324 51.324 55.953 -4.629 25342 7164 1 9 . 1 1 84 84 SER CB C 84 64.271 64.271 64.384 -0.113 25342 7165 1 9 . 1 1 84 84 SER H H 84 7.533 7.533 7.518 0.015 25342 7166 1 9 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.378 0.785 25342 7167 1 9 . 1 1 85 85 PRO C C 85 175.590 175.590 176.911 -1.321 25342 7168 1 9 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.241 -3.358 25342 7169 1 9 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.058 -1.584 25342 7170 1 9 . 1 1 86 86 VAL N N 86 116.295 116.295 116.762 -0.467 25342 7171 1 9 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.151 -0.330 25342 7172 1 9 . 1 1 86 86 VAL C C 86 172.692 172.692 174.663 -1.971 25342 7173 1 9 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.014 -1.202 25342 7174 1 9 . 1 1 86 86 VAL CB C 86 30.083 30.083 33.091 -3.008 25342 7175 1 9 . 1 1 86 86 VAL H H 86 7.246 7.246 7.824 -0.578 25342 7176 1 9 . 1 1 87 87 TRP N N 87 131.042 131.042 120.802 10.240 25342 7177 1 9 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.689 -0.378 25342 7178 1 9 . 1 1 87 87 TRP C C 87 173.323 173.323 175.889 -2.566 25342 7179 1 9 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.391 -4.504 25342 7180 1 9 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.323 -4.013 25342 7181 1 9 . 1 1 87 87 TRP H H 87 9.555 9.555 7.727 1.828 25342 7182 1 9 . 1 1 88 88 SER N N 88 122.660 122.660 115.119 7.541 25342 7183 1 9 . 1 1 88 88 SER HA H 88 4.582 4.582 4.094 0.488 25342 7184 1 9 . 1 1 88 88 SER C C 88 172.096 172.096 174.740 -2.644 25342 7185 1 9 . 1 1 88 88 SER CA C 88 55.391 55.391 59.801 -4.410 25342 7186 1 9 . 1 1 88 88 SER CB C 88 57.813 57.813 63.285 -5.471 25342 7187 1 9 . 1 1 88 88 SER H H 88 10.257 10.257 8.342 1.915 25342 7188 1 9 . 1 1 89 89 GLY N N 89 128.381 128.381 104.763 23.618 25342 7189 1 9 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.044 -2.415 25342 7190 1 9 . 1 1 89 89 GLY H H 89 6.372 6.372 7.561 -1.189 25342 7191 1 9 . 1 1 90 90 TYR N N 90 120.345 120.345 115.557 4.788 25342 7192 1 9 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.970 -0.781 25342 7193 1 9 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.786 -0.237 25342 7194 1 9 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.216 -1.021 25342 7195 1 9 . 1 1 90 90 TYR H H 90 8.113 8.113 6.940 1.173 25342 7196 1 9 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.600 0.234 25342 7197 1 9 . 1 1 91 91 PRO C C 91 170.911 170.911 177.279 -6.368 25342 7198 1 9 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.596 -3.761 25342 7199 1 9 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.828 -6.758 25342 7200 1 9 . 1 1 92 92 ALA N N 92 120.629 120.629 124.612 -3.983 25342 7201 1 9 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.928 -0.309 25342 7202 1 9 . 1 1 92 92 ALA C C 92 176.782 176.782 176.247 0.535 25342 7203 1 9 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.524 -1.107 25342 7204 1 9 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.511 -0.995 25342 7205 1 9 . 1 1 92 92 ALA H H 92 7.554 7.554 8.573 -1.019 25342 7206 1 9 . 1 1 93 93 THR N N 93 112.558 112.558 110.647 1.911 25342 7207 1 9 . 1 1 93 93 THR CB C 93 64.173 64.173 67.422 -3.249 25342 7208 1 9 . 1 1 93 93 THR H H 93 6.730 6.730 7.788 -1.058 25342 7209 1 9 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.465 -0.606 25342 7210 1 9 . 1 1 94 94 PRO C C 94 173.309 173.309 177.533 -4.224 25342 7211 1 9 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.744 -1.681 25342 7212 1 9 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.031 -2.752 25342 7213 1 9 . 1 1 95 95 ILE N N 95 111.014 111.014 117.746 -6.732 25342 7214 1 9 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.181 -0.576 25342 7215 1 9 . 1 1 95 95 ILE C C 95 174.302 174.302 177.430 -3.128 25342 7216 1 9 . 1 1 95 95 ILE CA C 95 57.181 57.181 60.291 -3.110 25342 7217 1 9 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.083 -4.300 25342 7218 1 9 . 1 1 95 95 ILE H H 95 7.995 7.995 8.121 -0.126 25342 7219 1 9 . 1 1 96 96 LYS N N 96 123.208 123.208 121.515 1.693 25342 7220 1 9 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.080 -0.988 25342 7221 1 9 . 1 1 96 96 LYS C C 96 174.451 174.451 178.247 -3.796 25342 7222 1 9 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.256 -2.215 25342 7223 1 9 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.908 -3.161 25342 7224 1 9 . 1 1 96 96 LYS H H 96 6.928 6.928 7.526 -0.598 25342 7225 1 9 . 1 1 97 97 THR N N 97 113.320 113.320 114.945 -1.625 25342 7226 1 9 . 1 1 97 97 THR HA H 97 3.436 3.436 3.778 -0.342 25342 7227 1 9 . 1 1 97 97 THR C C 97 173.221 173.221 175.852 -2.631 25342 7228 1 9 . 1 1 97 97 THR CA C 97 62.710 62.710 65.849 -3.139 25342 7229 1 9 . 1 1 97 97 THR CB C 97 65.562 65.562 68.611 -3.049 25342 7230 1 9 . 1 1 97 97 THR H H 97 6.325 6.325 7.540 -1.215 25342 7231 1 9 . 1 1 98 98 LEU N N 98 120.963 120.963 122.491 -1.528 25342 7232 1 9 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.109 -0.484 25342 7233 1 9 . 1 1 98 98 LEU C C 98 174.713 174.713 178.304 -3.591 25342 7234 1 9 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.476 -1.962 25342 7235 1 9 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.644 -1.916 25342 7236 1 9 . 1 1 98 98 LEU H H 98 7.536 7.536 7.691 -0.155 25342 7237 1 9 . 1 1 99 99 LEU N N 99 118.859 118.859 118.210 0.649 25342 7238 1 9 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.921 -0.249 25342 7239 1 9 . 1 1 99 99 LEU C C 99 177.458 177.458 178.863 -1.405 25342 7240 1 9 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.351 -3.206 25342 7241 1 9 . 1 1 99 99 LEU CB C 99 38.857 38.857 40.866 -2.009 25342 7242 1 9 . 1 1 99 99 LEU H H 99 8.179 8.179 8.018 0.161 25342 7243 1 9 . 1 1 100 100 ASP N N 100 118.703 118.703 118.056 0.647 25342 7244 1 9 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.360 -0.139 25342 7245 1 9 . 1 1 100 100 ASP C C 100 176.472 176.472 178.259 -1.787 25342 7246 1 9 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.340 -3.033 25342 7247 1 9 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.779 -3.421 25342 7248 1 9 . 1 1 100 100 ASP H H 100 7.867 7.867 7.950 -0.083 25342 7249 1 9 . 1 1 101 101 GLN N N 101 117.829 117.829 116.221 1.608 25342 7250 1 9 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.321 -0.121 25342 7251 1 9 . 1 1 101 101 GLN C C 101 174.508 174.508 176.528 -2.020 25342 7252 1 9 . 1 1 101 101 GLN CA C 101 54.688 54.688 56.660 -1.972 25342 7253 1 9 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.441 -3.844 25342 7254 1 9 . 1 1 101 101 GLN H H 101 7.597 7.597 7.710 -0.113 25342 7255 1 9 . 1 1 102 102 MET N N 102 118.406 118.406 110.545 7.861 25342 7256 1 9 . 1 1 102 102 MET HA H 102 3.864 3.864 5.061 -1.196 25342 7257 1 9 . 1 1 102 102 MET C C 102 172.820 172.820 176.107 -3.287 25342 7258 1 9 . 1 1 102 102 MET CA C 102 53.298 53.298 54.676 -1.379 25342 7259 1 9 . 1 1 102 102 MET CB C 102 31.207 31.207 34.065 -2.858 25342 7260 1 9 . 1 1 102 102 MET H H 102 7.434 7.434 7.804 -0.370 25342 7261 1 9 . 1 1 103 103 LYS N N 103 115.889 115.889 123.548 -7.659 25342 7262 1 9 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.067 -0.148 25342 7263 1 9 . 1 1 103 103 LYS C C 103 173.938 173.938 177.131 -3.193 25342 7264 1 9 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.840 -2.404 25342 7265 1 9 . 1 1 103 103 LYS CB C 103 29.263 29.263 32.096 -2.833 25342 7266 1 9 . 1 1 103 103 LYS H H 103 6.881 6.881 7.890 -1.009 25342 7267 1 9 . 1 1 104 104 ASN N N 104 114.951 114.951 114.973 -0.022 25342 7268 1 9 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.703 0.028 25342 7269 1 9 . 1 1 104 104 ASN C C 104 172.617 172.617 175.129 -2.512 25342 7270 1 9 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.117 -2.851 25342 7271 1 9 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.322 -2.539 25342 7272 1 9 . 1 1 104 104 ASN H H 104 8.493 8.493 8.382 0.111 25342 7273 1 9 . 1 1 105 105 TYR N N 105 122.680 122.680 122.495 0.185 25342 7274 1 9 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.363 0.199 25342 7275 1 9 . 1 1 105 105 TYR CA C 105 55.433 55.433 59.444 -4.011 25342 7276 1 9 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.177 -3.345 25342 7277 1 9 . 1 1 105 105 TYR H H 105 8.217 8.217 7.628 0.589 25342 7278 1 9 . 1 1 106 106 ARG N N 106 128.872 128.872 122.154 6.718 25342 7279 1 9 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.316 -0.051 25342 7280 1 9 . 1 1 106 106 ARG CA C 106 52.982 52.982 53.881 -0.899 25342 7281 1 9 . 1 1 106 106 ARG CB C 106 28.130 28.130 34.076 -5.946 25342 7282 1 9 . 1 1 106 106 ARG H H 106 8.801 8.801 7.553 1.248 25342 7283 1 9 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.519 -2.118 25342 7284 1 9 . 1 1 108 108 GLU N N 108 117.000 117.000 120.673 -3.673 25342 7285 1 9 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.963 -0.337 25342 7286 1 9 . 1 1 108 108 GLU C C 108 174.125 174.125 175.167 -1.042 25342 7287 1 9 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.002 -1.214 25342 7288 1 9 . 1 1 108 108 GLU CB C 108 30.440 30.440 34.604 -4.164 25342 7289 1 9 . 1 1 108 108 GLU H H 108 7.514 7.514 8.410 -0.896 25342 7290 1 9 . 1 1 109 109 VAL N N 109 123.398 123.398 118.763 4.635 25342 7291 1 9 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.205 0.132 25342 7292 1 9 . 1 1 109 109 VAL C C 109 170.606 170.606 173.777 -3.171 25342 7293 1 9 . 1 1 109 109 VAL CA C 109 57.280 57.280 59.943 -2.663 25342 7294 1 9 . 1 1 109 109 VAL CB C 109 32.657 32.657 36.407 -3.750 25342 7295 1 9 . 1 1 109 109 VAL H H 109 8.942 8.942 8.169 0.773 25342 7296 1 9 . 1 1 110 110 ALA N N 110 127.905 127.905 125.232 2.673 25342 7297 1 9 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.057 -0.430 25342 7298 1 9 . 1 1 110 110 ALA C C 110 173.195 173.195 175.435 -2.240 25342 7299 1 9 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.225 -1.879 25342 7300 1 9 . 1 1 110 110 ALA CB C 110 18.325 18.325 21.527 -3.203 25342 7301 1 9 . 1 1 110 110 ALA H H 110 8.776 8.776 8.580 0.196 25342 7302 1 9 . 1 1 111 111 SER N N 111 110.523 110.523 114.781 -4.258 25342 7303 1 9 . 1 1 111 111 SER HA H 111 5.562 5.562 4.843 0.719 25342 7304 1 9 . 1 1 111 111 SER C C 111 170.719 170.719 172.973 -2.254 25342 7305 1 9 . 1 1 111 111 SER CA C 111 51.314 51.314 56.952 -5.638 25342 7306 1 9 . 1 1 111 111 SER CB C 111 61.907 61.907 64.657 -2.750 25342 7307 1 9 . 1 1 111 111 SER H H 111 7.480 7.480 8.245 -0.765 25342 7308 1 9 . 1 1 112 112 PHE N N 112 125.567 125.567 125.082 0.485 25342 7309 1 9 . 1 1 112 112 PHE HA H 112 6.356 6.356 6.123 0.233 25342 7310 1 9 . 1 1 112 112 PHE C C 112 169.536 169.536 173.260 -3.724 25342 7311 1 9 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.862 -5.491 25342 7312 1 9 . 1 1 112 112 PHE CB C 112 39.788 39.788 43.595 -3.807 25342 7313 1 9 . 1 1 112 112 PHE H H 112 7.848 7.848 8.828 -0.980 25342 7314 1 9 . 1 1 113 113 PHE N N 113 115.065 115.065 117.299 -2.234 25342 7315 1 9 . 1 1 113 113 PHE HA H 113 6.104 6.104 4.697 1.407 25342 7316 1 9 . 1 1 113 113 PHE C C 113 173.006 173.006 172.768 0.238 25342 7317 1 9 . 1 1 113 113 PHE CA C 113 50.262 50.262 54.987 -4.725 25342 7318 1 9 . 1 1 113 113 PHE CB C 113 38.749 38.749 40.899 -2.150 25342 7319 1 9 . 1 1 113 113 PHE H H 113 7.361 7.361 7.717 -0.356 25342 7320 1 9 . 1 1 114 114 THR N N 114 108.014 108.014 112.640 -4.626 25342 7321 1 9 . 1 1 114 114 THR HA H 114 4.999 4.999 4.429 0.570 25342 7322 1 9 . 1 1 114 114 THR C C 114 169.874 169.874 174.546 -4.672 25342 7323 1 9 . 1 1 114 114 THR CA C 114 56.500 56.500 60.336 -3.836 25342 7324 1 9 . 1 1 114 114 THR CB C 114 68.809 68.809 69.449 -0.640 25342 7325 1 9 . 1 1 114 114 THR H H 114 7.867 7.867 7.719 0.148 25342 7326 1 9 . 1 1 115 115 SER N N 115 115.049 115.049 119.847 -4.798 25342 7327 1 9 . 1 1 115 115 SER HA H 115 5.613 5.613 4.140 1.473 25342 7328 1 9 . 1 1 115 115 SER C C 115 171.247 171.247 175.009 -3.762 25342 7329 1 9 . 1 1 115 115 SER CA C 115 54.830 54.830 58.369 -3.539 25342 7330 1 9 . 1 1 115 115 SER CB C 115 63.992 63.992 63.058 0.934 25342 7331 1 9 . 1 1 115 115 SER H H 115 8.970 8.970 7.525 1.445 25342 7332 1 9 . 1 1 116 116 ALA N N 116 122.671 122.671 124.043 -1.372 25342 7333 1 9 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.243 0.742 25342 7334 1 9 . 1 1 116 116 ALA C C 116 176.180 176.180 177.692 -1.512 25342 7335 1 9 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.058 -2.858 25342 7336 1 9 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.863 -1.868 25342 7337 1 9 . 1 1 116 116 ALA H H 116 8.963 8.963 8.773 0.190 25342 7338 1 9 . 1 1 117 117 GLY N N 117 107.387 107.387 106.330 1.057 25342 7339 1 9 . 1 1 117 117 GLY C C 117 172.528 172.528 174.350 -1.822 25342 7340 1 9 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.737 -2.005 25342 7341 1 9 . 1 1 117 117 GLY H H 117 9.340 9.340 7.790 1.550 25342 7342 1 9 . 1 1 118 118 THR N N 118 113.481 113.481 111.945 1.536 25342 7343 1 9 . 1 1 118 118 THR HA H 118 4.651 4.651 4.408 0.243 25342 7344 1 9 . 1 1 118 118 THR C C 118 172.067 172.067 174.651 -2.584 25342 7345 1 9 . 1 1 118 118 THR CA C 118 57.357 57.357 61.052 -3.695 25342 7346 1 9 . 1 1 118 118 THR CB C 118 69.475 69.475 69.657 -0.183 25342 7347 1 9 . 1 1 118 118 THR H H 118 9.373 9.373 7.626 1.747 25342 7348 1 9 . 1 1 119 119 ASN N N 119 113.202 113.202 116.330 -3.128 25342 7349 1 9 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.278 0.340 25342 7350 1 9 . 1 1 119 119 ASN C C 119 173.114 173.114 176.407 -3.293 25342 7351 1 9 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.892 -3.208 25342 7352 1 9 . 1 1 119 119 ASN CB C 119 33.730 33.730 36.307 -2.577 25342 7353 1 9 . 1 1 119 119 ASN H H 119 8.908 8.908 8.978 -0.070 25342 7354 1 9 . 1 1 120 120 HIS N N 120 117.315 117.315 116.883 0.432 25342 7355 1 9 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.576 -0.790 25342 7356 1 9 . 1 1 120 120 HIS C C 120 174.381 174.381 176.897 -2.516 25342 7357 1 9 . 1 1 120 120 HIS CA C 120 54.516 54.516 59.566 -5.050 25342 7358 1 9 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.297 -2.793 25342 7359 1 9 . 1 1 120 120 HIS H H 120 8.074 8.074 7.886 0.188 25342 7360 1 9 . 1 1 121 121 LYS N N 121 118.678 118.678 119.452 -0.774 25342 7361 1 9 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.091 -0.257 25342 7362 1 9 . 1 1 121 121 LYS C C 121 176.564 176.564 177.796 -1.232 25342 7363 1 9 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.138 -1.843 25342 7364 1 9 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.825 -2.883 25342 7365 1 9 . 1 1 121 121 LYS H H 121 8.336 8.336 7.893 0.443 25342 7366 1 9 . 1 1 122 122 ALA N N 122 122.146 122.146 123.332 -1.186 25342 7367 1 9 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.097 -0.402 25342 7368 1 9 . 1 1 122 122 ALA C C 122 175.163 175.163 179.078 -3.915 25342 7369 1 9 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.599 -2.907 25342 7370 1 9 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.262 -2.545 25342 7371 1 9 . 1 1 122 122 ALA H H 122 7.584 7.584 7.624 -0.040 25342 7372 1 9 . 1 1 123 123 TYR N N 123 119.730 119.730 120.251 -0.521 25342 7373 1 9 . 1 1 123 123 TYR HA H 123 3.153 3.153 3.937 -0.784 25342 7374 1 9 . 1 1 123 123 TYR C C 123 174.340 174.340 177.303 -2.963 25342 7375 1 9 . 1 1 123 123 TYR CA C 123 60.398 60.398 61.750 -1.352 25342 7376 1 9 . 1 1 123 123 TYR CB C 123 34.663 34.663 38.082 -3.419 25342 7377 1 9 . 1 1 123 123 TYR H H 123 7.317 7.317 8.325 -1.008 25342 7378 1 9 . 1 1 124 124 VAL N N 124 118.649 118.649 117.632 1.017 25342 7379 1 9 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.100 0.102 25342 7380 1 9 . 1 1 124 124 VAL C C 124 175.603 175.603 178.300 -2.697 25342 7381 1 9 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.384 -1.704 25342 7382 1 9 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.953 -1.665 25342 7383 1 9 . 1 1 124 124 VAL H H 124 7.799 7.799 7.521 0.278 25342 7384 1 9 . 1 1 125 125 SER N N 125 114.475 114.475 114.855 -0.380 25342 7385 1 9 . 1 1 125 125 SER HA H 125 4.032 4.032 4.026 0.006 25342 7386 1 9 . 1 1 125 125 SER C C 125 174.849 174.849 176.941 -2.092 25342 7387 1 9 . 1 1 125 125 SER CA C 125 59.002 59.002 62.218 -3.216 25342 7388 1 9 . 1 1 125 125 SER CB C 125 59.613 59.613 63.028 -3.415 25342 7389 1 9 . 1 1 125 125 SER H H 125 7.766 7.766 7.614 0.152 25342 7390 1 9 . 1 1 126 126 HIS N N 126 119.326 119.326 120.201 -0.875 25342 7391 1 9 . 1 1 126 126 HIS HA H 126 4.127 4.127 3.636 0.491 25342 7392 1 9 . 1 1 126 126 HIS C C 126 172.865 172.865 176.869 -4.004 25342 7393 1 9 . 1 1 126 126 HIS CA C 126 55.706 55.706 58.498 -2.792 25342 7394 1 9 . 1 1 126 126 HIS CB C 126 25.993 25.993 29.570 -3.577 25342 7395 1 9 . 1 1 126 126 HIS H H 126 8.569 8.569 8.164 0.405 25342 7396 1 9 . 1 1 127 127 PHE N N 127 121.044 121.044 120.768 0.276 25342 7397 1 9 . 1 1 127 127 PHE HA H 127 3.174 3.174 3.836 -0.662 25342 7398 1 9 . 1 1 127 127 PHE C C 127 173.378 173.378 175.496 -2.118 25342 7399 1 9 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.029 -0.162 25342 7400 1 9 . 1 1 127 127 PHE CB C 127 36.054 36.054 38.635 -2.581 25342 7401 1 9 . 1 1 127 127 PHE H H 127 9.139 9.139 8.169 0.970 25342 7402 1 9 . 1 1 128 128 ASN N N 128 114.893 114.893 114.799 0.094 25342 7403 1 9 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.000 0.040 25342 7404 1 9 . 1 1 128 128 ASN C C 128 175.230 175.230 176.431 -1.201 25342 7405 1 9 . 1 1 128 128 ASN CA C 128 54.300 54.300 55.805 -1.505 25342 7406 1 9 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.531 -2.360 25342 7407 1 9 . 1 1 128 128 ASN H H 128 7.774 7.774 7.679 0.095 25342 7408 1 9 . 1 1 129 129 GLU N N 129 119.804 119.804 119.668 0.136 25342 7409 1 9 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.977 0.063 25342 7410 1 9 . 1 1 129 129 GLU C C 129 177.052 177.052 178.264 -1.212 25342 7411 1 9 . 1 1 129 129 GLU CA C 129 56.730 56.730 59.105 -2.375 25342 7412 1 9 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.849 -2.653 25342 7413 1 9 . 1 1 129 129 GLU H H 129 7.577 7.577 7.186 0.391 25342 7414 1 9 . 1 1 130 130 TRP N N 130 120.979 120.979 117.251 3.728 25342 7415 1 9 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.529 -0.072 25342 7416 1 9 . 1 1 130 130 TRP C C 130 174.329 174.329 174.960 -0.631 25342 7417 1 9 . 1 1 130 130 TRP CA C 130 54.688 54.688 55.935 -1.247 25342 7418 1 9 . 1 1 130 130 TRP CB C 130 26.991 26.991 27.920 -0.929 25342 7419 1 9 . 1 1 130 130 TRP H H 130 8.225 8.225 7.043 1.182 25342 7420 1 9 . 1 1 131 131 ALA N N 131 120.450 120.450 118.339 2.111 25342 7421 1 9 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.211 -0.275 25342 7422 1 9 . 1 1 131 131 ALA C C 131 172.487 172.487 175.538 -3.051 25342 7423 1 9 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.456 -3.022 25342 7424 1 9 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.207 -2.919 25342 7425 1 9 . 1 1 131 131 ALA H H 131 8.081 8.081 6.729 1.352 25342 7426 1 9 . 1 1 132 132 ASP N N 132 117.813 117.813 120.828 -3.015 25342 7427 1 9 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.506 -0.298 25342 7428 1 9 . 1 1 132 132 ASP C C 132 173.804 173.804 176.807 -3.003 25342 7429 1 9 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.088 -0.907 25342 7430 1 9 . 1 1 132 132 ASP CB C 132 39.321 39.321 42.173 -2.852 25342 7431 1 9 . 1 1 132 132 ASP H H 132 6.772 6.772 7.551 -0.779 25342 7432 1 9 . 1 1 133 133 GLY N N 133 115.052 115.052 109.411 5.641 25342 7433 1 9 . 1 1 133 133 GLY C C 133 172.078 172.078 173.786 -1.708 25342 7434 1 9 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.647 -2.227 25342 7435 1 9 . 1 1 133 133 GLY H H 133 8.626 8.626 8.362 0.264 25342 7436 1 9 . 1 1 134 134 LEU N N 134 120.063 120.063 120.620 -0.557 25342 7437 1 9 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.659 -0.187 25342 7438 1 9 . 1 1 134 134 LEU C C 134 174.079 174.079 176.088 -2.009 25342 7439 1 9 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.051 -2.087 25342 7440 1 9 . 1 1 134 134 LEU CB C 134 40.370 40.370 44.916 -4.545 25342 7441 1 9 . 1 1 134 134 LEU H H 134 8.094 8.094 7.799 0.295 25342 7442 1 9 . 1 1 135 135 ASN N N 135 119.292 119.292 120.564 -1.272 25342 7443 1 9 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.589 0.034 25342 7444 1 9 . 1 1 135 135 ASN C C 135 170.527 170.527 174.320 -3.793 25342 7445 1 9 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.323 -4.321 25342 7446 1 9 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.294 -4.734 25342 7447 1 9 . 1 1 135 135 ASN H H 135 8.513 8.513 8.660 -0.147 25342 7448 1 9 . 1 1 136 136 VAL N N 136 125.412 125.412 123.385 2.027 25342 7449 1 9 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.626 -0.020 25342 7450 1 9 . 1 1 136 136 VAL C C 136 175.420 175.420 176.446 -1.026 25342 7451 1 9 . 1 1 136 136 VAL CA C 136 58.382 58.382 61.105 -2.723 25342 7452 1 9 . 1 1 136 136 VAL CB C 136 29.247 29.247 34.229 -4.982 25342 7453 1 9 . 1 1 136 136 VAL H H 136 7.648 7.648 8.259 -0.611 25342 7454 1 9 . 1 1 137 137 ILE N N 137 121.881 121.881 125.063 -3.182 25342 7455 1 9 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.730 -0.297 25342 7456 1 9 . 1 1 137 137 ILE C C 137 173.906 173.906 175.006 -1.100 25342 7457 1 9 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.489 -1.511 25342 7458 1 9 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.075 -1.879 25342 7459 1 9 . 1 1 137 137 ILE H H 137 9.139 9.139 9.262 -0.123 25342 7460 1 9 . 1 1 138 138 GLY N N 138 108.226 108.226 106.189 2.037 25342 7461 1 9 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.590 -2.199 25342 7462 1 9 . 1 1 138 138 GLY H H 138 6.645 6.645 7.454 -0.809 25342 7463 1 9 . 1 1 139 139 VAL N N 139 119.408 119.408 120.230 -0.822 25342 7464 1 9 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.433 -0.076 25342 7465 1 9 . 1 1 139 139 VAL C C 139 172.327 172.327 174.691 -2.364 25342 7466 1 9 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.088 -1.821 25342 7467 1 9 . 1 1 139 139 VAL CB C 139 32.743 32.743 35.007 -2.264 25342 7468 1 9 . 1 1 139 139 VAL H H 139 8.092 8.092 8.414 -0.322 25342 7469 1 9 . 1 1 140 140 ALA N N 140 127.415 127.415 130.785 -3.370 25342 7470 1 9 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.145 -0.700 25342 7471 1 9 . 1 1 140 140 ALA C C 140 170.718 170.718 176.006 -5.288 25342 7472 1 9 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.017 -2.117 25342 7473 1 9 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.684 -1.625 25342 7474 1 9 . 1 1 140 140 ALA H H 140 9.093 9.093 8.850 0.243 25342 7475 1 9 . 1 1 141 141 ARG N N 141 119.287 119.287 120.702 -1.415 25342 7476 1 9 . 1 1 141 141 ARG HA H 141 2.487 2.487 4.882 -2.395 25342 7477 1 9 . 1 1 141 141 ARG C C 141 173.375 173.375 176.565 -3.190 25342 7478 1 9 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.667 -3.783 25342 7479 1 9 . 1 1 141 141 ARG CB C 141 28.684 28.684 30.939 -2.255 25342 7480 1 9 . 1 1 141 141 ARG H H 141 7.620 7.620 8.540 -0.920 25342 7481 1 9 . 1 1 142 142 ASP N N 142 125.999 125.999 121.501 4.498 25342 7482 1 9 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.393 -0.669 25342 7483 1 9 . 1 1 142 142 ASP C C 142 169.292 169.292 176.344 -7.052 25342 7484 1 9 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.930 -3.592 25342 7485 1 9 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.802 -4.125 25342 7486 1 9 . 1 1 142 142 ASP H H 142 9.482 9.482 8.479 1.003 25342 7487 1 9 . 1 1 143 143 ASP N N 143 119.293 119.293 119.415 -0.122 25342 7488 1 9 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.388 -0.082 25342 7489 1 9 . 1 1 143 143 ASP C C 143 175.686 175.686 177.377 -1.691 25342 7490 1 9 . 1 1 143 143 ASP CA C 143 48.905 48.905 55.172 -6.266 25342 7491 1 9 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.185 -3.873 25342 7492 1 9 . 1 1 143 143 ASP H H 143 8.108 8.108 8.541 -0.433 25342 7493 1 9 . 1 1 144 144 SER N N 144 115.303 115.303 115.160 0.143 25342 7494 1 9 . 1 1 144 144 SER HA H 144 3.740 3.740 4.203 -0.463 25342 7495 1 9 . 1 1 144 144 SER C C 144 172.925 172.925 174.474 -1.549 25342 7496 1 9 . 1 1 144 144 SER CA C 144 59.213 59.213 60.609 -1.396 25342 7497 1 9 . 1 1 144 144 SER CB C 144 60.806 60.806 62.840 -2.034 25342 7498 1 9 . 1 1 144 144 SER H H 144 7.642 7.642 7.667 -0.025 25342 7499 1 9 . 1 1 145 145 GLU N N 145 119.523 119.523 118.600 0.923 25342 7500 1 9 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.178 0.128 25342 7501 1 9 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.436 -3.397 25342 7502 1 9 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.646 -2.846 25342 7503 1 9 . 1 1 145 145 GLU H H 145 7.771 7.771 7.862 -0.091 25342 7504 1 9 . 1 1 146 146 VAL N N 146 118.683 118.683 120.988 -2.305 25342 7505 1 9 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.550 -0.609 25342 7506 1 9 . 1 1 146 146 VAL C C 146 174.591 174.591 177.380 -2.789 25342 7507 1 9 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.943 -3.011 25342 7508 1 9 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.532 -2.485 25342 7509 1 9 . 1 1 146 146 VAL H H 146 6.352 6.352 7.263 -0.911 25342 7510 1 9 . 1 1 147 147 ASP N N 147 119.312 119.312 118.861 0.451 25342 7511 1 9 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.297 -0.242 25342 7512 1 9 . 1 1 147 147 ASP C C 147 174.783 174.783 177.575 -2.792 25342 7513 1 9 . 1 1 147 147 ASP CA C 147 54.241 54.241 57.025 -2.784 25342 7514 1 9 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.658 -3.425 25342 7515 1 9 . 1 1 147 147 ASP H H 147 8.370 8.370 8.691 -0.321 25342 7516 1 9 . 1 1 148 148 LYS N N 148 119.342 119.342 116.804 2.538 25342 7517 1 9 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.423 -0.486 25342 7518 1 9 . 1 1 148 148 LYS C C 148 176.384 176.384 177.924 -1.540 25342 7519 1 9 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.179 -1.473 25342 7520 1 9 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.525 -3.014 25342 7521 1 9 . 1 1 148 148 LYS H H 148 7.040 7.040 7.648 -0.608 25342 7522 1 9 . 1 1 149 149 TRP N N 149 118.258 118.258 119.935 -1.677 25342 7523 1 9 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.877 -0.286 25342 7524 1 9 . 1 1 149 149 TRP C C 149 174.212 174.212 175.971 -1.759 25342 7525 1 9 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.515 -1.770 25342 7526 1 9 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.469 -1.529 25342 7527 1 9 . 1 1 149 149 TRP H H 149 7.811 7.811 7.324 0.487 25342 7528 1 9 . 1 1 150 150 SER N N 150 109.618 109.618 114.518 -4.900 25342 7529 1 9 . 1 1 150 150 SER HA H 150 4.234 4.234 4.619 -0.385 25342 7530 1 9 . 1 1 150 150 SER C C 150 170.189 170.189 174.242 -4.053 25342 7531 1 9 . 1 1 150 150 SER CA C 150 56.695 56.695 57.494 -0.799 25342 7532 1 9 . 1 1 150 150 SER CB C 150 61.935 61.935 63.622 -1.687 25342 7533 1 9 . 1 1 150 150 SER H H 150 7.793 7.793 7.537 0.256 25342 7534 1 10 . 1 1 3 3 ALA N N 3 125.638 125.638 122.657 2.981 25342 7535 1 10 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.495 -0.130 25342 7536 1 10 . 1 1 3 3 ALA CA C 3 49.298 49.298 51.800 -2.502 25342 7537 1 10 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.475 -2.616 25342 7538 1 10 . 1 1 3 3 ALA H H 3 8.325 8.325 7.923 0.402 25342 7539 1 10 . 1 1 4 4 LYS N N 4 121.813 121.813 120.247 1.566 25342 7540 1 10 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.550 -0.323 25342 7541 1 10 . 1 1 4 4 LYS C C 4 174.574 174.574 174.304 0.270 25342 7542 1 10 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.558 -1.777 25342 7543 1 10 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.360 -2.870 25342 7544 1 10 . 1 1 4 4 LYS H H 4 8.486 8.486 7.703 0.783 25342 7545 1 10 . 1 1 5 5 LYS N N 5 129.722 129.722 119.427 10.295 25342 7546 1 10 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.502 0.016 25342 7547 1 10 . 1 1 5 5 LYS C C 5 174.720 174.720 174.113 0.607 25342 7548 1 10 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.548 -0.826 25342 7549 1 10 . 1 1 5 5 LYS CB C 5 29.785 29.785 35.129 -5.344 25342 7550 1 10 . 1 1 5 5 LYS H H 5 10.015 10.015 8.302 1.713 25342 7551 1 10 . 1 1 6 6 THR N N 6 126.254 126.254 115.675 10.579 25342 7552 1 10 . 1 1 6 6 THR HA H 6 5.654 5.654 4.940 0.714 25342 7553 1 10 . 1 1 6 6 THR C C 6 169.926 169.926 173.046 -3.120 25342 7554 1 10 . 1 1 6 6 THR CA C 6 60.598 60.598 62.030 -1.432 25342 7555 1 10 . 1 1 6 6 THR CB C 6 68.041 68.041 69.633 -1.592 25342 7556 1 10 . 1 1 6 6 THR H H 6 8.538 8.538 8.422 0.116 25342 7557 1 10 . 1 1 7 7 LEU N N 7 130.775 130.775 128.095 2.680 25342 7558 1 10 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.565 0.029 25342 7559 1 10 . 1 1 7 7 LEU C C 7 170.404 170.404 174.573 -4.169 25342 7560 1 10 . 1 1 7 7 LEU CA C 7 49.933 49.933 54.736 -4.803 25342 7561 1 10 . 1 1 7 7 LEU CB C 7 40.728 40.728 43.961 -3.233 25342 7562 1 10 . 1 1 7 7 LEU H H 7 8.575 8.575 8.380 0.195 25342 7563 1 10 . 1 1 8 8 ILE N N 8 127.242 127.242 124.323 2.919 25342 7564 1 10 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.683 0.165 25342 7565 1 10 . 1 1 8 8 ILE C C 8 170.936 170.936 174.262 -3.326 25342 7566 1 10 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.701 -3.449 25342 7567 1 10 . 1 1 8 8 ILE CB C 8 36.935 36.935 39.641 -2.706 25342 7568 1 10 . 1 1 8 8 ILE H H 8 9.217 9.217 7.994 1.223 25342 7569 1 10 . 1 1 9 9 LEU N N 9 127.183 127.183 129.050 -1.867 25342 7570 1 10 . 1 1 9 9 LEU HA H 9 5.694 5.694 5.084 0.610 25342 7571 1 10 . 1 1 9 9 LEU C C 9 173.824 173.824 175.386 -1.562 25342 7572 1 10 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.191 -4.352 25342 7573 1 10 . 1 1 9 9 LEU CB C 9 43.963 43.963 43.887 0.076 25342 7574 1 10 . 1 1 9 9 LEU H H 9 9.248 9.248 8.994 0.254 25342 7575 1 10 . 1 1 10 10 TYR N N 10 113.330 113.330 122.701 -9.371 25342 7576 1 10 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.367 0.147 25342 7577 1 10 . 1 1 10 10 TYR C C 10 167.898 167.898 172.850 -4.952 25342 7578 1 10 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.431 -0.556 25342 7579 1 10 . 1 1 10 10 TYR CB C 10 38.436 38.436 41.147 -2.711 25342 7580 1 10 . 1 1 10 10 TYR H H 10 7.306 7.306 8.492 -1.186 25342 7581 1 10 . 1 1 11 11 TYR N N 11 121.297 121.297 123.359 -2.062 25342 7582 1 10 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.048 -0.286 25342 7583 1 10 . 1 1 11 11 TYR C C 11 169.698 169.698 174.428 -4.730 25342 7584 1 10 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.352 -0.305 25342 7585 1 10 . 1 1 11 11 TYR CB C 11 40.538 40.538 39.899 0.639 25342 7586 1 10 . 1 1 11 11 TYR H H 11 7.891 7.891 8.812 -0.921 25342 7587 1 10 . 1 1 12 12 SER N N 12 117.763 117.763 124.365 -6.602 25342 7588 1 10 . 1 1 12 12 SER HA H 12 4.679 4.679 4.149 0.530 25342 7589 1 10 . 1 1 12 12 SER C C 12 170.075 170.075 173.938 -3.863 25342 7590 1 10 . 1 1 12 12 SER CA C 12 53.619 53.619 56.779 -3.160 25342 7591 1 10 . 1 1 12 12 SER CB C 12 62.847 62.847 62.300 0.547 25342 7592 1 10 . 1 1 12 12 SER H H 12 7.557 7.557 8.152 -0.595 25342 7593 1 10 . 1 1 13 13 TRP N N 13 135.232 135.232 129.923 5.309 25342 7594 1 10 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.761 0.875 25342 7595 1 10 . 1 1 13 13 TRP C C 13 175.708 175.708 176.619 -0.911 25342 7596 1 10 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.220 -2.104 25342 7597 1 10 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.619 -1.984 25342 7598 1 10 . 1 1 13 13 TRP H H 13 9.755 9.755 7.760 1.995 25342 7599 1 10 . 1 1 14 14 SER N N 14 113.789 113.789 110.367 3.422 25342 7600 1 10 . 1 1 14 14 SER HA H 14 4.223 4.223 4.527 -0.304 25342 7601 1 10 . 1 1 14 14 SER C C 14 172.747 172.747 173.940 -1.193 25342 7602 1 10 . 1 1 14 14 SER CA C 14 53.828 53.828 58.003 -4.175 25342 7603 1 10 . 1 1 14 14 SER CB C 14 60.037 60.037 63.696 -3.659 25342 7604 1 10 . 1 1 14 14 SER H H 14 10.026 10.026 8.630 1.396 25342 7605 1 10 . 1 1 15 15 GLY N N 15 110.489 110.489 108.441 2.048 25342 7606 1 10 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.853 -1.194 25342 7607 1 10 . 1 1 15 15 GLY H H 15 7.391 7.391 8.329 -0.938 25342 7608 1 10 . 1 1 16 16 GLU N N 16 129.005 129.005 122.387 6.618 25342 7609 1 10 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.057 0.006 25342 7610 1 10 . 1 1 16 16 GLU CA C 16 56.761 56.761 59.632 -2.871 25342 7611 1 10 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.135 -2.723 25342 7612 1 10 . 1 1 16 16 GLU H H 16 11.550 11.550 8.880 2.670 25342 7613 1 10 . 1 1 17 17 THR N N 17 123.016 123.016 114.154 8.862 25342 7614 1 10 . 1 1 17 17 THR HA H 17 4.035 4.035 4.193 -0.158 25342 7615 1 10 . 1 1 17 17 THR C C 17 173.360 173.360 177.098 -3.738 25342 7616 1 10 . 1 1 17 17 THR CA C 17 64.303 64.303 65.523 -1.220 25342 7617 1 10 . 1 1 17 17 THR CB C 17 63.999 63.999 68.465 -4.466 25342 7618 1 10 . 1 1 17 17 THR H H 17 11.293 11.293 8.294 2.999 25342 7619 1 10 . 1 1 18 18 LYS N N 18 120.156 120.156 123.462 -3.306 25342 7620 1 10 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.430 -1.574 25342 7621 1 10 . 1 1 18 18 LYS C C 18 173.901 173.901 179.334 -5.433 25342 7622 1 10 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.378 -2.544 25342 7623 1 10 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.122 -2.641 25342 7624 1 10 . 1 1 18 18 LYS H H 18 6.940 6.940 8.115 -1.175 25342 7625 1 10 . 1 1 19 19 LYS N N 19 117.237 117.237 117.363 -0.126 25342 7626 1 10 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.196 -0.273 25342 7627 1 10 . 1 1 19 19 LYS CA C 19 56.324 56.324 57.651 -1.327 25342 7628 1 10 . 1 1 19 19 LYS CB C 19 29.361 29.361 31.893 -2.532 25342 7629 1 10 . 1 1 19 19 LYS H H 19 7.212 7.212 8.062 -0.850 25342 7630 1 10 . 1 1 20 20 MET N N 20 119.268 119.268 117.672 1.596 25342 7631 1 10 . 1 1 20 20 MET HA H 20 4.413 4.413 4.424 -0.011 25342 7632 1 10 . 1 1 20 20 MET C C 20 173.625 173.625 176.735 -3.110 25342 7633 1 10 . 1 1 20 20 MET CA C 20 52.261 52.261 55.474 -3.213 25342 7634 1 10 . 1 1 20 20 MET CB C 20 26.680 26.680 32.830 -6.149 25342 7635 1 10 . 1 1 20 20 MET H H 20 7.600 7.600 7.748 -0.148 25342 7636 1 10 . 1 1 21 21 ALA N N 21 123.669 123.669 123.072 0.597 25342 7637 1 10 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.877 -0.395 25342 7638 1 10 . 1 1 21 21 ALA C C 21 176.628 176.628 179.330 -2.702 25342 7639 1 10 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.396 -3.022 25342 7640 1 10 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.794 -1.299 25342 7641 1 10 . 1 1 21 21 ALA H H 21 8.738 8.738 7.887 0.851 25342 7642 1 10 . 1 1 22 22 GLU N N 22 117.242 117.242 117.765 -0.523 25342 7643 1 10 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.888 -0.215 25342 7644 1 10 . 1 1 22 22 GLU C C 22 176.698 176.698 178.944 -2.246 25342 7645 1 10 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.306 -2.766 25342 7646 1 10 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.267 -2.833 25342 7647 1 10 . 1 1 22 22 GLU H H 22 7.959 7.959 7.857 0.102 25342 7648 1 10 . 1 1 23 23 LYS N N 23 123.302 123.302 120.128 3.174 25342 7649 1 10 . 1 1 23 23 LYS HA H 23 3.821 3.821 3.994 -0.173 25342 7650 1 10 . 1 1 23 23 LYS C C 23 177.389 177.389 179.000 -1.611 25342 7651 1 10 . 1 1 23 23 LYS CA C 23 56.922 56.922 58.937 -2.015 25342 7652 1 10 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.041 -2.527 25342 7653 1 10 . 1 1 23 23 LYS H H 23 7.703 7.703 7.820 -0.117 25342 7654 1 10 . 1 1 24 24 ILE N N 24 122.208 122.208 118.544 3.664 25342 7655 1 10 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.488 -0.205 25342 7656 1 10 . 1 1 24 24 ILE C C 24 174.934 174.934 177.320 -2.386 25342 7657 1 10 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.283 -1.991 25342 7658 1 10 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.601 -2.863 25342 7659 1 10 . 1 1 24 24 ILE H H 24 8.535 8.535 7.270 1.265 25342 7660 1 10 . 1 1 25 25 ASN N N 25 118.640 118.640 118.568 0.072 25342 7661 1 10 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.293 -0.066 25342 7662 1 10 . 1 1 25 25 ASN C C 25 173.530 173.530 177.551 -4.021 25342 7663 1 10 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.416 -4.205 25342 7664 1 10 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.604 -0.500 25342 7665 1 10 . 1 1 25 25 ASN H H 25 8.317 8.317 8.395 -0.078 25342 7666 1 10 . 1 1 26 26 SER N N 26 111.990 111.990 113.907 -1.917 25342 7667 1 10 . 1 1 26 26 SER HA H 26 4.153 4.153 4.301 -0.148 25342 7668 1 10 . 1 1 26 26 SER C C 26 172.110 172.110 175.258 -3.148 25342 7669 1 10 . 1 1 26 26 SER CA C 26 57.905 57.905 60.826 -2.921 25342 7670 1 10 . 1 1 26 26 SER CB C 26 60.655 60.655 63.090 -2.435 25342 7671 1 10 . 1 1 26 26 SER H H 26 7.369 7.369 8.294 -0.925 25342 7672 1 10 . 1 1 27 27 GLU N N 27 120.201 120.201 119.465 0.736 25342 7673 1 10 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.329 -0.228 25342 7674 1 10 . 1 1 27 27 GLU C C 27 173.673 173.673 177.114 -3.441 25342 7675 1 10 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.377 -2.142 25342 7676 1 10 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.537 -3.936 25342 7677 1 10 . 1 1 27 27 GLU H H 27 7.451 7.451 7.552 -0.101 25342 7678 1 10 . 1 1 28 28 ILE N N 28 118.762 118.762 119.489 -0.727 25342 7679 1 10 . 1 1 28 28 ILE HA H 28 4.199 4.199 3.960 0.239 25342 7680 1 10 . 1 1 28 28 ILE C C 28 172.487 172.487 176.516 -4.029 25342 7681 1 10 . 1 1 28 28 ILE CA C 28 57.732 57.732 61.566 -3.834 25342 7682 1 10 . 1 1 28 28 ILE CB C 28 35.738 35.738 38.755 -3.018 25342 7683 1 10 . 1 1 28 28 ILE H H 28 7.255 7.255 7.363 -0.108 25342 7684 1 10 . 1 1 29 29 LYS N N 29 130.563 130.563 122.108 8.455 25342 7685 1 10 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.129 -0.127 25342 7686 1 10 . 1 1 29 29 LYS C C 29 174.386 174.386 177.051 -2.665 25342 7687 1 10 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.050 -1.515 25342 7688 1 10 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.864 -3.278 25342 7689 1 10 . 1 1 29 29 LYS H H 29 8.564 8.564 8.553 0.011 25342 7690 1 10 . 1 1 30 30 ASP N N 30 119.357 119.357 119.699 -0.342 25342 7691 1 10 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.506 -0.104 25342 7692 1 10 . 1 1 30 30 ASP C C 30 172.570 172.570 176.016 -3.446 25342 7693 1 10 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.450 -1.014 25342 7694 1 10 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.523 -2.779 25342 7695 1 10 . 1 1 30 30 ASP H H 30 8.920 8.920 8.620 0.300 25342 7696 1 10 . 1 1 31 31 SER N N 31 114.019 114.019 118.532 -4.513 25342 7697 1 10 . 1 1 31 31 SER HA H 31 4.782 4.782 4.863 -0.081 25342 7698 1 10 . 1 1 31 31 SER C C 31 171.150 171.150 173.954 -2.804 25342 7699 1 10 . 1 1 31 31 SER CA C 31 55.551 55.551 57.821 -2.270 25342 7700 1 10 . 1 1 31 31 SER CB C 31 62.259 62.259 65.346 -3.087 25342 7701 1 10 . 1 1 31 31 SER H H 31 8.006 8.006 8.157 -0.151 25342 7702 1 10 . 1 1 32 32 GLU N N 32 121.455 121.455 119.390 2.065 25342 7703 1 10 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.574 0.166 25342 7704 1 10 . 1 1 32 32 GLU C C 32 171.185 171.185 174.748 -3.563 25342 7705 1 10 . 1 1 32 32 GLU CA C 32 52.081 52.081 54.979 -2.898 25342 7706 1 10 . 1 1 32 32 GLU CB C 32 30.827 30.827 33.012 -2.185 25342 7707 1 10 . 1 1 32 32 GLU H H 32 8.145 8.145 8.173 -0.028 25342 7708 1 10 . 1 1 33 33 LEU N N 33 126.176 126.176 123.084 3.092 25342 7709 1 10 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.499 0.807 25342 7710 1 10 . 1 1 33 33 LEU C C 33 173.365 173.365 175.613 -2.248 25342 7711 1 10 . 1 1 33 33 LEU CA C 33 51.440 51.440 53.880 -2.439 25342 7712 1 10 . 1 1 33 33 LEU CB C 33 43.635 43.635 44.014 -0.379 25342 7713 1 10 . 1 1 33 33 LEU H H 33 8.589 8.589 8.504 0.085 25342 7714 1 10 . 1 1 34 34 LYS N N 34 127.200 127.200 124.504 2.696 25342 7715 1 10 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.883 -0.287 25342 7716 1 10 . 1 1 34 34 LYS C C 34 169.622 169.622 174.366 -4.744 25342 7717 1 10 . 1 1 34 34 LYS CA C 34 52.329 52.329 53.856 -1.527 25342 7718 1 10 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.367 -2.167 25342 7719 1 10 . 1 1 34 34 LYS H H 34 9.380 9.380 8.849 0.531 25342 7720 1 10 . 1 1 35 35 GLU N N 35 122.324 122.324 119.359 2.965 25342 7721 1 10 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.503 -2.170 25342 7722 1 10 . 1 1 35 35 GLU C C 35 172.734 172.734 174.518 -1.784 25342 7723 1 10 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.839 -2.227 25342 7724 1 10 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.619 -4.300 25342 7725 1 10 . 1 1 35 35 GLU H H 35 8.094 8.094 8.628 -0.534 25342 7726 1 10 . 1 1 36 36 VAL N N 36 126.781 126.781 118.003 8.778 25342 7727 1 10 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.870 -1.031 25342 7728 1 10 . 1 1 36 36 VAL C C 36 171.482 171.482 174.458 -2.976 25342 7729 1 10 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.532 -1.127 25342 7730 1 10 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.353 -6.005 25342 7731 1 10 . 1 1 36 36 VAL H H 36 8.660 8.660 8.391 0.269 25342 7732 1 10 . 1 1 37 37 LYS N N 37 126.065 126.065 123.873 2.192 25342 7733 1 10 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.457 0.508 25342 7734 1 10 . 1 1 37 37 LYS C C 37 173.187 173.187 173.920 -0.733 25342 7735 1 10 . 1 1 37 37 LYS CA C 37 52.280 52.280 53.795 -1.515 25342 7736 1 10 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.656 -2.735 25342 7737 1 10 . 1 1 37 37 LYS H H 37 7.809 7.809 9.179 -1.370 25342 7738 1 10 . 1 1 38 38 VAL N N 38 111.020 111.020 114.053 -3.033 25342 7739 1 10 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.305 0.519 25342 7740 1 10 . 1 1 38 38 VAL C C 38 173.604 173.604 175.445 -1.841 25342 7741 1 10 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.070 -2.687 25342 7742 1 10 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.521 -2.145 25342 7743 1 10 . 1 1 38 38 VAL H H 38 8.305 8.305 7.723 0.582 25342 7744 1 10 . 1 1 39 39 SER N N 39 117.887 117.887 114.971 2.916 25342 7745 1 10 . 1 1 39 39 SER HA H 39 4.183 4.183 4.512 -0.329 25342 7746 1 10 . 1 1 39 39 SER C C 39 173.538 173.538 174.333 -0.795 25342 7747 1 10 . 1 1 39 39 SER CA C 39 56.279 56.279 58.232 -1.953 25342 7748 1 10 . 1 1 39 39 SER CB C 39 60.537 60.537 63.763 -3.226 25342 7749 1 10 . 1 1 39 39 SER H H 39 8.847 8.847 8.478 0.369 25342 7750 1 10 . 1 1 40 40 GLU N N 40 126.316 126.316 118.300 8.016 25342 7751 1 10 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.422 -0.268 25342 7752 1 10 . 1 1 40 40 GLU C C 40 174.586 174.586 176.227 -1.641 25342 7753 1 10 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.235 -0.423 25342 7754 1 10 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.758 -3.038 25342 7755 1 10 . 1 1 40 40 GLU H H 40 9.049 9.049 8.548 0.501 25342 7756 1 10 . 1 1 41 41 GLY N N 41 112.494 112.494 109.272 3.222 25342 7757 1 10 . 1 1 41 41 GLY C C 41 171.994 171.994 174.971 -2.977 25342 7758 1 10 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.036 -2.574 25342 7759 1 10 . 1 1 41 41 GLY H H 41 8.780 8.780 7.977 0.803 25342 7760 1 10 . 1 1 42 42 THR N N 42 118.631 118.631 117.269 1.362 25342 7761 1 10 . 1 1 42 42 THR HA H 42 3.582 3.582 3.966 -0.384 25342 7762 1 10 . 1 1 42 42 THR C C 42 171.225 171.225 174.182 -2.957 25342 7763 1 10 . 1 1 42 42 THR CA C 42 64.104 64.104 63.559 0.545 25342 7764 1 10 . 1 1 42 42 THR CB C 42 65.914 65.914 68.786 -2.872 25342 7765 1 10 . 1 1 42 42 THR H H 42 7.737 7.737 7.858 -0.121 25342 7766 1 10 . 1 1 43 43 PHE N N 43 116.279 116.279 116.181 0.098 25342 7767 1 10 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.829 0.191 25342 7768 1 10 . 1 1 43 43 PHE C C 43 170.141 170.141 172.918 -2.777 25342 7769 1 10 . 1 1 43 43 PHE CA C 43 52.472 52.472 55.677 -3.205 25342 7770 1 10 . 1 1 43 43 PHE CB C 43 37.385 37.385 39.640 -2.255 25342 7771 1 10 . 1 1 43 43 PHE H H 43 8.114 8.114 7.046 1.068 25342 7772 1 10 . 1 1 44 44 ASP N N 44 121.513 121.513 119.108 2.405 25342 7773 1 10 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.864 -0.013 25342 7774 1 10 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.381 -2.169 25342 7775 1 10 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.169 0.216 25342 7776 1 10 . 1 1 44 44 ASP H H 44 7.774 7.774 8.546 -0.772 25342 7777 1 10 . 1 1 45 45 ALA N N 45 125.663 125.663 123.040 2.623 25342 7778 1 10 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.690 -0.479 25342 7779 1 10 . 1 1 45 45 ALA C C 45 175.139 175.139 176.869 -1.730 25342 7780 1 10 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.214 -0.778 25342 7781 1 10 . 1 1 45 45 ALA CB C 45 16.232 16.232 18.747 -2.515 25342 7782 1 10 . 1 1 45 45 ALA H H 45 8.324 8.324 8.178 0.146 25342 7783 1 10 . 1 1 46 46 ASP N N 46 119.288 119.288 118.982 0.306 25342 7784 1 10 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.651 0.174 25342 7785 1 10 . 1 1 46 46 ASP C C 46 175.013 175.013 175.744 -0.731 25342 7786 1 10 . 1 1 46 46 ASP CA C 46 51.161 51.161 54.161 -3.000 25342 7787 1 10 . 1 1 46 46 ASP CB C 46 41.233 41.233 41.922 -0.689 25342 7788 1 10 . 1 1 46 46 ASP H H 46 9.618 9.618 8.114 1.504 25342 7789 1 10 . 1 1 47 47 MET N N 47 127.347 127.347 114.624 12.723 25342 7790 1 10 . 1 1 47 47 MET HA H 47 3.456 3.456 4.905 -1.449 25342 7791 1 10 . 1 1 47 47 MET C C 47 173.605 173.605 175.715 -2.110 25342 7792 1 10 . 1 1 47 47 MET CA C 47 56.699 56.699 55.526 1.173 25342 7793 1 10 . 1 1 47 47 MET CB C 47 29.930 29.930 34.653 -4.723 25342 7794 1 10 . 1 1 47 47 MET H H 47 9.178 9.178 7.963 1.215 25342 7795 1 10 . 1 1 48 48 TYR N N 48 121.040 121.040 117.625 3.415 25342 7796 1 10 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.881 -1.009 25342 7797 1 10 . 1 1 48 48 TYR CA C 48 58.712 58.712 58.347 0.365 25342 7798 1 10 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.416 -4.778 25342 7799 1 10 . 1 1 48 48 TYR H H 48 7.881 7.881 8.516 -0.635 25342 7800 1 10 . 1 1 49 49 LYS N N 49 121.754 121.754 121.030 0.724 25342 7801 1 10 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.136 -0.031 25342 7802 1 10 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.583 -3.198 25342 7803 1 10 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.187 -3.023 25342 7804 1 10 . 1 1 49 49 LYS H H 49 8.365 8.365 8.307 0.058 25342 7805 1 10 . 1 1 50 50 THR N N 50 117.557 117.557 110.067 7.490 25342 7806 1 10 . 1 1 50 50 THR HA H 50 3.586 3.586 4.075 -0.489 25342 7807 1 10 . 1 1 50 50 THR CA C 50 65.634 65.634 66.153 -0.518 25342 7808 1 10 . 1 1 50 50 THR CB C 50 65.904 65.904 67.730 -1.826 25342 7809 1 10 . 1 1 50 50 THR H H 50 8.007 8.007 8.590 -0.583 25342 7810 1 10 . 1 1 51 51 SER N N 51 115.110 115.110 117.415 -2.305 25342 7811 1 10 . 1 1 51 51 SER HA H 51 3.974 3.974 4.339 -0.365 25342 7812 1 10 . 1 1 51 51 SER CA C 51 59.042 59.042 61.598 -2.556 25342 7813 1 10 . 1 1 51 51 SER CB C 51 59.835 59.835 62.666 -2.832 25342 7814 1 10 . 1 1 51 51 SER H H 51 7.606 7.606 8.523 -0.917 25342 7815 1 10 . 1 1 52 52 ASP N N 52 119.713 119.713 122.420 -2.707 25342 7816 1 10 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.523 -0.215 25342 7817 1 10 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.352 -2.826 25342 7818 1 10 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.924 -3.236 25342 7819 1 10 . 1 1 52 52 ASP H H 52 7.552 7.552 7.763 -0.210 25342 7820 1 10 . 1 1 53 53 ILE N N 53 121.982 121.982 120.599 1.383 25342 7821 1 10 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.553 0.169 25342 7822 1 10 . 1 1 53 53 ILE C C 53 175.325 175.325 177.906 -2.581 25342 7823 1 10 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.651 -3.107 25342 7824 1 10 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.895 -1.196 25342 7825 1 10 . 1 1 53 53 ILE H H 53 7.815 7.815 7.782 0.033 25342 7826 1 10 . 1 1 54 54 ALA N N 54 121.552 121.552 121.009 0.543 25342 7827 1 10 . 1 1 54 54 ALA HA H 54 4.317 4.317 3.841 0.476 25342 7828 1 10 . 1 1 54 54 ALA C C 54 177.475 177.475 178.801 -1.326 25342 7829 1 10 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.783 -2.761 25342 7830 1 10 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.371 -2.387 25342 7831 1 10 . 1 1 54 54 ALA H H 54 8.332 8.332 7.832 0.500 25342 7832 1 10 . 1 1 55 55 LEU N N 55 117.176 117.176 118.848 -1.672 25342 7833 1 10 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.982 -0.048 25342 7834 1 10 . 1 1 55 55 LEU C C 55 176.532 176.532 178.290 -1.758 25342 7835 1 10 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.760 -2.429 25342 7836 1 10 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.550 -3.122 25342 7837 1 10 . 1 1 55 55 LEU H H 55 8.195 8.195 7.717 0.478 25342 7838 1 10 . 1 1 56 56 ASP N N 56 120.056 120.056 119.414 0.642 25342 7839 1 10 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.297 0.170 25342 7840 1 10 . 1 1 56 56 ASP C C 56 176.585 176.585 178.450 -1.865 25342 7841 1 10 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.400 -2.850 25342 7842 1 10 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.958 -2.653 25342 7843 1 10 . 1 1 56 56 ASP H H 56 7.806 7.806 8.501 -0.695 25342 7844 1 10 . 1 1 57 57 GLN N N 57 120.020 120.020 116.177 3.843 25342 7845 1 10 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.191 -0.068 25342 7846 1 10 . 1 1 57 57 GLN C C 57 175.689 175.689 176.555 -0.866 25342 7847 1 10 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.472 -2.067 25342 7848 1 10 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.510 -4.741 25342 7849 1 10 . 1 1 57 57 GLN H H 57 7.661 7.661 7.830 -0.169 25342 7850 1 10 . 1 1 58 58 ILE N N 58 120.644 120.644 119.046 1.598 25342 7851 1 10 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.125 -0.549 25342 7852 1 10 . 1 1 58 58 ILE C C 58 176.237 176.237 177.128 -0.891 25342 7853 1 10 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.139 0.367 25342 7854 1 10 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.160 -3.131 25342 7855 1 10 . 1 1 58 58 ILE H H 58 8.228 8.228 7.338 0.890 25342 7856 1 10 . 1 1 59 59 GLN N N 59 115.498 115.498 118.236 -2.738 25342 7857 1 10 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.210 -0.068 25342 7858 1 10 . 1 1 59 59 GLN C C 59 173.781 173.781 177.253 -3.472 25342 7859 1 10 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.571 -3.589 25342 7860 1 10 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.413 -2.801 25342 7861 1 10 . 1 1 59 59 GLN H H 59 8.331 8.331 8.200 0.131 25342 7862 1 10 . 1 1 60 60 GLY N N 60 106.623 106.623 105.691 0.932 25342 7863 1 10 . 1 1 60 60 GLY C C 60 172.068 172.068 175.319 -3.251 25342 7864 1 10 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.416 -2.543 25342 7865 1 10 . 1 1 60 60 GLY H H 60 7.611 7.611 8.393 -0.782 25342 7866 1 10 . 1 1 61 61 ASN N N 61 117.691 117.691 118.678 -0.987 25342 7867 1 10 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.634 -0.090 25342 7868 1 10 . 1 1 61 61 ASN C C 61 171.946 171.946 175.910 -3.964 25342 7869 1 10 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.648 -3.079 25342 7870 1 10 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.871 -2.511 25342 7871 1 10 . 1 1 61 61 ASN H H 61 8.151 8.151 8.405 -0.254 25342 7872 1 10 . 1 1 62 62 LYS N N 62 118.289 118.289 118.384 -0.095 25342 7873 1 10 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.558 -0.230 25342 7874 1 10 . 1 1 62 62 LYS C C 62 171.773 171.773 174.709 -2.936 25342 7875 1 10 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.059 -2.764 25342 7876 1 10 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.007 -0.324 25342 7877 1 10 . 1 1 62 62 LYS H H 62 7.242 7.242 7.569 -0.327 25342 7878 1 10 . 1 1 63 63 ASP N N 63 119.888 119.888 119.680 0.208 25342 7879 1 10 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.525 -0.109 25342 7880 1 10 . 1 1 63 63 ASP C C 63 174.476 174.476 176.960 -2.484 25342 7881 1 10 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.114 -1.653 25342 7882 1 10 . 1 1 63 63 ASP CB C 63 38.515 38.515 42.097 -3.582 25342 7883 1 10 . 1 1 63 63 ASP H H 63 8.230 8.230 8.246 -0.016 25342 7884 1 10 . 1 1 64 64 PHE N N 64 119.789 119.789 117.694 2.095 25342 7885 1 10 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.683 -0.867 25342 7886 1 10 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.980 1.270 25342 7887 1 10 . 1 1 64 64 PHE CB C 64 35.034 35.034 37.941 -2.907 25342 7888 1 10 . 1 1 64 64 PHE H H 64 8.428 8.428 7.675 0.753 25342 7889 1 10 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.501 -0.188 25342 7890 1 10 . 1 1 65 65 PRO C C 65 173.975 173.975 175.405 -1.430 25342 7891 1 10 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.479 -2.423 25342 7892 1 10 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.619 -3.099 25342 7893 1 10 . 1 1 66 66 GLU N N 66 121.326 121.326 117.469 3.857 25342 7894 1 10 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.751 -0.518 25342 7895 1 10 . 1 1 66 66 GLU C C 66 173.978 173.978 175.466 -1.488 25342 7896 1 10 . 1 1 66 66 GLU CA C 66 53.531 53.531 54.807 -1.276 25342 7897 1 10 . 1 1 66 66 GLU CB C 66 27.700 27.700 32.598 -4.898 25342 7898 1 10 . 1 1 66 66 GLU H H 66 8.225 8.225 8.359 -0.134 25342 7899 1 10 . 1 1 67 67 ILE N N 67 113.897 113.897 113.325 0.572 25342 7900 1 10 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.726 0.443 25342 7901 1 10 . 1 1 67 67 ILE C C 67 172.791 172.791 174.746 -1.955 25342 7902 1 10 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.100 -2.825 25342 7903 1 10 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.492 -2.476 25342 7904 1 10 . 1 1 67 67 ILE H H 67 8.366 8.366 8.021 0.345 25342 7905 1 10 . 1 1 68 68 GLN N N 68 121.654 121.654 122.334 -0.680 25342 7906 1 10 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.680 -0.161 25342 7907 1 10 . 1 1 68 68 GLN C C 68 171.562 171.562 174.321 -2.759 25342 7908 1 10 . 1 1 68 68 GLN CA C 68 52.313 52.313 55.086 -2.773 25342 7909 1 10 . 1 1 68 68 GLN CB C 68 26.785 26.785 30.640 -3.855 25342 7910 1 10 . 1 1 68 68 GLN H H 68 8.763 8.763 8.568 0.195 25342 7911 1 10 . 1 1 69 69 LEU N N 69 125.289 125.289 119.892 5.397 25342 7912 1 10 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.715 -0.196 25342 7913 1 10 . 1 1 69 69 LEU C C 69 172.567 172.567 175.964 -3.397 25342 7914 1 10 . 1 1 69 69 LEU CA C 69 51.797 51.797 53.561 -1.764 25342 7915 1 10 . 1 1 69 69 LEU CB C 69 42.742 42.742 43.101 -0.359 25342 7916 1 10 . 1 1 69 69 LEU H H 69 7.996 7.996 8.315 -0.319 25342 7917 1 10 . 1 1 70 70 ASP N N 70 123.170 123.170 120.506 2.664 25342 7918 1 10 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.698 -0.292 25342 7919 1 10 . 1 1 70 70 ASP C C 70 171.978 171.978 175.148 -3.170 25342 7920 1 10 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.393 -2.711 25342 7921 1 10 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.569 -2.840 25342 7922 1 10 . 1 1 70 70 ASP H H 70 8.278 8.278 8.588 -0.310 25342 7923 1 10 . 1 1 71 71 ASN N N 71 117.524 117.524 118.859 -1.335 25342 7924 1 10 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.641 -0.314 25342 7925 1 10 . 1 1 71 71 ASN C C 71 171.825 171.825 174.362 -2.537 25342 7926 1 10 . 1 1 71 71 ASN CA C 71 51.657 51.657 52.934 -1.277 25342 7927 1 10 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.908 -3.678 25342 7928 1 10 . 1 1 71 71 ASN H H 71 8.372 8.372 8.432 -0.060 25342 7929 1 10 . 1 1 72 72 ILE N N 72 124.515 124.515 121.070 3.445 25342 7930 1 10 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.275 -0.346 25342 7931 1 10 . 1 1 72 72 ILE C C 72 171.607 171.607 174.273 -2.666 25342 7932 1 10 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.748 -2.459 25342 7933 1 10 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.312 -2.552 25342 7934 1 10 . 1 1 72 72 ILE H H 72 7.653 7.653 7.912 -0.259 25342 7935 1 10 . 1 1 73 73 ASP N N 73 125.182 125.182 123.981 1.201 25342 7936 1 10 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.646 -0.018 25342 7937 1 10 . 1 1 73 73 ASP C C 73 173.980 173.980 176.317 -2.337 25342 7938 1 10 . 1 1 73 73 ASP CA C 73 49.214 49.214 52.592 -3.378 25342 7939 1 10 . 1 1 73 73 ASP CB C 73 36.902 36.902 38.997 -2.095 25342 7940 1 10 . 1 1 73 73 ASP H H 73 8.382 8.382 8.838 -0.456 25342 7941 1 10 . 1 1 74 74 TYR N N 74 123.092 123.092 122.091 1.001 25342 7942 1 10 . 1 1 74 74 TYR HA H 74 3.865 3.865 3.844 0.021 25342 7943 1 10 . 1 1 74 74 TYR C C 74 173.582 173.582 177.587 -4.005 25342 7944 1 10 . 1 1 74 74 TYR CA C 74 59.486 59.486 58.110 1.376 25342 7945 1 10 . 1 1 74 74 TYR CB C 74 34.808 34.808 36.455 -1.647 25342 7946 1 10 . 1 1 74 74 TYR H H 74 7.348 7.348 7.254 0.094 25342 7947 1 10 . 1 1 75 75 ASN N N 75 109.447 109.447 117.474 -8.027 25342 7948 1 10 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.610 0.315 25342 7949 1 10 . 1 1 75 75 ASN C C 75 172.570 172.570 176.331 -3.761 25342 7950 1 10 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.937 -3.319 25342 7951 1 10 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.367 -2.833 25342 7952 1 10 . 1 1 75 75 ASN H H 75 8.040 8.040 8.171 -0.131 25342 7953 1 10 . 1 1 76 76 ASN N N 76 117.411 117.411 116.338 1.073 25342 7954 1 10 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.708 -0.254 25342 7955 1 10 . 1 1 76 76 ASN C C 76 171.155 171.155 174.730 -3.575 25342 7956 1 10 . 1 1 76 76 ASN CA C 76 50.934 50.934 54.049 -3.115 25342 7957 1 10 . 1 1 76 76 ASN CB C 76 35.658 35.658 39.153 -3.495 25342 7958 1 10 . 1 1 76 76 ASN H H 76 7.750 7.750 7.897 -0.147 25342 7959 1 10 . 1 1 77 77 TYR N N 77 116.878 116.878 120.013 -3.135 25342 7960 1 10 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.595 -0.241 25342 7961 1 10 . 1 1 77 77 TYR C C 77 172.224 172.224 174.839 -2.615 25342 7962 1 10 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.529 -2.289 25342 7963 1 10 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.182 -2.069 25342 7964 1 10 . 1 1 77 77 TYR H H 77 7.789 7.789 7.464 0.325 25342 7965 1 10 . 1 1 78 78 ASP N N 78 121.352 121.352 123.954 -2.602 25342 7966 1 10 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.455 0.342 25342 7967 1 10 . 1 1 78 78 ASP C C 78 172.623 172.623 175.523 -2.900 25342 7968 1 10 . 1 1 78 78 ASP CA C 78 53.190 53.190 57.126 -3.936 25342 7969 1 10 . 1 1 78 78 ASP CB C 78 41.035 41.035 41.569 -0.534 25342 7970 1 10 . 1 1 78 78 ASP H H 78 9.036 9.036 8.881 0.155 25342 7971 1 10 . 1 1 79 79 LEU N N 79 123.073 123.073 115.232 7.841 25342 7972 1 10 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.021 0.087 25342 7973 1 10 . 1 1 79 79 LEU C C 79 170.730 170.730 174.395 -3.665 25342 7974 1 10 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.796 -2.539 25342 7975 1 10 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.090 -3.807 25342 7976 1 10 . 1 1 79 79 LEU H H 79 7.877 7.877 7.379 0.498 25342 7977 1 10 . 1 1 80 80 ILE N N 80 126.348 126.348 122.668 3.680 25342 7978 1 10 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.815 0.254 25342 7979 1 10 . 1 1 80 80 ILE C C 80 171.584 171.584 174.827 -3.243 25342 7980 1 10 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.008 -2.593 25342 7981 1 10 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.161 -2.163 25342 7982 1 10 . 1 1 80 80 ILE H H 80 8.704 8.704 8.635 0.069 25342 7983 1 10 . 1 1 81 81 LEU N N 81 126.303 126.303 127.932 -1.629 25342 7984 1 10 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.968 0.155 25342 7985 1 10 . 1 1 81 81 LEU C C 81 172.779 172.779 175.784 -3.005 25342 7986 1 10 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.315 -4.806 25342 7987 1 10 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.512 -1.797 25342 7988 1 10 . 1 1 81 81 LEU H H 81 9.202 9.202 8.950 0.252 25342 7989 1 10 . 1 1 82 82 ILE N N 82 120.931 120.931 121.302 -0.371 25342 7990 1 10 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.761 0.086 25342 7991 1 10 . 1 1 82 82 ILE C C 82 172.796 172.796 174.155 -1.359 25342 7992 1 10 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.903 -3.022 25342 7993 1 10 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.625 -4.828 25342 7994 1 10 . 1 1 82 82 ILE H H 82 8.846 8.846 9.025 -0.179 25342 7995 1 10 . 1 1 83 83 GLY N N 83 120.905 120.905 111.272 9.633 25342 7996 1 10 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.884 -2.327 25342 7997 1 10 . 1 1 83 83 GLY H H 83 9.558 9.558 7.921 1.637 25342 7998 1 10 . 1 1 84 84 SER N N 84 116.601 116.601 117.136 -0.535 25342 7999 1 10 . 1 1 84 84 SER HA H 84 5.476 5.476 5.115 0.361 25342 8000 1 10 . 1 1 84 84 SER CA C 84 51.324 51.324 54.782 -3.458 25342 8001 1 10 . 1 1 84 84 SER CB C 84 64.271 64.271 64.806 -0.535 25342 8002 1 10 . 1 1 84 84 SER H H 84 7.533 7.533 7.532 0.001 25342 8003 1 10 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.554 0.609 25342 8004 1 10 . 1 1 85 85 PRO C C 85 175.590 175.590 176.419 -0.829 25342 8005 1 10 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.556 -3.673 25342 8006 1 10 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.767 -2.293 25342 8007 1 10 . 1 1 86 86 VAL N N 86 116.295 116.295 117.953 -1.658 25342 8008 1 10 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.540 -0.719 25342 8009 1 10 . 1 1 86 86 VAL C C 86 172.692 172.692 175.438 -2.746 25342 8010 1 10 . 1 1 86 86 VAL CA C 86 59.812 59.812 60.775 -0.963 25342 8011 1 10 . 1 1 86 86 VAL CB C 86 30.083 30.083 33.939 -3.856 25342 8012 1 10 . 1 1 86 86 VAL H H 86 7.246 7.246 7.737 -0.491 25342 8013 1 10 . 1 1 87 87 TRP N N 87 131.042 131.042 125.014 6.028 25342 8014 1 10 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.766 -0.455 25342 8015 1 10 . 1 1 87 87 TRP C C 87 173.323 173.323 176.119 -2.796 25342 8016 1 10 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.989 -5.102 25342 8017 1 10 . 1 1 87 87 TRP CB C 87 27.310 27.310 33.270 -5.960 25342 8018 1 10 . 1 1 87 87 TRP H H 87 9.555 9.555 8.867 0.688 25342 8019 1 10 . 1 1 88 88 SER N N 88 122.660 122.660 117.027 5.633 25342 8020 1 10 . 1 1 88 88 SER HA H 88 4.582 4.582 4.237 0.345 25342 8021 1 10 . 1 1 88 88 SER C C 88 172.096 172.096 175.482 -3.386 25342 8022 1 10 . 1 1 88 88 SER CA C 88 55.391 55.391 60.443 -5.052 25342 8023 1 10 . 1 1 88 88 SER CB C 88 57.813 57.813 61.858 -4.045 25342 8024 1 10 . 1 1 88 88 SER H H 88 10.257 10.257 9.035 1.222 25342 8025 1 10 . 1 1 89 89 GLY N N 89 128.381 128.381 113.212 15.169 25342 8026 1 10 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.988 -3.359 25342 8027 1 10 . 1 1 89 89 GLY H H 89 6.372 6.372 8.593 -2.221 25342 8028 1 10 . 1 1 90 90 TYR N N 90 120.345 120.345 116.469 3.876 25342 8029 1 10 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.036 -0.847 25342 8030 1 10 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.052 0.497 25342 8031 1 10 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.487 -0.292 25342 8032 1 10 . 1 1 90 90 TYR H H 90 8.113 8.113 7.437 0.676 25342 8033 1 10 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.771 0.063 25342 8034 1 10 . 1 1 91 91 PRO C C 91 170.911 170.911 177.313 -6.402 25342 8035 1 10 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.504 -3.669 25342 8036 1 10 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.718 -6.647 25342 8037 1 10 . 1 1 92 92 ALA N N 92 120.629 120.629 124.706 -4.077 25342 8038 1 10 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.818 -0.199 25342 8039 1 10 . 1 1 92 92 ALA C C 92 176.782 176.782 176.904 -0.122 25342 8040 1 10 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.052 -1.635 25342 8041 1 10 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.940 -1.424 25342 8042 1 10 . 1 1 92 92 ALA H H 92 7.554 7.554 8.798 -1.244 25342 8043 1 10 . 1 1 93 93 THR N N 93 112.558 112.558 109.968 2.590 25342 8044 1 10 . 1 1 93 93 THR CB C 93 64.173 64.173 67.270 -3.097 25342 8045 1 10 . 1 1 93 93 THR H H 93 6.730 6.730 7.822 -1.092 25342 8046 1 10 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.587 -0.728 25342 8047 1 10 . 1 1 94 94 PRO C C 94 173.309 173.309 176.482 -3.173 25342 8048 1 10 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.377 -1.314 25342 8049 1 10 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.043 -2.764 25342 8050 1 10 . 1 1 95 95 ILE N N 95 111.014 111.014 116.740 -5.726 25342 8051 1 10 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.454 -0.849 25342 8052 1 10 . 1 1 95 95 ILE C C 95 174.302 174.302 176.971 -2.669 25342 8053 1 10 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.391 -2.210 25342 8054 1 10 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.601 -4.818 25342 8055 1 10 . 1 1 95 95 ILE H H 95 7.995 7.995 8.051 -0.056 25342 8056 1 10 . 1 1 96 96 LYS N N 96 123.208 123.208 122.872 0.336 25342 8057 1 10 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.036 -0.944 25342 8058 1 10 . 1 1 96 96 LYS C C 96 174.451 174.451 178.199 -3.748 25342 8059 1 10 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.563 -2.522 25342 8060 1 10 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.859 -3.112 25342 8061 1 10 . 1 1 96 96 LYS H H 96 6.928 6.928 7.508 -0.580 25342 8062 1 10 . 1 1 97 97 THR N N 97 113.320 113.320 114.484 -1.164 25342 8063 1 10 . 1 1 97 97 THR HA H 97 3.436 3.436 4.121 -0.685 25342 8064 1 10 . 1 1 97 97 THR C C 97 173.221 173.221 176.645 -3.424 25342 8065 1 10 . 1 1 97 97 THR CA C 97 62.710 62.710 65.847 -3.137 25342 8066 1 10 . 1 1 97 97 THR CB C 97 65.562 65.562 68.351 -2.789 25342 8067 1 10 . 1 1 97 97 THR H H 97 6.325 6.325 8.289 -1.964 25342 8068 1 10 . 1 1 98 98 LEU N N 98 120.963 120.963 121.656 -0.693 25342 8069 1 10 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.093 -0.468 25342 8070 1 10 . 1 1 98 98 LEU C C 98 174.713 174.713 178.838 -4.125 25342 8071 1 10 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.662 -2.148 25342 8072 1 10 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.906 -2.178 25342 8073 1 10 . 1 1 98 98 LEU H H 98 7.536 7.536 7.767 -0.231 25342 8074 1 10 . 1 1 99 99 LEU N N 99 118.859 118.859 117.646 1.213 25342 8075 1 10 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.970 -0.298 25342 8076 1 10 . 1 1 99 99 LEU C C 99 177.458 177.458 178.066 -0.608 25342 8077 1 10 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.670 -3.525 25342 8078 1 10 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.265 -2.408 25342 8079 1 10 . 1 1 99 99 LEU H H 99 8.179 8.179 8.074 0.105 25342 8080 1 10 . 1 1 100 100 ASP N N 100 118.703 118.703 117.479 1.224 25342 8081 1 10 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.312 -0.091 25342 8082 1 10 . 1 1 100 100 ASP C C 100 176.472 176.472 179.081 -2.609 25342 8083 1 10 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.472 -3.165 25342 8084 1 10 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.477 -3.119 25342 8085 1 10 . 1 1 100 100 ASP H H 100 7.867 7.867 8.111 -0.244 25342 8086 1 10 . 1 1 101 101 GLN N N 101 117.829 117.829 119.487 -1.658 25342 8087 1 10 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.116 0.084 25342 8088 1 10 . 1 1 101 101 GLN C C 101 174.508 174.508 178.615 -4.107 25342 8089 1 10 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.453 -3.765 25342 8090 1 10 . 1 1 101 101 GLN CB C 101 25.597 25.597 28.920 -3.323 25342 8091 1 10 . 1 1 101 101 GLN H H 101 7.597 7.597 7.685 -0.088 25342 8092 1 10 . 1 1 102 102 MET N N 102 118.406 118.406 117.544 0.862 25342 8093 1 10 . 1 1 102 102 MET HA H 102 3.864 3.864 4.714 -0.850 25342 8094 1 10 . 1 1 102 102 MET C C 102 172.820 172.820 177.464 -4.644 25342 8095 1 10 . 1 1 102 102 MET CA C 102 53.298 53.298 57.958 -4.660 25342 8096 1 10 . 1 1 102 102 MET CB C 102 31.207 31.207 32.411 -1.204 25342 8097 1 10 . 1 1 102 102 MET H H 102 7.434 7.434 8.545 -1.111 25342 8098 1 10 . 1 1 103 103 LYS N N 103 115.889 115.889 119.836 -3.947 25342 8099 1 10 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.963 -0.044 25342 8100 1 10 . 1 1 103 103 LYS C C 103 173.938 173.938 177.318 -3.380 25342 8101 1 10 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.544 -2.107 25342 8102 1 10 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.718 -2.455 25342 8103 1 10 . 1 1 103 103 LYS H H 103 6.881 6.881 7.492 -0.611 25342 8104 1 10 . 1 1 104 104 ASN N N 104 114.951 114.951 115.022 -0.071 25342 8105 1 10 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.420 0.311 25342 8106 1 10 . 1 1 104 104 ASN C C 104 172.617 172.617 175.622 -3.005 25342 8107 1 10 . 1 1 104 104 ASN CA C 104 50.266 50.266 54.487 -4.221 25342 8108 1 10 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.624 -2.841 25342 8109 1 10 . 1 1 104 104 ASN H H 104 8.493 8.493 7.347 1.146 25342 8110 1 10 . 1 1 105 105 TYR N N 105 122.680 122.680 119.155 3.525 25342 8111 1 10 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.711 -0.149 25342 8112 1 10 . 1 1 105 105 TYR CA C 105 55.433 55.433 56.848 -1.415 25342 8113 1 10 . 1 1 105 105 TYR CB C 105 35.832 35.832 40.340 -4.508 25342 8114 1 10 . 1 1 105 105 TYR H H 105 8.217 8.217 7.667 0.550 25342 8115 1 10 . 1 1 106 106 ARG N N 106 128.872 128.872 122.851 6.021 25342 8116 1 10 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.754 -0.489 25342 8117 1 10 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.625 -2.643 25342 8118 1 10 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.038 -2.908 25342 8119 1 10 . 1 1 106 106 ARG H H 106 8.801 8.801 8.975 -0.174 25342 8120 1 10 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.988 -2.587 25342 8121 1 10 . 1 1 108 108 GLU N N 108 117.000 117.000 119.549 -2.549 25342 8122 1 10 . 1 1 108 108 GLU HA H 108 4.626 4.626 5.073 -0.447 25342 8123 1 10 . 1 1 108 108 GLU C C 108 174.125 174.125 176.040 -1.915 25342 8124 1 10 . 1 1 108 108 GLU CA C 108 53.788 53.788 54.895 -1.107 25342 8125 1 10 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.573 -1.133 25342 8126 1 10 . 1 1 108 108 GLU H H 108 7.514 7.514 8.048 -0.534 25342 8127 1 10 . 1 1 109 109 VAL N N 109 123.398 123.398 121.328 2.070 25342 8128 1 10 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.738 0.599 25342 8129 1 10 . 1 1 109 109 VAL C C 109 170.606 170.606 174.128 -3.522 25342 8130 1 10 . 1 1 109 109 VAL CA C 109 57.280 57.280 61.455 -4.175 25342 8131 1 10 . 1 1 109 109 VAL CB C 109 32.657 32.657 33.428 -0.770 25342 8132 1 10 . 1 1 109 109 VAL H H 109 8.942 8.942 8.272 0.670 25342 8133 1 10 . 1 1 110 110 ALA N N 110 127.905 127.905 129.673 -1.768 25342 8134 1 10 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.762 -0.135 25342 8135 1 10 . 1 1 110 110 ALA C C 110 173.195 173.195 175.579 -2.384 25342 8136 1 10 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.434 -2.088 25342 8137 1 10 . 1 1 110 110 ALA CB C 110 18.325 18.325 21.720 -3.395 25342 8138 1 10 . 1 1 110 110 ALA H H 110 8.776 8.776 8.271 0.505 25342 8139 1 10 . 1 1 111 111 SER N N 111 110.523 110.523 116.122 -5.599 25342 8140 1 10 . 1 1 111 111 SER HA H 111 5.562 5.562 5.450 0.112 25342 8141 1 10 . 1 1 111 111 SER C C 111 170.719 170.719 173.968 -3.249 25342 8142 1 10 . 1 1 111 111 SER CA C 111 51.314 51.314 56.032 -4.718 25342 8143 1 10 . 1 1 111 111 SER CB C 111 61.907 61.907 63.916 -2.009 25342 8144 1 10 . 1 1 111 111 SER H H 111 7.480 7.480 8.117 -0.637 25342 8145 1 10 . 1 1 112 112 PHE N N 112 125.567 125.567 122.005 3.562 25342 8146 1 10 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.349 1.007 25342 8147 1 10 . 1 1 112 112 PHE C C 112 169.536 169.536 173.720 -4.184 25342 8148 1 10 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.923 -5.552 25342 8149 1 10 . 1 1 112 112 PHE CB C 112 39.788 39.788 41.199 -1.411 25342 8150 1 10 . 1 1 112 112 PHE H H 112 7.848 7.848 8.449 -0.601 25342 8151 1 10 . 1 1 113 113 PHE N N 113 115.065 115.065 116.056 -0.991 25342 8152 1 10 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.662 0.442 25342 8153 1 10 . 1 1 113 113 PHE C C 113 173.006 173.006 175.340 -2.334 25342 8154 1 10 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.487 -6.225 25342 8155 1 10 . 1 1 113 113 PHE CB C 113 38.749 38.749 44.362 -5.613 25342 8156 1 10 . 1 1 113 113 PHE H H 113 7.361 7.361 8.716 -1.355 25342 8157 1 10 . 1 1 114 114 THR N N 114 108.014 108.014 111.553 -3.539 25342 8158 1 10 . 1 1 114 114 THR HA H 114 4.999 4.999 4.883 0.116 25342 8159 1 10 . 1 1 114 114 THR C C 114 169.874 169.874 173.319 -3.445 25342 8160 1 10 . 1 1 114 114 THR CA C 114 56.500 56.500 61.164 -4.664 25342 8161 1 10 . 1 1 114 114 THR CB C 114 68.809 68.809 70.590 -1.781 25342 8162 1 10 . 1 1 114 114 THR H H 114 7.867 7.867 8.499 -0.632 25342 8163 1 10 . 1 1 115 115 SER N N 115 115.049 115.049 120.264 -5.215 25342 8164 1 10 . 1 1 115 115 SER HA H 115 5.613 5.613 4.643 0.970 25342 8165 1 10 . 1 1 115 115 SER C C 115 171.247 171.247 173.515 -2.268 25342 8166 1 10 . 1 1 115 115 SER CA C 115 54.830 54.830 56.776 -1.946 25342 8167 1 10 . 1 1 115 115 SER CB C 115 63.992 63.992 65.143 -1.151 25342 8168 1 10 . 1 1 115 115 SER H H 115 8.970 8.970 8.348 0.622 25342 8169 1 10 . 1 1 116 116 ALA N N 116 122.671 122.671 124.074 -1.403 25342 8170 1 10 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.631 0.354 25342 8171 1 10 . 1 1 116 116 ALA C C 116 176.180 176.180 177.544 -1.364 25342 8172 1 10 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.607 -2.407 25342 8173 1 10 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.488 -2.493 25342 8174 1 10 . 1 1 116 116 ALA H H 116 8.963 8.963 8.577 0.386 25342 8175 1 10 . 1 1 117 117 GLY N N 117 107.387 107.387 110.028 -2.641 25342 8176 1 10 . 1 1 117 117 GLY C C 117 172.528 172.528 174.424 -1.896 25342 8177 1 10 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.253 -1.521 25342 8178 1 10 . 1 1 117 117 GLY H H 117 9.340 9.340 8.492 0.848 25342 8179 1 10 . 1 1 118 118 THR N N 118 113.481 113.481 112.811 0.670 25342 8180 1 10 . 1 1 118 118 THR HA H 118 4.651 4.651 4.658 -0.007 25342 8181 1 10 . 1 1 118 118 THR C C 118 172.067 172.067 173.730 -1.663 25342 8182 1 10 . 1 1 118 118 THR CA C 118 57.357 57.357 59.957 -2.600 25342 8183 1 10 . 1 1 118 118 THR CB C 118 69.475 69.475 71.457 -1.982 25342 8184 1 10 . 1 1 118 118 THR H H 118 9.373 9.373 7.476 1.897 25342 8185 1 10 . 1 1 119 119 ASN N N 119 113.202 113.202 116.097 -2.895 25342 8186 1 10 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.056 0.562 25342 8187 1 10 . 1 1 119 119 ASN C C 119 173.114 173.114 175.790 -2.676 25342 8188 1 10 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.161 -2.477 25342 8189 1 10 . 1 1 119 119 ASN CB C 119 33.730 33.730 36.826 -3.096 25342 8190 1 10 . 1 1 119 119 ASN H H 119 8.908 8.908 8.907 0.001 25342 8191 1 10 . 1 1 120 120 HIS N N 120 117.315 117.315 115.675 1.640 25342 8192 1 10 . 1 1 120 120 HIS HA H 120 3.786 3.786 3.776 0.010 25342 8193 1 10 . 1 1 120 120 HIS C C 120 174.381 174.381 176.598 -2.217 25342 8194 1 10 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.762 -4.246 25342 8195 1 10 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.318 -2.814 25342 8196 1 10 . 1 1 120 120 HIS H H 120 8.074 8.074 8.268 -0.194 25342 8197 1 10 . 1 1 121 121 LYS N N 121 118.678 118.678 118.947 -0.269 25342 8198 1 10 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.892 -0.058 25342 8199 1 10 . 1 1 121 121 LYS C C 121 176.564 176.564 178.275 -1.711 25342 8200 1 10 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.691 -1.396 25342 8201 1 10 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.859 -2.917 25342 8202 1 10 . 1 1 121 121 LYS H H 121 8.336 8.336 7.458 0.878 25342 8203 1 10 . 1 1 122 122 ALA N N 122 122.146 122.146 122.355 -0.209 25342 8204 1 10 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.030 -0.335 25342 8205 1 10 . 1 1 122 122 ALA C C 122 175.163 175.163 179.964 -4.801 25342 8206 1 10 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.878 -3.186 25342 8207 1 10 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.842 -2.124 25342 8208 1 10 . 1 1 122 122 ALA H H 122 7.584 7.584 7.284 0.300 25342 8209 1 10 . 1 1 123 123 TYR N N 123 119.730 119.730 117.020 2.710 25342 8210 1 10 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.106 -0.953 25342 8211 1 10 . 1 1 123 123 TYR C C 123 174.340 174.340 178.670 -4.330 25342 8212 1 10 . 1 1 123 123 TYR CA C 123 60.398 60.398 59.310 1.088 25342 8213 1 10 . 1 1 123 123 TYR CB C 123 34.663 34.663 36.948 -2.285 25342 8214 1 10 . 1 1 123 123 TYR H H 123 7.317 7.317 7.656 -0.339 25342 8215 1 10 . 1 1 124 124 VAL N N 124 118.649 118.649 118.194 0.455 25342 8216 1 10 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.717 -0.515 25342 8217 1 10 . 1 1 124 124 VAL C C 124 175.603 175.603 178.437 -2.834 25342 8218 1 10 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.284 -1.604 25342 8219 1 10 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.582 -1.293 25342 8220 1 10 . 1 1 124 124 VAL H H 124 7.799 7.799 7.575 0.224 25342 8221 1 10 . 1 1 125 125 SER N N 125 114.475 114.475 116.119 -1.644 25342 8222 1 10 . 1 1 125 125 SER HA H 125 4.032 4.032 4.152 -0.120 25342 8223 1 10 . 1 1 125 125 SER C C 125 174.849 174.849 176.783 -1.934 25342 8224 1 10 . 1 1 125 125 SER CA C 125 59.002 59.002 62.651 -3.649 25342 8225 1 10 . 1 1 125 125 SER CB C 125 59.613 59.613 62.972 -3.359 25342 8226 1 10 . 1 1 125 125 SER H H 125 7.766 7.766 8.228 -0.462 25342 8227 1 10 . 1 1 126 126 HIS N N 126 119.326 119.326 121.615 -2.289 25342 8228 1 10 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.347 -0.220 25342 8229 1 10 . 1 1 126 126 HIS C C 126 172.865 172.865 177.681 -4.816 25342 8230 1 10 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.911 -4.205 25342 8231 1 10 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.549 -4.556 25342 8232 1 10 . 1 1 126 126 HIS H H 126 8.569 8.569 8.308 0.261 25342 8233 1 10 . 1 1 127 127 PHE N N 127 121.044 121.044 119.833 1.211 25342 8234 1 10 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.358 -1.184 25342 8235 1 10 . 1 1 127 127 PHE C C 127 173.378 173.378 176.236 -2.858 25342 8236 1 10 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.348 -0.481 25342 8237 1 10 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.217 -3.163 25342 8238 1 10 . 1 1 127 127 PHE H H 127 9.139 9.139 8.744 0.395 25342 8239 1 10 . 1 1 128 128 ASN N N 128 114.893 114.893 117.155 -2.262 25342 8240 1 10 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.291 -0.251 25342 8241 1 10 . 1 1 128 128 ASN C C 128 175.230 175.230 177.444 -2.214 25342 8242 1 10 . 1 1 128 128 ASN CA C 128 54.300 54.300 55.974 -1.674 25342 8243 1 10 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.786 -2.615 25342 8244 1 10 . 1 1 128 128 ASN H H 128 7.774 7.774 7.992 -0.218 25342 8245 1 10 . 1 1 129 129 GLU N N 129 119.804 119.804 120.713 -0.909 25342 8246 1 10 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.772 0.268 25342 8247 1 10 . 1 1 129 129 GLU C C 129 177.052 177.052 177.736 -0.684 25342 8248 1 10 . 1 1 129 129 GLU CA C 129 56.730 56.730 59.191 -2.461 25342 8249 1 10 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.411 -2.215 25342 8250 1 10 . 1 1 129 129 GLU H H 129 7.577 7.577 7.340 0.237 25342 8251 1 10 . 1 1 130 130 TRP N N 130 120.979 120.979 116.991 3.988 25342 8252 1 10 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.379 0.078 25342 8253 1 10 . 1 1 130 130 TRP C C 130 174.329 174.329 174.829 -0.500 25342 8254 1 10 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.382 -1.694 25342 8255 1 10 . 1 1 130 130 TRP CB C 130 26.991 26.991 28.122 -1.131 25342 8256 1 10 . 1 1 130 130 TRP H H 130 8.225 8.225 7.278 0.947 25342 8257 1 10 . 1 1 131 131 ALA N N 131 120.450 120.450 119.172 1.278 25342 8258 1 10 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.204 -0.268 25342 8259 1 10 . 1 1 131 131 ALA C C 131 172.487 172.487 175.369 -2.882 25342 8260 1 10 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.520 -3.086 25342 8261 1 10 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.579 -3.291 25342 8262 1 10 . 1 1 131 131 ALA H H 131 8.081 8.081 6.828 1.253 25342 8263 1 10 . 1 1 132 132 ASP N N 132 117.813 117.813 121.413 -3.600 25342 8264 1 10 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.519 -0.311 25342 8265 1 10 . 1 1 132 132 ASP C C 132 173.804 173.804 176.407 -2.603 25342 8266 1 10 . 1 1 132 132 ASP CA C 132 54.181 54.181 54.617 -0.436 25342 8267 1 10 . 1 1 132 132 ASP CB C 132 39.321 39.321 39.813 -0.492 25342 8268 1 10 . 1 1 132 132 ASP H H 132 6.772 6.772 7.463 -0.691 25342 8269 1 10 . 1 1 133 133 GLY N N 133 115.052 115.052 112.156 2.896 25342 8270 1 10 . 1 1 133 133 GLY C C 133 172.078 172.078 174.014 -1.936 25342 8271 1 10 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.909 -2.489 25342 8272 1 10 . 1 1 133 133 GLY H H 133 8.626 8.626 7.909 0.717 25342 8273 1 10 . 1 1 134 134 LEU N N 134 120.063 120.063 123.860 -3.797 25342 8274 1 10 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.512 -0.040 25342 8275 1 10 . 1 1 134 134 LEU C C 134 174.079 174.079 176.656 -2.577 25342 8276 1 10 . 1 1 134 134 LEU CA C 134 50.964 50.964 54.278 -3.314 25342 8277 1 10 . 1 1 134 134 LEU CB C 134 40.370 40.370 42.140 -1.770 25342 8278 1 10 . 1 1 134 134 LEU H H 134 8.094 8.094 7.693 0.401 25342 8279 1 10 . 1 1 135 135 ASN N N 135 119.292 119.292 123.661 -4.369 25342 8280 1 10 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.594 0.029 25342 8281 1 10 . 1 1 135 135 ASN C C 135 170.527 170.527 174.258 -3.731 25342 8282 1 10 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.327 -4.325 25342 8283 1 10 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.054 -4.494 25342 8284 1 10 . 1 1 135 135 ASN H H 135 8.513 8.513 8.731 -0.218 25342 8285 1 10 . 1 1 136 136 VAL N N 136 125.412 125.412 124.520 0.892 25342 8286 1 10 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.555 0.051 25342 8287 1 10 . 1 1 136 136 VAL C C 136 175.420 175.420 175.770 -0.350 25342 8288 1 10 . 1 1 136 136 VAL CA C 136 58.382 58.382 60.438 -2.056 25342 8289 1 10 . 1 1 136 136 VAL CB C 136 29.247 29.247 33.471 -4.224 25342 8290 1 10 . 1 1 136 136 VAL H H 136 7.648 7.648 7.737 -0.089 25342 8291 1 10 . 1 1 137 137 ILE N N 137 121.881 121.881 121.086 0.795 25342 8292 1 10 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.169 0.264 25342 8293 1 10 . 1 1 137 137 ILE C C 137 173.906 173.906 175.221 -1.315 25342 8294 1 10 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.036 -2.058 25342 8295 1 10 . 1 1 137 137 ILE CB C 137 36.196 36.196 37.868 -1.672 25342 8296 1 10 . 1 1 137 137 ILE H H 137 9.139 9.139 8.262 0.877 25342 8297 1 10 . 1 1 138 138 GLY N N 138 108.226 108.226 106.712 1.514 25342 8298 1 10 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.080 -1.689 25342 8299 1 10 . 1 1 138 138 GLY H H 138 6.645 6.645 7.256 -0.611 25342 8300 1 10 . 1 1 139 139 VAL N N 139 119.408 119.408 119.882 -0.474 25342 8301 1 10 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.103 0.254 25342 8302 1 10 . 1 1 139 139 VAL C C 139 172.327 172.327 175.630 -3.303 25342 8303 1 10 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.665 -3.398 25342 8304 1 10 . 1 1 139 139 VAL CB C 139 32.743 32.743 33.175 -0.432 25342 8305 1 10 . 1 1 139 139 VAL H H 139 8.092 8.092 8.533 -0.441 25342 8306 1 10 . 1 1 140 140 ALA N N 140 127.415 127.415 131.948 -4.533 25342 8307 1 10 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.045 -0.600 25342 8308 1 10 . 1 1 140 140 ALA C C 140 170.718 170.718 175.643 -4.925 25342 8309 1 10 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.899 -1.999 25342 8310 1 10 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.141 -1.082 25342 8311 1 10 . 1 1 140 140 ALA H H 140 9.093 9.093 9.233 -0.140 25342 8312 1 10 . 1 1 141 141 ARG N N 141 119.287 119.287 118.152 1.135 25342 8313 1 10 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.013 -2.526 25342 8314 1 10 . 1 1 141 141 ARG C C 141 173.375 173.375 175.391 -2.016 25342 8315 1 10 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.867 -2.983 25342 8316 1 10 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.370 -4.686 25342 8317 1 10 . 1 1 141 141 ARG H H 141 7.620 7.620 8.451 -0.831 25342 8318 1 10 . 1 1 142 142 ASP N N 142 125.999 125.999 120.372 5.627 25342 8319 1 10 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.284 -0.560 25342 8320 1 10 . 1 1 142 142 ASP C C 142 169.292 169.292 176.360 -7.068 25342 8321 1 10 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.540 -3.202 25342 8322 1 10 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.370 -3.693 25342 8323 1 10 . 1 1 142 142 ASP H H 142 9.482 9.482 9.303 0.179 25342 8324 1 10 . 1 1 143 143 ASP N N 143 119.293 119.293 119.829 -0.536 25342 8325 1 10 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.257 0.049 25342 8326 1 10 . 1 1 143 143 ASP C C 143 175.686 175.686 177.508 -1.822 25342 8327 1 10 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.595 -5.690 25342 8328 1 10 . 1 1 143 143 ASP CB C 143 36.312 36.312 39.911 -3.599 25342 8329 1 10 . 1 1 143 143 ASP H H 143 8.108 8.108 8.454 -0.346 25342 8330 1 10 . 1 1 144 144 SER N N 144 115.303 115.303 117.188 -1.885 25342 8331 1 10 . 1 1 144 144 SER HA H 144 3.740 3.740 4.065 -0.325 25342 8332 1 10 . 1 1 144 144 SER C C 144 172.925 172.925 175.184 -2.259 25342 8333 1 10 . 1 1 144 144 SER CA C 144 59.213 59.213 61.127 -1.914 25342 8334 1 10 . 1 1 144 144 SER CB C 144 60.806 60.806 63.034 -2.228 25342 8335 1 10 . 1 1 144 144 SER H H 144 7.642 7.642 7.749 -0.107 25342 8336 1 10 . 1 1 145 145 GLU N N 145 119.523 119.523 117.519 2.004 25342 8337 1 10 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.220 0.086 25342 8338 1 10 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.396 -3.357 25342 8339 1 10 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.334 -2.534 25342 8340 1 10 . 1 1 145 145 GLU H H 145 7.771 7.771 7.906 -0.135 25342 8341 1 10 . 1 1 146 146 VAL N N 146 118.683 118.683 120.929 -2.246 25342 8342 1 10 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.587 -0.646 25342 8343 1 10 . 1 1 146 146 VAL C C 146 174.591 174.591 175.754 -1.163 25342 8344 1 10 . 1 1 146 146 VAL CA C 146 63.932 63.932 65.731 -1.799 25342 8345 1 10 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.850 -2.803 25342 8346 1 10 . 1 1 146 146 VAL H H 146 6.352 6.352 7.160 -0.808 25342 8347 1 10 . 1 1 147 147 ASP N N 147 119.312 119.312 116.309 3.003 25342 8348 1 10 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.360 -0.305 25342 8349 1 10 . 1 1 147 147 ASP C C 147 174.783 174.783 177.649 -2.866 25342 8350 1 10 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.666 -2.425 25342 8351 1 10 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.964 -3.731 25342 8352 1 10 . 1 1 147 147 ASP H H 147 8.370 8.370 8.556 -0.186 25342 8353 1 10 . 1 1 148 148 LYS N N 148 119.342 119.342 116.750 2.592 25342 8354 1 10 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.484 -0.547 25342 8355 1 10 . 1 1 148 148 LYS C C 148 176.384 176.384 178.810 -2.426 25342 8356 1 10 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.321 -1.615 25342 8357 1 10 . 1 1 148 148 LYS CB C 148 29.511 29.511 33.092 -3.581 25342 8358 1 10 . 1 1 148 148 LYS H H 148 7.040 7.040 7.613 -0.573 25342 8359 1 10 . 1 1 149 149 TRP N N 149 118.258 118.258 120.574 -2.316 25342 8360 1 10 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.801 -0.210 25342 8361 1 10 . 1 1 149 149 TRP C C 149 174.212 174.212 175.887 -1.675 25342 8362 1 10 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.968 -2.223 25342 8363 1 10 . 1 1 149 149 TRP CB C 149 26.940 26.940 27.369 -0.429 25342 8364 1 10 . 1 1 149 149 TRP H H 149 7.811 7.811 8.484 -0.673 25342 8365 1 10 . 1 1 150 150 SER N N 150 109.618 109.618 112.407 -2.789 25342 8366 1 10 . 1 1 150 150 SER HA H 150 4.234 4.234 4.665 -0.431 25342 8367 1 10 . 1 1 150 150 SER C C 150 170.189 170.189 174.509 -4.320 25342 8368 1 10 . 1 1 150 150 SER CA C 150 56.695 56.695 57.499 -0.804 25342 8369 1 10 . 1 1 150 150 SER CB C 150 61.935 61.935 64.028 -2.093 25342 8370 1 10 . 1 1 150 150 SER H H 150 7.793 7.793 7.493 0.300 25342 8371 1 11 . 1 1 3 3 ALA N N 3 125.638 125.638 126.367 -0.729 25342 8372 1 11 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.559 -0.194 25342 8373 1 11 . 1 1 3 3 ALA CA C 3 49.298 49.298 51.788 -2.490 25342 8374 1 11 . 1 1 3 3 ALA CB C 3 16.859 16.859 18.604 -1.745 25342 8375 1 11 . 1 1 3 3 ALA H H 3 8.325 8.325 8.291 0.034 25342 8376 1 11 . 1 1 4 4 LYS N N 4 121.813 121.813 119.278 2.535 25342 8377 1 11 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.596 -0.369 25342 8378 1 11 . 1 1 4 4 LYS C C 4 174.574 174.574 176.313 -1.739 25342 8379 1 11 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.804 -2.023 25342 8380 1 11 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.368 -0.878 25342 8381 1 11 . 1 1 4 4 LYS H H 4 8.486 8.486 7.985 0.501 25342 8382 1 11 . 1 1 5 5 LYS N N 5 129.722 129.722 120.742 8.980 25342 8383 1 11 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.290 0.228 25342 8384 1 11 . 1 1 5 5 LYS C C 5 174.720 174.720 175.780 -1.060 25342 8385 1 11 . 1 1 5 5 LYS CA C 5 54.722 54.722 57.038 -2.316 25342 8386 1 11 . 1 1 5 5 LYS CB C 5 29.785 29.785 33.332 -3.547 25342 8387 1 11 . 1 1 5 5 LYS H H 5 10.015 10.015 8.312 1.703 25342 8388 1 11 . 1 1 6 6 THR N N 6 126.254 126.254 114.004 12.250 25342 8389 1 11 . 1 1 6 6 THR HA H 6 5.654 5.654 4.922 0.732 25342 8390 1 11 . 1 1 6 6 THR C C 6 169.926 169.926 173.478 -3.552 25342 8391 1 11 . 1 1 6 6 THR CA C 6 60.598 60.598 62.191 -1.593 25342 8392 1 11 . 1 1 6 6 THR CB C 6 68.041 68.041 69.975 -1.934 25342 8393 1 11 . 1 1 6 6 THR H H 6 8.538 8.538 8.489 0.049 25342 8394 1 11 . 1 1 7 7 LEU N N 7 130.775 130.775 129.374 1.401 25342 8395 1 11 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.511 0.083 25342 8396 1 11 . 1 1 7 7 LEU C C 7 170.404 170.404 174.479 -4.075 25342 8397 1 11 . 1 1 7 7 LEU CA C 7 49.933 49.933 54.238 -4.305 25342 8398 1 11 . 1 1 7 7 LEU CB C 7 40.728 40.728 42.804 -2.076 25342 8399 1 11 . 1 1 7 7 LEU H H 7 8.575 8.575 8.753 -0.178 25342 8400 1 11 . 1 1 8 8 ILE N N 8 127.242 127.242 127.697 -0.455 25342 8401 1 11 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.427 0.421 25342 8402 1 11 . 1 1 8 8 ILE C C 8 170.936 170.936 174.904 -3.968 25342 8403 1 11 . 1 1 8 8 ILE CA C 8 57.252 57.252 61.320 -4.068 25342 8404 1 11 . 1 1 8 8 ILE CB C 8 36.935 36.935 38.876 -1.941 25342 8405 1 11 . 1 1 8 8 ILE H H 8 9.217 9.217 8.906 0.311 25342 8406 1 11 . 1 1 9 9 LEU N N 9 127.183 127.183 128.281 -1.098 25342 8407 1 11 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.871 0.823 25342 8408 1 11 . 1 1 9 9 LEU C C 9 173.824 173.824 175.393 -1.569 25342 8409 1 11 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.010 -4.171 25342 8410 1 11 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.249 1.714 25342 8411 1 11 . 1 1 9 9 LEU H H 9 9.248 9.248 8.976 0.272 25342 8412 1 11 . 1 1 10 10 TYR N N 10 113.330 113.330 121.331 -8.001 25342 8413 1 11 . 1 1 10 10 TYR HA H 10 5.514 5.514 4.941 0.573 25342 8414 1 11 . 1 1 10 10 TYR C C 10 167.898 167.898 175.345 -7.447 25342 8415 1 11 . 1 1 10 10 TYR CA C 10 52.875 52.875 55.153 -2.278 25342 8416 1 11 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.222 -1.786 25342 8417 1 11 . 1 1 10 10 TYR H H 10 7.306 7.306 8.105 -0.799 25342 8418 1 11 . 1 1 11 11 TYR N N 11 121.297 121.297 127.811 -6.514 25342 8419 1 11 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.052 -0.290 25342 8420 1 11 . 1 1 11 11 TYR C C 11 169.698 169.698 175.218 -5.520 25342 8421 1 11 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.459 -1.412 25342 8422 1 11 . 1 1 11 11 TYR CB C 11 40.538 40.538 38.401 2.137 25342 8423 1 11 . 1 1 11 11 TYR H H 11 7.891 7.891 8.483 -0.592 25342 8424 1 11 . 1 1 12 12 SER N N 12 117.763 117.763 124.055 -6.292 25342 8425 1 11 . 1 1 12 12 SER HA H 12 4.679 4.679 4.344 0.335 25342 8426 1 11 . 1 1 12 12 SER C C 12 170.075 170.075 173.864 -3.789 25342 8427 1 11 . 1 1 12 12 SER CA C 12 53.619 53.619 58.102 -4.482 25342 8428 1 11 . 1 1 12 12 SER CB C 12 62.847 62.847 62.648 0.199 25342 8429 1 11 . 1 1 12 12 SER H H 12 7.557 7.557 8.586 -1.029 25342 8430 1 11 . 1 1 13 13 TRP N N 13 135.232 135.232 128.514 6.718 25342 8431 1 11 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.023 0.613 25342 8432 1 11 . 1 1 13 13 TRP C C 13 175.708 175.708 176.369 -0.661 25342 8433 1 11 . 1 1 13 13 TRP CA C 13 58.116 58.116 58.018 0.098 25342 8434 1 11 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.571 -1.936 25342 8435 1 11 . 1 1 13 13 TRP H H 13 9.755 9.755 7.613 2.142 25342 8436 1 11 . 1 1 14 14 SER N N 14 113.789 113.789 115.260 -1.471 25342 8437 1 11 . 1 1 14 14 SER HA H 14 4.223 4.223 4.126 0.097 25342 8438 1 11 . 1 1 14 14 SER C C 14 172.747 172.747 174.506 -1.759 25342 8439 1 11 . 1 1 14 14 SER CA C 14 53.828 53.828 57.823 -3.995 25342 8440 1 11 . 1 1 14 14 SER CB C 14 60.037 60.037 61.759 -1.722 25342 8441 1 11 . 1 1 14 14 SER H H 14 10.026 10.026 7.830 2.196 25342 8442 1 11 . 1 1 15 15 GLY N N 15 110.489 110.489 110.308 0.181 25342 8443 1 11 . 1 1 15 15 GLY CA C 15 44.659 44.659 46.191 -1.532 25342 8444 1 11 . 1 1 15 15 GLY H H 15 7.391 7.391 7.559 -0.168 25342 8445 1 11 . 1 1 16 16 GLU N N 16 129.005 129.005 121.289 7.716 25342 8446 1 11 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.053 0.010 25342 8447 1 11 . 1 1 16 16 GLU CA C 16 56.761 56.761 59.396 -2.635 25342 8448 1 11 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.564 -3.152 25342 8449 1 11 . 1 1 16 16 GLU H H 16 11.550 11.550 8.514 3.036 25342 8450 1 11 . 1 1 17 17 THR N N 17 123.016 123.016 112.894 10.122 25342 8451 1 11 . 1 1 17 17 THR HA H 17 4.035 4.035 4.400 -0.365 25342 8452 1 11 . 1 1 17 17 THR C C 17 173.360 173.360 175.583 -2.223 25342 8453 1 11 . 1 1 17 17 THR CA C 17 64.303 64.303 65.254 -0.952 25342 8454 1 11 . 1 1 17 17 THR CB C 17 63.999 63.999 68.298 -4.299 25342 8455 1 11 . 1 1 17 17 THR H H 17 11.293 11.293 8.527 2.766 25342 8456 1 11 . 1 1 18 18 LYS N N 18 120.156 120.156 121.386 -1.230 25342 8457 1 11 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.124 -1.268 25342 8458 1 11 . 1 1 18 18 LYS C C 18 173.901 173.901 178.636 -4.735 25342 8459 1 11 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.142 -2.308 25342 8460 1 11 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.456 -2.975 25342 8461 1 11 . 1 1 18 18 LYS H H 18 6.940 6.940 7.388 -0.448 25342 8462 1 11 . 1 1 19 19 LYS N N 19 117.237 117.237 120.359 -3.122 25342 8463 1 11 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.234 -0.311 25342 8464 1 11 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.231 -2.908 25342 8465 1 11 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.187 -2.826 25342 8466 1 11 . 1 1 19 19 LYS H H 19 7.212 7.212 8.189 -0.977 25342 8467 1 11 . 1 1 20 20 MET N N 20 119.268 119.268 116.563 2.705 25342 8468 1 11 . 1 1 20 20 MET HA H 20 4.413 4.413 4.210 0.203 25342 8469 1 11 . 1 1 20 20 MET C C 20 173.625 173.625 177.282 -3.657 25342 8470 1 11 . 1 1 20 20 MET CA C 20 52.261 52.261 56.613 -4.352 25342 8471 1 11 . 1 1 20 20 MET CB C 20 26.680 26.680 32.051 -5.371 25342 8472 1 11 . 1 1 20 20 MET H H 20 7.600 7.600 7.716 -0.116 25342 8473 1 11 . 1 1 21 21 ALA N N 21 123.669 123.669 121.736 1.933 25342 8474 1 11 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.581 -0.099 25342 8475 1 11 . 1 1 21 21 ALA C C 21 176.628 176.628 179.407 -2.779 25342 8476 1 11 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.020 -2.646 25342 8477 1 11 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.850 -1.355 25342 8478 1 11 . 1 1 21 21 ALA H H 21 8.738 8.738 7.887 0.851 25342 8479 1 11 . 1 1 22 22 GLU N N 22 117.242 117.242 118.317 -1.075 25342 8480 1 11 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.901 -0.228 25342 8481 1 11 . 1 1 22 22 GLU C C 22 176.698 176.698 179.014 -2.316 25342 8482 1 11 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.352 -2.812 25342 8483 1 11 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.381 -2.947 25342 8484 1 11 . 1 1 22 22 GLU H H 22 7.959 7.959 7.766 0.193 25342 8485 1 11 . 1 1 23 23 LYS N N 23 123.302 123.302 120.586 2.716 25342 8486 1 11 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.076 -0.255 25342 8487 1 11 . 1 1 23 23 LYS C C 23 177.389 177.389 178.860 -1.471 25342 8488 1 11 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.118 -2.196 25342 8489 1 11 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.516 -3.002 25342 8490 1 11 . 1 1 23 23 LYS H H 23 7.703 7.703 7.287 0.416 25342 8491 1 11 . 1 1 24 24 ILE N N 24 122.208 122.208 118.638 3.570 25342 8492 1 11 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.581 -0.298 25342 8493 1 11 . 1 1 24 24 ILE C C 24 174.934 174.934 178.082 -3.148 25342 8494 1 11 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.998 -1.706 25342 8495 1 11 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.675 -2.937 25342 8496 1 11 . 1 1 24 24 ILE H H 24 8.535 8.535 7.762 0.773 25342 8497 1 11 . 1 1 25 25 ASN N N 25 118.640 118.640 118.076 0.564 25342 8498 1 11 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.279 -0.052 25342 8499 1 11 . 1 1 25 25 ASN C C 25 173.530 173.530 177.682 -4.152 25342 8500 1 11 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.408 -4.197 25342 8501 1 11 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.312 -0.207 25342 8502 1 11 . 1 1 25 25 ASN H H 25 8.317 8.317 8.364 -0.047 25342 8503 1 11 . 1 1 26 26 SER N N 26 111.990 111.990 115.053 -3.063 25342 8504 1 11 . 1 1 26 26 SER HA H 26 4.153 4.153 4.247 -0.094 25342 8505 1 11 . 1 1 26 26 SER C C 26 172.110 172.110 175.438 -3.328 25342 8506 1 11 . 1 1 26 26 SER CA C 26 57.905 57.905 61.068 -3.163 25342 8507 1 11 . 1 1 26 26 SER CB C 26 60.655 60.655 63.006 -2.351 25342 8508 1 11 . 1 1 26 26 SER H H 26 7.369 7.369 7.774 -0.405 25342 8509 1 11 . 1 1 27 27 GLU N N 27 120.201 120.201 118.369 1.832 25342 8510 1 11 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.299 -0.198 25342 8511 1 11 . 1 1 27 27 GLU C C 27 173.673 173.673 176.467 -2.794 25342 8512 1 11 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.411 -2.176 25342 8513 1 11 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.311 -3.710 25342 8514 1 11 . 1 1 27 27 GLU H H 27 7.451 7.451 7.625 -0.174 25342 8515 1 11 . 1 1 28 28 ILE N N 28 118.762 118.762 118.595 0.167 25342 8516 1 11 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.245 -0.046 25342 8517 1 11 . 1 1 28 28 ILE C C 28 172.487 172.487 176.575 -4.088 25342 8518 1 11 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.186 -2.454 25342 8519 1 11 . 1 1 28 28 ILE CB C 28 35.738 35.738 39.347 -3.609 25342 8520 1 11 . 1 1 28 28 ILE H H 28 7.255 7.255 7.267 -0.012 25342 8521 1 11 . 1 1 29 29 LYS N N 29 130.563 130.563 122.536 8.027 25342 8522 1 11 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.205 -0.203 25342 8523 1 11 . 1 1 29 29 LYS C C 29 174.386 174.386 176.708 -2.322 25342 8524 1 11 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.859 -1.324 25342 8525 1 11 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.056 -3.470 25342 8526 1 11 . 1 1 29 29 LYS H H 29 8.564 8.564 8.481 0.083 25342 8527 1 11 . 1 1 30 30 ASP N N 30 119.357 119.357 119.562 -0.205 25342 8528 1 11 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.505 -0.103 25342 8529 1 11 . 1 1 30 30 ASP C C 30 172.570 172.570 175.548 -2.978 25342 8530 1 11 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.649 -1.213 25342 8531 1 11 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.372 -2.628 25342 8532 1 11 . 1 1 30 30 ASP H H 30 8.920 8.920 8.570 0.350 25342 8533 1 11 . 1 1 31 31 SER N N 31 114.019 114.019 118.795 -4.776 25342 8534 1 11 . 1 1 31 31 SER HA H 31 4.782 4.782 5.033 -0.251 25342 8535 1 11 . 1 1 31 31 SER C C 31 171.150 171.150 174.028 -2.878 25342 8536 1 11 . 1 1 31 31 SER CA C 31 55.551 55.551 57.015 -1.464 25342 8537 1 11 . 1 1 31 31 SER CB C 31 62.259 62.259 66.069 -3.810 25342 8538 1 11 . 1 1 31 31 SER H H 31 8.006 8.006 8.176 -0.170 25342 8539 1 11 . 1 1 32 32 GLU N N 32 121.455 121.455 119.407 2.048 25342 8540 1 11 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.683 0.057 25342 8541 1 11 . 1 1 32 32 GLU C C 32 171.185 171.185 174.068 -2.883 25342 8542 1 11 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.599 -3.518 25342 8543 1 11 . 1 1 32 32 GLU CB C 32 30.827 30.827 33.771 -2.944 25342 8544 1 11 . 1 1 32 32 GLU H H 32 8.145 8.145 8.276 -0.131 25342 8545 1 11 . 1 1 33 33 LEU N N 33 126.176 126.176 123.830 2.346 25342 8546 1 11 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.551 0.755 25342 8547 1 11 . 1 1 33 33 LEU C C 33 173.365 173.365 175.286 -1.921 25342 8548 1 11 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.561 -3.121 25342 8549 1 11 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.549 0.086 25342 8550 1 11 . 1 1 33 33 LEU H H 33 8.589 8.589 8.515 0.074 25342 8551 1 11 . 1 1 34 34 LYS N N 34 127.200 127.200 126.472 0.728 25342 8552 1 11 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.907 -0.311 25342 8553 1 11 . 1 1 34 34 LYS C C 34 169.622 169.622 174.847 -5.225 25342 8554 1 11 . 1 1 34 34 LYS CA C 34 52.329 52.329 53.894 -1.565 25342 8555 1 11 . 1 1 34 34 LYS CB C 34 34.200 34.200 35.442 -1.242 25342 8556 1 11 . 1 1 34 34 LYS H H 34 9.380 9.380 8.983 0.397 25342 8557 1 11 . 1 1 35 35 GLU N N 35 122.324 122.324 118.625 3.699 25342 8558 1 11 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.018 -1.685 25342 8559 1 11 . 1 1 35 35 GLU C C 35 172.734 172.734 175.122 -2.388 25342 8560 1 11 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.683 -2.071 25342 8561 1 11 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.882 -3.563 25342 8562 1 11 . 1 1 35 35 GLU H H 35 8.094 8.094 8.397 -0.303 25342 8563 1 11 . 1 1 36 36 VAL N N 36 126.781 126.781 118.489 8.292 25342 8564 1 11 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.573 -0.734 25342 8565 1 11 . 1 1 36 36 VAL C C 36 171.482 171.482 175.063 -3.581 25342 8566 1 11 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.295 -0.890 25342 8567 1 11 . 1 1 36 36 VAL CB C 36 29.348 29.348 34.791 -5.443 25342 8568 1 11 . 1 1 36 36 VAL H H 36 8.660 8.660 8.288 0.372 25342 8569 1 11 . 1 1 37 37 LYS N N 37 126.065 126.065 119.523 6.542 25342 8570 1 11 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.393 0.572 25342 8571 1 11 . 1 1 37 37 LYS C C 37 173.187 173.187 174.444 -1.257 25342 8572 1 11 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.812 -2.531 25342 8573 1 11 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.329 -2.408 25342 8574 1 11 . 1 1 37 37 LYS H H 37 7.809 7.809 8.180 -0.371 25342 8575 1 11 . 1 1 38 38 VAL N N 38 111.020 111.020 115.833 -4.813 25342 8576 1 11 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.731 0.093 25342 8577 1 11 . 1 1 38 38 VAL C C 38 173.604 173.604 175.848 -2.244 25342 8578 1 11 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.583 -3.200 25342 8579 1 11 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.317 -1.941 25342 8580 1 11 . 1 1 38 38 VAL H H 38 8.305 8.305 8.022 0.283 25342 8581 1 11 . 1 1 39 39 SER N N 39 117.887 117.887 115.503 2.384 25342 8582 1 11 . 1 1 39 39 SER HA H 39 4.183 4.183 4.577 -0.394 25342 8583 1 11 . 1 1 39 39 SER C C 39 173.538 173.538 174.442 -0.904 25342 8584 1 11 . 1 1 39 39 SER CA C 39 56.279 56.279 58.688 -2.409 25342 8585 1 11 . 1 1 39 39 SER CB C 39 60.537 60.537 63.837 -3.300 25342 8586 1 11 . 1 1 39 39 SER H H 39 8.847 8.847 8.594 0.253 25342 8587 1 11 . 1 1 40 40 GLU N N 40 126.316 126.316 120.291 6.025 25342 8588 1 11 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.552 -0.398 25342 8589 1 11 . 1 1 40 40 GLU C C 40 174.586 174.586 177.083 -2.497 25342 8590 1 11 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.394 -0.582 25342 8591 1 11 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.878 -3.159 25342 8592 1 11 . 1 1 40 40 GLU H H 40 9.049 9.049 8.581 0.468 25342 8593 1 11 . 1 1 41 41 GLY N N 41 112.494 112.494 115.192 -2.698 25342 8594 1 11 . 1 1 41 41 GLY C C 41 171.994 171.994 175.320 -3.326 25342 8595 1 11 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.703 -3.241 25342 8596 1 11 . 1 1 41 41 GLY H H 41 8.780 8.780 9.116 -0.336 25342 8597 1 11 . 1 1 42 42 THR N N 42 118.631 118.631 114.566 4.065 25342 8598 1 11 . 1 1 42 42 THR HA H 42 3.582 3.582 3.957 -0.375 25342 8599 1 11 . 1 1 42 42 THR C C 42 171.225 171.225 174.742 -3.517 25342 8600 1 11 . 1 1 42 42 THR CA C 42 64.104 64.104 64.806 -0.702 25342 8601 1 11 . 1 1 42 42 THR CB C 42 65.914 65.914 69.285 -3.372 25342 8602 1 11 . 1 1 42 42 THR H H 42 7.737 7.737 8.298 -0.561 25342 8603 1 11 . 1 1 43 43 PHE N N 43 116.279 116.279 116.779 -0.500 25342 8604 1 11 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.556 0.464 25342 8605 1 11 . 1 1 43 43 PHE C C 43 170.141 170.141 174.310 -4.169 25342 8606 1 11 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.078 -3.606 25342 8607 1 11 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.879 -4.494 25342 8608 1 11 . 1 1 43 43 PHE H H 43 8.114 8.114 7.730 0.384 25342 8609 1 11 . 1 1 44 44 ASP N N 44 121.513 121.513 117.829 3.684 25342 8610 1 11 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.905 -0.054 25342 8611 1 11 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.688 -3.476 25342 8612 1 11 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.273 0.112 25342 8613 1 11 . 1 1 44 44 ASP H H 44 7.774 7.774 8.313 -0.539 25342 8614 1 11 . 1 1 45 45 ALA N N 45 125.663 125.663 122.465 3.198 25342 8615 1 11 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.659 -0.448 25342 8616 1 11 . 1 1 45 45 ALA C C 45 175.139 175.139 177.065 -1.926 25342 8617 1 11 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.489 -1.052 25342 8618 1 11 . 1 1 45 45 ALA CB C 45 16.232 16.232 18.860 -2.627 25342 8619 1 11 . 1 1 45 45 ALA H H 45 8.324 8.324 8.593 -0.269 25342 8620 1 11 . 1 1 46 46 ASP N N 46 119.288 119.288 118.863 0.425 25342 8621 1 11 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.482 0.343 25342 8622 1 11 . 1 1 46 46 ASP C C 46 175.013 175.013 177.291 -2.278 25342 8623 1 11 . 1 1 46 46 ASP CA C 46 51.161 51.161 54.019 -2.858 25342 8624 1 11 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.017 -0.784 25342 8625 1 11 . 1 1 46 46 ASP H H 46 9.618 9.618 7.796 1.822 25342 8626 1 11 . 1 1 47 47 MET N N 47 127.347 127.347 115.303 12.044 25342 8627 1 11 . 1 1 47 47 MET HA H 47 3.456 3.456 4.694 -1.238 25342 8628 1 11 . 1 1 47 47 MET C C 47 173.605 173.605 175.489 -1.884 25342 8629 1 11 . 1 1 47 47 MET CA C 47 56.699 56.699 56.069 0.630 25342 8630 1 11 . 1 1 47 47 MET CB C 47 29.930 29.930 34.629 -4.699 25342 8631 1 11 . 1 1 47 47 MET H H 47 9.178 9.178 7.928 1.250 25342 8632 1 11 . 1 1 48 48 TYR N N 48 121.040 121.040 117.842 3.198 25342 8633 1 11 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.815 -0.943 25342 8634 1 11 . 1 1 48 48 TYR CA C 48 58.712 58.712 58.449 0.263 25342 8635 1 11 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.075 -4.437 25342 8636 1 11 . 1 1 48 48 TYR H H 48 7.881 7.881 8.124 -0.243 25342 8637 1 11 . 1 1 49 49 LYS N N 49 121.754 121.754 120.439 1.315 25342 8638 1 11 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.084 0.021 25342 8639 1 11 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.909 -3.524 25342 8640 1 11 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.041 -2.877 25342 8641 1 11 . 1 1 49 49 LYS H H 49 8.365 8.365 8.168 0.197 25342 8642 1 11 . 1 1 50 50 THR N N 50 117.557 117.557 110.246 7.311 25342 8643 1 11 . 1 1 50 50 THR HA H 50 3.586 3.586 4.159 -0.573 25342 8644 1 11 . 1 1 50 50 THR CA C 50 65.634 65.634 66.308 -0.674 25342 8645 1 11 . 1 1 50 50 THR CB C 50 65.904 65.904 67.988 -2.084 25342 8646 1 11 . 1 1 50 50 THR H H 50 8.007 8.007 8.262 -0.255 25342 8647 1 11 . 1 1 51 51 SER N N 51 115.110 115.110 117.700 -2.590 25342 8648 1 11 . 1 1 51 51 SER HA H 51 3.974 3.974 4.190 -0.216 25342 8649 1 11 . 1 1 51 51 SER CA C 51 59.042 59.042 62.370 -3.328 25342 8650 1 11 . 1 1 51 51 SER CB C 51 59.835 59.835 62.920 -3.085 25342 8651 1 11 . 1 1 51 51 SER H H 51 7.606 7.606 8.085 -0.479 25342 8652 1 11 . 1 1 52 52 ASP N N 52 119.713 119.713 122.169 -2.456 25342 8653 1 11 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.468 -0.161 25342 8654 1 11 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.452 -2.926 25342 8655 1 11 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.972 -3.284 25342 8656 1 11 . 1 1 52 52 ASP H H 52 7.552 7.552 8.001 -0.449 25342 8657 1 11 . 1 1 53 53 ILE N N 53 121.982 121.982 120.260 1.722 25342 8658 1 11 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.916 -0.194 25342 8659 1 11 . 1 1 53 53 ILE C C 53 175.325 175.325 178.013 -2.688 25342 8660 1 11 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.223 -2.679 25342 8661 1 11 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.810 -1.111 25342 8662 1 11 . 1 1 53 53 ILE H H 53 7.815 7.815 8.242 -0.426 25342 8663 1 11 . 1 1 54 54 ALA N N 54 121.552 121.552 121.174 0.378 25342 8664 1 11 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.205 0.113 25342 8665 1 11 . 1 1 54 54 ALA C C 54 177.475 177.475 178.886 -1.411 25342 8666 1 11 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.885 -2.863 25342 8667 1 11 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.761 -2.777 25342 8668 1 11 . 1 1 54 54 ALA H H 54 8.332 8.332 7.833 0.499 25342 8669 1 11 . 1 1 55 55 LEU N N 55 117.176 117.176 119.296 -2.120 25342 8670 1 11 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.008 -0.074 25342 8671 1 11 . 1 1 55 55 LEU C C 55 176.532 176.532 178.303 -1.771 25342 8672 1 11 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.407 -2.075 25342 8673 1 11 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.679 -3.251 25342 8674 1 11 . 1 1 55 55 LEU H H 55 8.195 8.195 7.786 0.409 25342 8675 1 11 . 1 1 56 56 ASP N N 56 120.056 120.056 118.798 1.258 25342 8676 1 11 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.451 0.016 25342 8677 1 11 . 1 1 56 56 ASP C C 56 176.585 176.585 178.051 -1.466 25342 8678 1 11 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.238 -2.688 25342 8679 1 11 . 1 1 56 56 ASP CB C 56 38.305 38.305 39.920 -1.615 25342 8680 1 11 . 1 1 56 56 ASP H H 56 7.806 7.806 8.433 -0.627 25342 8681 1 11 . 1 1 57 57 GLN N N 57 120.020 120.020 116.771 3.249 25342 8682 1 11 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.412 -0.289 25342 8683 1 11 . 1 1 57 57 GLN C C 57 175.689 175.689 176.167 -0.478 25342 8684 1 11 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.400 -1.995 25342 8685 1 11 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.763 -4.994 25342 8686 1 11 . 1 1 57 57 GLN H H 57 7.661 7.661 7.605 0.056 25342 8687 1 11 . 1 1 58 58 ILE N N 58 120.644 120.644 118.680 1.964 25342 8688 1 11 . 1 1 58 58 ILE HA H 58 3.576 3.576 3.820 -0.244 25342 8689 1 11 . 1 1 58 58 ILE C C 58 176.237 176.237 178.053 -1.816 25342 8690 1 11 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.243 0.263 25342 8691 1 11 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.250 -3.221 25342 8692 1 11 . 1 1 58 58 ILE H H 58 8.228 8.228 7.650 0.578 25342 8693 1 11 . 1 1 59 59 GLN N N 59 115.498 115.498 119.750 -4.252 25342 8694 1 11 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.277 -0.135 25342 8695 1 11 . 1 1 59 59 GLN C C 59 173.781 173.781 176.411 -2.630 25342 8696 1 11 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.645 -2.663 25342 8697 1 11 . 1 1 59 59 GLN CB C 59 26.611 26.611 28.322 -1.711 25342 8698 1 11 . 1 1 59 59 GLN H H 59 8.331 8.331 8.187 0.144 25342 8699 1 11 . 1 1 60 60 GLY N N 60 106.623 106.623 107.413 -0.790 25342 8700 1 11 . 1 1 60 60 GLY C C 60 172.068 172.068 175.092 -3.024 25342 8701 1 11 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.678 -2.805 25342 8702 1 11 . 1 1 60 60 GLY H H 60 7.611 7.611 7.854 -0.243 25342 8703 1 11 . 1 1 61 61 ASN N N 61 117.691 117.691 118.368 -0.677 25342 8704 1 11 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.527 0.017 25342 8705 1 11 . 1 1 61 61 ASN C C 61 171.946 171.946 175.873 -3.927 25342 8706 1 11 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.807 -3.238 25342 8707 1 11 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.619 -2.259 25342 8708 1 11 . 1 1 61 61 ASN H H 61 8.151 8.151 8.339 -0.188 25342 8709 1 11 . 1 1 62 62 LYS N N 62 118.289 118.289 118.473 -0.184 25342 8710 1 11 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.696 -0.368 25342 8711 1 11 . 1 1 62 62 LYS C C 62 171.773 171.773 174.813 -3.040 25342 8712 1 11 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.545 -3.249 25342 8713 1 11 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.603 -0.920 25342 8714 1 11 . 1 1 62 62 LYS H H 62 7.242 7.242 7.989 -0.747 25342 8715 1 11 . 1 1 63 63 ASP N N 63 119.888 119.888 119.927 -0.039 25342 8716 1 11 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.385 0.031 25342 8717 1 11 . 1 1 63 63 ASP C C 63 174.476 174.476 175.678 -1.202 25342 8718 1 11 . 1 1 63 63 ASP CA C 63 51.461 51.461 54.124 -2.663 25342 8719 1 11 . 1 1 63 63 ASP CB C 63 38.515 38.515 40.945 -2.430 25342 8720 1 11 . 1 1 63 63 ASP H H 63 8.230 8.230 8.101 0.129 25342 8721 1 11 . 1 1 64 64 PHE N N 64 119.789 119.789 113.581 6.208 25342 8722 1 11 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.823 -1.007 25342 8723 1 11 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.178 2.072 25342 8724 1 11 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.610 -3.576 25342 8725 1 11 . 1 1 64 64 PHE H H 64 8.428 8.428 7.379 1.049 25342 8726 1 11 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.636 -0.323 25342 8727 1 11 . 1 1 65 65 PRO C C 65 173.975 173.975 176.459 -2.484 25342 8728 1 11 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.561 -2.505 25342 8729 1 11 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.990 -3.470 25342 8730 1 11 . 1 1 66 66 GLU N N 66 121.326 121.326 121.848 -0.522 25342 8731 1 11 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.481 -0.248 25342 8732 1 11 . 1 1 66 66 GLU C C 66 173.978 173.978 176.883 -2.905 25342 8733 1 11 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.480 -2.949 25342 8734 1 11 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.308 -3.608 25342 8735 1 11 . 1 1 66 66 GLU H H 66 8.225 8.225 8.647 -0.422 25342 8736 1 11 . 1 1 67 67 ILE N N 67 113.897 113.897 114.179 -0.282 25342 8737 1 11 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.769 0.400 25342 8738 1 11 . 1 1 67 67 ILE C C 67 172.791 172.791 175.853 -3.062 25342 8739 1 11 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.924 -2.649 25342 8740 1 11 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.066 -2.050 25342 8741 1 11 . 1 1 67 67 ILE H H 67 8.366 8.366 8.163 0.203 25342 8742 1 11 . 1 1 68 68 GLN N N 68 121.654 121.654 118.914 2.740 25342 8743 1 11 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.512 0.007 25342 8744 1 11 . 1 1 68 68 GLN C C 68 171.562 171.562 174.550 -2.988 25342 8745 1 11 . 1 1 68 68 GLN CA C 68 52.313 52.313 55.053 -2.740 25342 8746 1 11 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.908 -2.123 25342 8747 1 11 . 1 1 68 68 GLN H H 68 8.763 8.763 8.283 0.480 25342 8748 1 11 . 1 1 69 69 LEU N N 69 125.289 125.289 120.230 5.059 25342 8749 1 11 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.412 0.107 25342 8750 1 11 . 1 1 69 69 LEU C C 69 172.567 172.567 176.386 -3.819 25342 8751 1 11 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.483 -2.686 25342 8752 1 11 . 1 1 69 69 LEU CB C 69 42.742 42.742 43.143 -0.401 25342 8753 1 11 . 1 1 69 69 LEU H H 69 7.996 7.996 7.574 0.422 25342 8754 1 11 . 1 1 70 70 ASP N N 70 123.170 123.170 120.764 2.406 25342 8755 1 11 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.675 -0.269 25342 8756 1 11 . 1 1 70 70 ASP C C 70 171.978 171.978 175.272 -3.294 25342 8757 1 11 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.102 -2.420 25342 8758 1 11 . 1 1 70 70 ASP CB C 70 38.729 38.729 42.016 -3.287 25342 8759 1 11 . 1 1 70 70 ASP H H 70 8.278 8.278 8.467 -0.189 25342 8760 1 11 . 1 1 71 71 ASN N N 71 117.524 117.524 119.211 -1.687 25342 8761 1 11 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.689 -0.362 25342 8762 1 11 . 1 1 71 71 ASN C C 71 171.825 171.825 174.386 -2.561 25342 8763 1 11 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.096 -1.439 25342 8764 1 11 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.620 -3.390 25342 8765 1 11 . 1 1 71 71 ASN H H 71 8.372 8.372 8.391 -0.019 25342 8766 1 11 . 1 1 72 72 ILE N N 72 124.515 124.515 124.553 -0.038 25342 8767 1 11 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.086 -0.157 25342 8768 1 11 . 1 1 72 72 ILE C C 72 171.607 171.607 174.452 -2.845 25342 8769 1 11 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.244 -2.955 25342 8770 1 11 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.294 -2.534 25342 8771 1 11 . 1 1 72 72 ILE H H 72 7.653 7.653 8.087 -0.434 25342 8772 1 11 . 1 1 73 73 ASP N N 73 125.182 125.182 128.048 -2.866 25342 8773 1 11 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.604 0.024 25342 8774 1 11 . 1 1 73 73 ASP C C 73 173.980 173.980 176.653 -2.673 25342 8775 1 11 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.007 -4.793 25342 8776 1 11 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.714 -3.812 25342 8777 1 11 . 1 1 73 73 ASP H H 73 8.382 8.382 8.693 -0.311 25342 8778 1 11 . 1 1 74 74 TYR N N 74 123.092 123.092 123.777 -0.685 25342 8779 1 11 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.536 -0.671 25342 8780 1 11 . 1 1 74 74 TYR C C 74 173.582 173.582 177.368 -3.786 25342 8781 1 11 . 1 1 74 74 TYR CA C 74 59.486 59.486 58.798 0.688 25342 8782 1 11 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.000 -3.192 25342 8783 1 11 . 1 1 74 74 TYR H H 74 7.348 7.348 7.801 -0.453 25342 8784 1 11 . 1 1 75 75 ASN N N 75 109.447 109.447 115.754 -6.307 25342 8785 1 11 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.641 0.284 25342 8786 1 11 . 1 1 75 75 ASN C C 75 172.570 172.570 175.541 -2.971 25342 8787 1 11 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.228 -2.610 25342 8788 1 11 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.412 -2.878 25342 8789 1 11 . 1 1 75 75 ASN H H 75 8.040 8.040 8.598 -0.558 25342 8790 1 11 . 1 1 76 76 ASN N N 76 117.411 117.411 115.785 1.626 25342 8791 1 11 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.659 -0.205 25342 8792 1 11 . 1 1 76 76 ASN C C 76 171.155 171.155 174.709 -3.554 25342 8793 1 11 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.474 -2.541 25342 8794 1 11 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.914 -3.256 25342 8795 1 11 . 1 1 76 76 ASN H H 76 7.750 7.750 7.761 -0.011 25342 8796 1 11 . 1 1 77 77 TYR N N 77 116.878 116.878 119.207 -2.329 25342 8797 1 11 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.634 -0.280 25342 8798 1 11 . 1 1 77 77 TYR C C 77 172.224 172.224 174.833 -2.609 25342 8799 1 11 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.674 -2.434 25342 8800 1 11 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.829 -2.716 25342 8801 1 11 . 1 1 77 77 TYR H H 77 7.789 7.789 7.785 0.004 25342 8802 1 11 . 1 1 78 78 ASP N N 78 121.352 121.352 123.749 -2.397 25342 8803 1 11 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.504 0.293 25342 8804 1 11 . 1 1 78 78 ASP C C 78 172.623 172.623 175.423 -2.800 25342 8805 1 11 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.358 -3.167 25342 8806 1 11 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.042 -1.007 25342 8807 1 11 . 1 1 78 78 ASP H H 78 9.036 9.036 8.924 0.112 25342 8808 1 11 . 1 1 79 79 LEU N N 79 123.073 123.073 117.007 6.066 25342 8809 1 11 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.414 -0.306 25342 8810 1 11 . 1 1 79 79 LEU C C 79 170.730 170.730 174.421 -3.691 25342 8811 1 11 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.349 -3.092 25342 8812 1 11 . 1 1 79 79 LEU CB C 79 42.284 42.284 45.701 -3.417 25342 8813 1 11 . 1 1 79 79 LEU H H 79 7.877 7.877 7.414 0.463 25342 8814 1 11 . 1 1 80 80 ILE N N 80 126.348 126.348 124.973 1.375 25342 8815 1 11 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.843 0.226 25342 8816 1 11 . 1 1 80 80 ILE C C 80 171.584 171.584 174.070 -2.486 25342 8817 1 11 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.313 -2.898 25342 8818 1 11 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.652 -2.654 25342 8819 1 11 . 1 1 80 80 ILE H H 80 8.704 8.704 8.535 0.169 25342 8820 1 11 . 1 1 81 81 LEU N N 81 126.303 126.303 128.533 -2.230 25342 8821 1 11 . 1 1 81 81 LEU HA H 81 5.123 5.123 5.008 0.115 25342 8822 1 11 . 1 1 81 81 LEU C C 81 172.779 172.779 175.510 -2.731 25342 8823 1 11 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.189 -4.680 25342 8824 1 11 . 1 1 81 81 LEU CB C 81 41.715 41.715 44.384 -2.669 25342 8825 1 11 . 1 1 81 81 LEU H H 81 9.202 9.202 8.365 0.837 25342 8826 1 11 . 1 1 82 82 ILE N N 82 120.931 120.931 122.330 -1.399 25342 8827 1 11 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.228 -0.381 25342 8828 1 11 . 1 1 82 82 ILE C C 82 172.796 172.796 174.858 -2.062 25342 8829 1 11 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.508 -2.627 25342 8830 1 11 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.220 -4.423 25342 8831 1 11 . 1 1 82 82 ILE H H 82 8.846 8.846 8.615 0.231 25342 8832 1 11 . 1 1 83 83 GLY N N 83 120.905 120.905 110.280 10.625 25342 8833 1 11 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.217 -2.660 25342 8834 1 11 . 1 1 83 83 GLY H H 83 9.558 9.558 8.148 1.410 25342 8835 1 11 . 1 1 84 84 SER N N 84 116.601 116.601 114.631 1.970 25342 8836 1 11 . 1 1 84 84 SER HA H 84 5.476 5.476 5.026 0.450 25342 8837 1 11 . 1 1 84 84 SER CA C 84 51.324 51.324 56.049 -4.725 25342 8838 1 11 . 1 1 84 84 SER CB C 84 64.271 64.271 63.988 0.283 25342 8839 1 11 . 1 1 84 84 SER H H 84 7.533 7.533 7.832 -0.299 25342 8840 1 11 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.525 0.638 25342 8841 1 11 . 1 1 85 85 PRO C C 85 175.590 175.590 175.827 -0.237 25342 8842 1 11 . 1 1 85 85 PRO CA C 85 58.883 58.883 61.945 -3.062 25342 8843 1 11 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.677 -2.203 25342 8844 1 11 . 1 1 86 86 VAL N N 86 116.295 116.295 118.944 -2.649 25342 8845 1 11 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.349 -0.528 25342 8846 1 11 . 1 1 86 86 VAL C C 86 172.692 172.692 175.605 -2.913 25342 8847 1 11 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.050 -1.238 25342 8848 1 11 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.909 -2.826 25342 8849 1 11 . 1 1 86 86 VAL H H 86 7.246 7.246 8.241 -0.995 25342 8850 1 11 . 1 1 87 87 TRP N N 87 131.042 131.042 127.932 3.110 25342 8851 1 11 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.650 -0.339 25342 8852 1 11 . 1 1 87 87 TRP C C 87 173.323 173.323 176.616 -3.293 25342 8853 1 11 . 1 1 87 87 TRP CA C 87 50.887 50.887 56.674 -5.787 25342 8854 1 11 . 1 1 87 87 TRP CB C 87 27.310 27.310 30.899 -3.589 25342 8855 1 11 . 1 1 87 87 TRP H H 87 9.555 9.555 8.421 1.133 25342 8856 1 11 . 1 1 88 88 SER N N 88 122.660 122.660 116.907 5.753 25342 8857 1 11 . 1 1 88 88 SER HA H 88 4.582 4.582 4.144 0.438 25342 8858 1 11 . 1 1 88 88 SER C C 88 172.096 172.096 174.692 -2.596 25342 8859 1 11 . 1 1 88 88 SER CA C 88 55.391 55.391 60.132 -4.741 25342 8860 1 11 . 1 1 88 88 SER CB C 88 57.813 57.813 61.731 -3.918 25342 8861 1 11 . 1 1 88 88 SER H H 88 10.257 10.257 8.993 1.264 25342 8862 1 11 . 1 1 89 89 GLY N N 89 128.381 128.381 109.589 18.792 25342 8863 1 11 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.954 -2.325 25342 8864 1 11 . 1 1 89 89 GLY H H 89 6.372 6.372 8.229 -1.857 25342 8865 1 11 . 1 1 90 90 TYR N N 90 120.345 120.345 116.809 3.536 25342 8866 1 11 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.010 -0.821 25342 8867 1 11 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.483 -0.934 25342 8868 1 11 . 1 1 90 90 TYR CB C 90 37.195 37.195 39.225 -2.030 25342 8869 1 11 . 1 1 90 90 TYR H H 90 8.113 8.113 7.242 0.871 25342 8870 1 11 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.555 0.279 25342 8871 1 11 . 1 1 91 91 PRO C C 91 170.911 170.911 177.053 -6.142 25342 8872 1 11 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.561 -3.726 25342 8873 1 11 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.149 -6.079 25342 8874 1 11 . 1 1 92 92 ALA N N 92 120.629 120.629 124.140 -3.511 25342 8875 1 11 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.231 0.388 25342 8876 1 11 . 1 1 92 92 ALA C C 92 176.782 176.782 176.406 0.376 25342 8877 1 11 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.561 -1.144 25342 8878 1 11 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.084 -0.568 25342 8879 1 11 . 1 1 92 92 ALA H H 92 7.554 7.554 8.474 -0.920 25342 8880 1 11 . 1 1 93 93 THR N N 93 112.558 112.558 109.271 3.287 25342 8881 1 11 . 1 1 93 93 THR CB C 93 64.173 64.173 67.846 -3.673 25342 8882 1 11 . 1 1 93 93 THR H H 93 6.730 6.730 7.682 -0.952 25342 8883 1 11 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.534 -0.675 25342 8884 1 11 . 1 1 94 94 PRO C C 94 173.309 173.309 175.947 -2.638 25342 8885 1 11 . 1 1 94 94 PRO CA C 94 63.063 63.063 63.961 -0.898 25342 8886 1 11 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.913 -3.634 25342 8887 1 11 . 1 1 95 95 ILE N N 95 111.014 111.014 117.963 -6.949 25342 8888 1 11 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.410 -0.805 25342 8889 1 11 . 1 1 95 95 ILE C C 95 174.302 174.302 176.351 -2.049 25342 8890 1 11 . 1 1 95 95 ILE CA C 95 57.181 57.181 58.819 -1.638 25342 8891 1 11 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.628 -4.845 25342 8892 1 11 . 1 1 95 95 ILE H H 95 7.995 7.995 8.117 -0.122 25342 8893 1 11 . 1 1 96 96 LYS N N 96 123.208 123.208 123.550 -0.342 25342 8894 1 11 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.256 -1.164 25342 8895 1 11 . 1 1 96 96 LYS C C 96 174.451 174.451 177.803 -3.352 25342 8896 1 11 . 1 1 96 96 LYS CA C 96 57.041 57.041 58.890 -1.849 25342 8897 1 11 . 1 1 96 96 LYS CB C 96 28.747 28.747 32.242 -3.495 25342 8898 1 11 . 1 1 96 96 LYS H H 96 6.928 6.928 7.541 -0.613 25342 8899 1 11 . 1 1 97 97 THR N N 97 113.320 113.320 115.489 -2.169 25342 8900 1 11 . 1 1 97 97 THR HA H 97 3.436 3.436 3.659 -0.223 25342 8901 1 11 . 1 1 97 97 THR C C 97 173.221 173.221 176.568 -3.347 25342 8902 1 11 . 1 1 97 97 THR CA C 97 62.710 62.710 66.134 -3.424 25342 8903 1 11 . 1 1 97 97 THR CB C 97 65.562 65.562 68.323 -2.761 25342 8904 1 11 . 1 1 97 97 THR H H 97 6.325 6.325 8.069 -1.744 25342 8905 1 11 . 1 1 98 98 LEU N N 98 120.963 120.963 121.228 -0.265 25342 8906 1 11 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.118 -0.493 25342 8907 1 11 . 1 1 98 98 LEU C C 98 174.713 174.713 178.229 -3.516 25342 8908 1 11 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.771 -2.257 25342 8909 1 11 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.738 -2.010 25342 8910 1 11 . 1 1 98 98 LEU H H 98 7.536 7.536 7.899 -0.363 25342 8911 1 11 . 1 1 99 99 LEU N N 99 118.859 118.859 118.386 0.473 25342 8912 1 11 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.871 -0.199 25342 8913 1 11 . 1 1 99 99 LEU C C 99 177.458 177.458 178.181 -0.723 25342 8914 1 11 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.257 -3.112 25342 8915 1 11 . 1 1 99 99 LEU CB C 99 38.857 38.857 40.930 -2.073 25342 8916 1 11 . 1 1 99 99 LEU H H 99 8.179 8.179 7.350 0.829 25342 8917 1 11 . 1 1 100 100 ASP N N 100 118.703 118.703 117.446 1.257 25342 8918 1 11 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.309 -0.088 25342 8919 1 11 . 1 1 100 100 ASP C C 100 176.472 176.472 177.507 -1.035 25342 8920 1 11 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.024 -2.717 25342 8921 1 11 . 1 1 100 100 ASP CB C 100 37.358 37.358 41.087 -3.729 25342 8922 1 11 . 1 1 100 100 ASP H H 100 7.867 7.867 7.820 0.047 25342 8923 1 11 . 1 1 101 101 GLN N N 101 117.829 117.829 114.299 3.530 25342 8924 1 11 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.394 -0.194 25342 8925 1 11 . 1 1 101 101 GLN C C 101 174.508 174.508 176.697 -2.189 25342 8926 1 11 . 1 1 101 101 GLN CA C 101 54.688 54.688 56.663 -1.975 25342 8927 1 11 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.239 -3.642 25342 8928 1 11 . 1 1 101 101 GLN H H 101 7.597 7.597 7.699 -0.102 25342 8929 1 11 . 1 1 102 102 MET N N 102 118.406 118.406 114.092 4.314 25342 8930 1 11 . 1 1 102 102 MET HA H 102 3.864 3.864 5.083 -1.219 25342 8931 1 11 . 1 1 102 102 MET C C 102 172.820 172.820 176.974 -4.154 25342 8932 1 11 . 1 1 102 102 MET CA C 102 53.298 53.298 56.106 -2.808 25342 8933 1 11 . 1 1 102 102 MET CB C 102 31.207 31.207 34.584 -3.377 25342 8934 1 11 . 1 1 102 102 MET H H 102 7.434 7.434 7.673 -0.239 25342 8935 1 11 . 1 1 103 103 LYS N N 103 115.889 115.889 121.939 -6.050 25342 8936 1 11 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.972 -0.053 25342 8937 1 11 . 1 1 103 103 LYS C C 103 173.938 173.938 177.376 -3.438 25342 8938 1 11 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.186 -2.749 25342 8939 1 11 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.904 -2.641 25342 8940 1 11 . 1 1 103 103 LYS H H 103 6.881 6.881 8.216 -1.335 25342 8941 1 11 . 1 1 104 104 ASN N N 104 114.951 114.951 116.864 -1.913 25342 8942 1 11 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.839 -0.108 25342 8943 1 11 . 1 1 104 104 ASN C C 104 172.617 172.617 175.738 -3.121 25342 8944 1 11 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.879 -3.613 25342 8945 1 11 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.317 -2.534 25342 8946 1 11 . 1 1 104 104 ASN H H 104 8.493 8.493 8.454 0.039 25342 8947 1 11 . 1 1 105 105 TYR N N 105 122.680 122.680 120.013 2.667 25342 8948 1 11 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.554 0.008 25342 8949 1 11 . 1 1 105 105 TYR CA C 105 55.433 55.433 56.939 -1.506 25342 8950 1 11 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.217 -3.385 25342 8951 1 11 . 1 1 105 105 TYR H H 105 8.217 8.217 7.909 0.308 25342 8952 1 11 . 1 1 106 106 ARG N N 106 128.872 128.872 119.455 9.417 25342 8953 1 11 . 1 1 106 106 ARG HA H 106 4.265 4.265 3.963 0.302 25342 8954 1 11 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.789 -1.808 25342 8955 1 11 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.459 -5.329 25342 8956 1 11 . 1 1 106 106 ARG H H 106 8.801 8.801 8.292 0.509 25342 8957 1 11 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.753 -2.352 25342 8958 1 11 . 1 1 108 108 GLU N N 108 117.000 117.000 119.964 -2.964 25342 8959 1 11 . 1 1 108 108 GLU HA H 108 4.626 4.626 5.013 -0.387 25342 8960 1 11 . 1 1 108 108 GLU C C 108 174.125 174.125 175.209 -1.084 25342 8961 1 11 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.501 -1.713 25342 8962 1 11 . 1 1 108 108 GLU CB C 108 30.440 30.440 33.188 -2.748 25342 8963 1 11 . 1 1 108 108 GLU H H 108 7.514 7.514 8.366 -0.852 25342 8964 1 11 . 1 1 109 109 VAL N N 109 123.398 123.398 120.484 2.914 25342 8965 1 11 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.958 0.379 25342 8966 1 11 . 1 1 109 109 VAL C C 109 170.606 170.606 173.651 -3.045 25342 8967 1 11 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.796 -3.516 25342 8968 1 11 . 1 1 109 109 VAL CB C 109 32.657 32.657 36.127 -3.470 25342 8969 1 11 . 1 1 109 109 VAL H H 109 8.942 8.942 8.342 0.600 25342 8970 1 11 . 1 1 110 110 ALA N N 110 127.905 127.905 128.140 -0.235 25342 8971 1 11 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.058 -0.431 25342 8972 1 11 . 1 1 110 110 ALA C C 110 173.195 173.195 175.082 -1.887 25342 8973 1 11 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.538 -2.192 25342 8974 1 11 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.143 -3.818 25342 8975 1 11 . 1 1 110 110 ALA H H 110 8.776 8.776 8.307 0.469 25342 8976 1 11 . 1 1 111 111 SER N N 111 110.523 110.523 113.960 -3.437 25342 8977 1 11 . 1 1 111 111 SER HA H 111 5.562 5.562 5.389 0.173 25342 8978 1 11 . 1 1 111 111 SER C C 111 170.719 170.719 172.608 -1.889 25342 8979 1 11 . 1 1 111 111 SER CA C 111 51.314 51.314 57.102 -5.788 25342 8980 1 11 . 1 1 111 111 SER CB C 111 61.907 61.907 66.172 -4.265 25342 8981 1 11 . 1 1 111 111 SER H H 111 7.480 7.480 7.844 -0.364 25342 8982 1 11 . 1 1 112 112 PHE N N 112 125.567 125.567 126.350 -0.783 25342 8983 1 11 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.597 0.759 25342 8984 1 11 . 1 1 112 112 PHE C C 112 169.536 169.536 172.769 -3.233 25342 8985 1 11 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.991 -5.620 25342 8986 1 11 . 1 1 112 112 PHE CB C 112 39.788 39.788 42.863 -3.075 25342 8987 1 11 . 1 1 112 112 PHE H H 112 7.848 7.848 8.766 -0.918 25342 8988 1 11 . 1 1 113 113 PHE N N 113 115.065 115.065 120.622 -5.557 25342 8989 1 11 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.271 0.833 25342 8990 1 11 . 1 1 113 113 PHE C C 113 173.006 173.006 174.309 -1.303 25342 8991 1 11 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.821 -5.559 25342 8992 1 11 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.413 -4.664 25342 8993 1 11 . 1 1 113 113 PHE H H 113 7.361 7.361 7.427 -0.066 25342 8994 1 11 . 1 1 114 114 THR N N 114 108.014 108.014 112.071 -4.057 25342 8995 1 11 . 1 1 114 114 THR HA H 114 4.999 4.999 4.525 0.474 25342 8996 1 11 . 1 1 114 114 THR C C 114 169.874 169.874 174.051 -4.177 25342 8997 1 11 . 1 1 114 114 THR CA C 114 56.500 56.500 60.879 -4.379 25342 8998 1 11 . 1 1 114 114 THR CB C 114 68.809 68.809 67.950 0.859 25342 8999 1 11 . 1 1 114 114 THR H H 114 7.867 7.867 8.608 -0.741 25342 9000 1 11 . 1 1 115 115 SER N N 115 115.049 115.049 118.014 -2.965 25342 9001 1 11 . 1 1 115 115 SER HA H 115 5.613 5.613 4.292 1.321 25342 9002 1 11 . 1 1 115 115 SER C C 115 171.247 171.247 175.543 -4.296 25342 9003 1 11 . 1 1 115 115 SER CA C 115 54.830 54.830 57.166 -2.336 25342 9004 1 11 . 1 1 115 115 SER CB C 115 63.992 63.992 64.051 -0.059 25342 9005 1 11 . 1 1 115 115 SER H H 115 8.970 8.970 7.773 1.197 25342 9006 1 11 . 1 1 116 116 ALA N N 116 122.671 122.671 124.637 -1.966 25342 9007 1 11 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.310 0.675 25342 9008 1 11 . 1 1 116 116 ALA C C 116 176.180 176.180 177.399 -1.219 25342 9009 1 11 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.161 -1.961 25342 9010 1 11 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.687 -1.692 25342 9011 1 11 . 1 1 116 116 ALA H H 116 8.963 8.963 8.644 0.319 25342 9012 1 11 . 1 1 117 117 GLY N N 117 107.387 107.387 108.173 -0.786 25342 9013 1 11 . 1 1 117 117 GLY C C 117 172.528 172.528 173.897 -1.369 25342 9014 1 11 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.600 -1.868 25342 9015 1 11 . 1 1 117 117 GLY H H 117 9.340 9.340 7.677 1.663 25342 9016 1 11 . 1 1 118 118 THR N N 118 113.481 113.481 111.266 2.215 25342 9017 1 11 . 1 1 118 118 THR HA H 118 4.651 4.651 4.615 0.036 25342 9018 1 11 . 1 1 118 118 THR C C 118 172.067 172.067 174.714 -2.647 25342 9019 1 11 . 1 1 118 118 THR CA C 118 57.357 57.357 59.989 -2.632 25342 9020 1 11 . 1 1 118 118 THR CB C 118 69.475 69.475 71.242 -1.767 25342 9021 1 11 . 1 1 118 118 THR H H 118 9.373 9.373 7.628 1.745 25342 9022 1 11 . 1 1 119 119 ASN N N 119 113.202 113.202 119.634 -6.432 25342 9023 1 11 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.258 0.360 25342 9024 1 11 . 1 1 119 119 ASN C C 119 173.114 173.114 176.276 -3.162 25342 9025 1 11 . 1 1 119 119 ASN CA C 119 51.684 51.684 55.291 -3.607 25342 9026 1 11 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.223 -3.493 25342 9027 1 11 . 1 1 119 119 ASN H H 119 8.908 8.908 8.855 0.053 25342 9028 1 11 . 1 1 120 120 HIS N N 120 117.315 117.315 117.629 -0.314 25342 9029 1 11 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.615 -0.829 25342 9030 1 11 . 1 1 120 120 HIS C C 120 174.381 174.381 176.455 -2.074 25342 9031 1 11 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.120 -3.604 25342 9032 1 11 . 1 1 120 120 HIS CB C 120 26.504 26.504 30.079 -3.575 25342 9033 1 11 . 1 1 120 120 HIS H H 120 8.074 8.074 8.613 -0.539 25342 9034 1 11 . 1 1 121 121 LYS N N 121 118.678 118.678 119.060 -0.382 25342 9035 1 11 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.018 -0.184 25342 9036 1 11 . 1 1 121 121 LYS C C 121 176.564 176.564 177.928 -1.364 25342 9037 1 11 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.640 -1.345 25342 9038 1 11 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.396 -3.454 25342 9039 1 11 . 1 1 121 121 LYS H H 121 8.336 8.336 8.386 -0.050 25342 9040 1 11 . 1 1 122 122 ALA N N 122 122.146 122.146 122.279 -0.133 25342 9041 1 11 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.236 -0.541 25342 9042 1 11 . 1 1 122 122 ALA C C 122 175.163 175.163 179.544 -4.381 25342 9043 1 11 . 1 1 122 122 ALA CA C 122 51.692 51.692 55.164 -3.472 25342 9044 1 11 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.256 -2.538 25342 9045 1 11 . 1 1 122 122 ALA H H 122 7.584 7.584 7.888 -0.304 25342 9046 1 11 . 1 1 123 123 TYR N N 123 119.730 119.730 118.159 1.571 25342 9047 1 11 . 1 1 123 123 TYR HA H 123 3.153 3.153 3.651 -0.498 25342 9048 1 11 . 1 1 123 123 TYR C C 123 174.340 174.340 177.879 -3.539 25342 9049 1 11 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.717 -0.319 25342 9050 1 11 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.282 -2.619 25342 9051 1 11 . 1 1 123 123 TYR H H 123 7.317 7.317 7.833 -0.516 25342 9052 1 11 . 1 1 124 124 VAL N N 124 118.649 118.649 118.062 0.587 25342 9053 1 11 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.261 -0.059 25342 9054 1 11 . 1 1 124 124 VAL C C 124 175.603 175.603 177.511 -1.908 25342 9055 1 11 . 1 1 124 124 VAL CA C 124 64.680 64.680 64.864 -0.184 25342 9056 1 11 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.524 -1.235 25342 9057 1 11 . 1 1 124 124 VAL H H 124 7.799 7.799 7.164 0.635 25342 9058 1 11 . 1 1 125 125 SER N N 125 114.475 114.475 113.792 0.683 25342 9059 1 11 . 1 1 125 125 SER HA H 125 4.032 4.032 4.449 -0.417 25342 9060 1 11 . 1 1 125 125 SER C C 125 174.849 174.849 175.824 -0.975 25342 9061 1 11 . 1 1 125 125 SER CA C 125 59.002 59.002 60.473 -1.471 25342 9062 1 11 . 1 1 125 125 SER CB C 125 59.613 59.613 64.480 -4.867 25342 9063 1 11 . 1 1 125 125 SER H H 125 7.766 7.766 8.129 -0.363 25342 9064 1 11 . 1 1 126 126 HIS N N 126 119.326 119.326 120.393 -1.067 25342 9065 1 11 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.502 -0.375 25342 9066 1 11 . 1 1 126 126 HIS C C 126 172.865 172.865 177.573 -4.708 25342 9067 1 11 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.074 -3.368 25342 9068 1 11 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.361 -4.368 25342 9069 1 11 . 1 1 126 126 HIS H H 126 8.569 8.569 8.611 -0.042 25342 9070 1 11 . 1 1 127 127 PHE N N 127 121.044 121.044 121.320 -0.276 25342 9071 1 11 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.447 -1.273 25342 9072 1 11 . 1 1 127 127 PHE C C 127 173.378 173.378 176.932 -3.554 25342 9073 1 11 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.370 0.497 25342 9074 1 11 . 1 1 127 127 PHE CB C 127 36.054 36.054 38.646 -2.592 25342 9075 1 11 . 1 1 127 127 PHE H H 127 9.139 9.139 7.534 1.605 25342 9076 1 11 . 1 1 128 128 ASN N N 128 114.893 114.893 117.551 -2.658 25342 9077 1 11 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.269 -0.229 25342 9078 1 11 . 1 1 128 128 ASN C C 128 175.230 175.230 176.114 -0.884 25342 9079 1 11 . 1 1 128 128 ASN CA C 128 54.300 54.300 55.127 -0.827 25342 9080 1 11 . 1 1 128 128 ASN CB C 128 36.171 36.171 37.782 -1.611 25342 9081 1 11 . 1 1 128 128 ASN H H 128 7.774 7.774 7.623 0.151 25342 9082 1 11 . 1 1 129 129 GLU N N 129 119.804 119.804 116.212 3.592 25342 9083 1 11 . 1 1 129 129 GLU HA H 129 4.040 4.040 4.020 0.020 25342 9084 1 11 . 1 1 129 129 GLU C C 129 177.052 177.052 176.609 0.443 25342 9085 1 11 . 1 1 129 129 GLU CA C 129 56.730 56.730 56.892 -0.162 25342 9086 1 11 . 1 1 129 129 GLU CB C 129 27.196 27.196 30.099 -2.903 25342 9087 1 11 . 1 1 129 129 GLU H H 129 7.577 7.577 7.641 -0.064 25342 9088 1 11 . 1 1 130 130 TRP N N 130 120.979 120.979 119.095 1.884 25342 9089 1 11 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.760 -0.303 25342 9090 1 11 . 1 1 130 130 TRP C C 130 174.329 174.329 174.626 -0.297 25342 9091 1 11 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.662 -1.974 25342 9092 1 11 . 1 1 130 130 TRP CB C 130 26.991 26.991 30.760 -3.769 25342 9093 1 11 . 1 1 130 130 TRP H H 130 8.225 8.225 7.559 0.666 25342 9094 1 11 . 1 1 131 131 ALA N N 131 120.450 120.450 119.275 1.175 25342 9095 1 11 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.403 -0.467 25342 9096 1 11 . 1 1 131 131 ALA C C 131 172.487 172.487 175.780 -3.293 25342 9097 1 11 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.023 -2.589 25342 9098 1 11 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.398 -3.110 25342 9099 1 11 . 1 1 131 131 ALA H H 131 8.081 8.081 7.099 0.982 25342 9100 1 11 . 1 1 132 132 ASP N N 132 117.813 117.813 120.807 -2.994 25342 9101 1 11 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.415 -0.207 25342 9102 1 11 . 1 1 132 132 ASP C C 132 173.804 173.804 177.169 -3.365 25342 9103 1 11 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.734 -1.553 25342 9104 1 11 . 1 1 132 132 ASP CB C 132 39.321 39.321 41.146 -1.825 25342 9105 1 11 . 1 1 132 132 ASP H H 132 6.772 6.772 7.696 -0.924 25342 9106 1 11 . 1 1 133 133 GLY N N 133 115.052 115.052 111.755 3.297 25342 9107 1 11 . 1 1 133 133 GLY C C 133 172.078 172.078 173.486 -1.408 25342 9108 1 11 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.867 -2.447 25342 9109 1 11 . 1 1 133 133 GLY H H 133 8.626 8.626 8.646 -0.020 25342 9110 1 11 . 1 1 134 134 LEU N N 134 120.063 120.063 119.439 0.624 25342 9111 1 11 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.653 -0.181 25342 9112 1 11 . 1 1 134 134 LEU C C 134 174.079 174.079 175.323 -1.244 25342 9113 1 11 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.908 -2.944 25342 9114 1 11 . 1 1 134 134 LEU CB C 134 40.370 40.370 45.083 -4.713 25342 9115 1 11 . 1 1 134 134 LEU H H 134 8.094 8.094 7.675 0.419 25342 9116 1 11 . 1 1 135 135 ASN N N 135 119.292 119.292 123.125 -3.833 25342 9117 1 11 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.773 -0.150 25342 9118 1 11 . 1 1 135 135 ASN C C 135 170.527 170.527 174.556 -4.029 25342 9119 1 11 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.654 -3.652 25342 9120 1 11 . 1 1 135 135 ASN CB C 135 33.560 33.560 37.921 -4.361 25342 9121 1 11 . 1 1 135 135 ASN H H 135 8.513 8.513 8.897 -0.384 25342 9122 1 11 . 1 1 136 136 VAL N N 136 125.412 125.412 124.445 0.967 25342 9123 1 11 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.249 0.357 25342 9124 1 11 . 1 1 136 136 VAL C C 136 175.420 175.420 176.872 -1.452 25342 9125 1 11 . 1 1 136 136 VAL CA C 136 58.382 58.382 63.596 -5.215 25342 9126 1 11 . 1 1 136 136 VAL CB C 136 29.247 29.247 32.205 -2.958 25342 9127 1 11 . 1 1 136 136 VAL H H 136 7.648 7.648 7.933 -0.285 25342 9128 1 11 . 1 1 137 137 ILE N N 137 121.881 121.881 122.473 -0.592 25342 9129 1 11 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.557 -0.124 25342 9130 1 11 . 1 1 137 137 ILE C C 137 173.906 173.906 175.727 -1.821 25342 9131 1 11 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.032 -2.054 25342 9132 1 11 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.904 -2.708 25342 9133 1 11 . 1 1 137 137 ILE H H 137 9.139 9.139 8.726 0.413 25342 9134 1 11 . 1 1 138 138 GLY N N 138 108.226 108.226 107.776 0.450 25342 9135 1 11 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.306 -1.915 25342 9136 1 11 . 1 1 138 138 GLY H H 138 6.645 6.645 7.512 -0.867 25342 9137 1 11 . 1 1 139 139 VAL N N 139 119.408 119.408 117.878 1.530 25342 9138 1 11 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.487 -0.130 25342 9139 1 11 . 1 1 139 139 VAL C C 139 172.327 172.327 174.090 -1.763 25342 9140 1 11 . 1 1 139 139 VAL CA C 139 58.267 58.267 59.913 -1.646 25342 9141 1 11 . 1 1 139 139 VAL CB C 139 32.743 32.743 35.750 -3.007 25342 9142 1 11 . 1 1 139 139 VAL H H 139 8.092 8.092 8.457 -0.365 25342 9143 1 11 . 1 1 140 140 ALA N N 140 127.415 127.415 127.013 0.402 25342 9144 1 11 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.081 -0.636 25342 9145 1 11 . 1 1 140 140 ALA C C 140 170.718 170.718 175.952 -5.234 25342 9146 1 11 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.918 -2.018 25342 9147 1 11 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.293 -1.234 25342 9148 1 11 . 1 1 140 140 ALA H H 140 9.093 9.093 9.344 -0.251 25342 9149 1 11 . 1 1 141 141 ARG N N 141 119.287 119.287 119.442 -0.155 25342 9150 1 11 . 1 1 141 141 ARG HA H 141 2.487 2.487 4.719 -2.232 25342 9151 1 11 . 1 1 141 141 ARG C C 141 173.375 173.375 175.667 -2.292 25342 9152 1 11 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.357 -2.473 25342 9153 1 11 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.056 -4.372 25342 9154 1 11 . 1 1 141 141 ARG H H 141 7.620 7.620 8.415 -0.795 25342 9155 1 11 . 1 1 142 142 ASP N N 142 125.999 125.999 121.115 4.884 25342 9156 1 11 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.581 -0.857 25342 9157 1 11 . 1 1 142 142 ASP C C 142 169.292 169.292 176.197 -6.905 25342 9158 1 11 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.438 -3.100 25342 9159 1 11 . 1 1 142 142 ASP CB C 142 36.677 36.677 41.104 -4.427 25342 9160 1 11 . 1 1 142 142 ASP H H 142 9.482 9.482 8.162 1.320 25342 9161 1 11 . 1 1 143 143 ASP N N 143 119.293 119.293 119.365 -0.072 25342 9162 1 11 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.771 -0.465 25342 9163 1 11 . 1 1 143 143 ASP C C 143 175.686 175.686 177.047 -1.361 25342 9164 1 11 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.802 -4.897 25342 9165 1 11 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.835 -4.523 25342 9166 1 11 . 1 1 143 143 ASP H H 143 8.108 8.108 8.775 -0.667 25342 9167 1 11 . 1 1 144 144 SER N N 144 115.303 115.303 117.093 -1.790 25342 9168 1 11 . 1 1 144 144 SER HA H 144 3.740 3.740 4.282 -0.542 25342 9169 1 11 . 1 1 144 144 SER C C 144 172.925 172.925 175.377 -2.452 25342 9170 1 11 . 1 1 144 144 SER CA C 144 59.213 59.213 60.802 -1.589 25342 9171 1 11 . 1 1 144 144 SER CB C 144 60.806 60.806 63.275 -2.469 25342 9172 1 11 . 1 1 144 144 SER H H 144 7.642 7.642 8.585 -0.943 25342 9173 1 11 . 1 1 145 145 GLU N N 145 119.523 119.523 119.455 0.068 25342 9174 1 11 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.109 0.197 25342 9175 1 11 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.016 -2.977 25342 9176 1 11 . 1 1 145 145 GLU CB C 145 26.800 26.800 27.865 -1.065 25342 9177 1 11 . 1 1 145 145 GLU H H 145 7.771 7.771 8.349 -0.578 25342 9178 1 11 . 1 1 146 146 VAL N N 146 118.683 118.683 119.967 -1.284 25342 9179 1 11 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.570 -0.629 25342 9180 1 11 . 1 1 146 146 VAL C C 146 174.591 174.591 176.932 -2.341 25342 9181 1 11 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.802 -2.870 25342 9182 1 11 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.650 -2.603 25342 9183 1 11 . 1 1 146 146 VAL H H 146 6.352 6.352 7.225 -0.873 25342 9184 1 11 . 1 1 147 147 ASP N N 147 119.312 119.312 117.644 1.668 25342 9185 1 11 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.373 -0.318 25342 9186 1 11 . 1 1 147 147 ASP C C 147 174.783 174.783 178.036 -3.253 25342 9187 1 11 . 1 1 147 147 ASP CA C 147 54.241 54.241 57.001 -2.760 25342 9188 1 11 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.913 -3.680 25342 9189 1 11 . 1 1 147 147 ASP H H 147 8.370 8.370 8.553 -0.183 25342 9190 1 11 . 1 1 148 148 LYS N N 148 119.342 119.342 118.386 0.956 25342 9191 1 11 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.375 -0.438 25342 9192 1 11 . 1 1 148 148 LYS C C 148 176.384 176.384 178.787 -2.403 25342 9193 1 11 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.957 -2.251 25342 9194 1 11 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.441 -2.930 25342 9195 1 11 . 1 1 148 148 LYS H H 148 7.040 7.040 7.720 -0.680 25342 9196 1 11 . 1 1 149 149 TRP N N 149 118.258 118.258 119.610 -1.352 25342 9197 1 11 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.824 -0.233 25342 9198 1 11 . 1 1 149 149 TRP C C 149 174.212 174.212 175.975 -1.763 25342 9199 1 11 . 1 1 149 149 TRP CA C 149 53.745 53.745 56.477 -2.732 25342 9200 1 11 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.931 -1.991 25342 9201 1 11 . 1 1 149 149 TRP H H 149 7.811 7.811 7.491 0.320 25342 9202 1 11 . 1 1 150 150 SER N N 150 109.618 109.618 114.609 -4.991 25342 9203 1 11 . 1 1 150 150 SER HA H 150 4.234 4.234 4.683 -0.449 25342 9204 1 11 . 1 1 150 150 SER C C 150 170.189 170.189 173.672 -3.483 25342 9205 1 11 . 1 1 150 150 SER CA C 150 56.695 56.695 57.657 -0.963 25342 9206 1 11 . 1 1 150 150 SER CB C 150 61.935 61.935 63.328 -1.393 25342 9207 1 11 . 1 1 150 150 SER H H 150 7.793 7.793 7.629 0.164 25342 9208 1 12 . 1 1 3 3 ALA N N 3 125.638 125.638 126.857 -1.219 25342 9209 1 12 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.503 -0.138 25342 9210 1 12 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.050 -2.752 25342 9211 1 12 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.895 -3.035 25342 9212 1 12 . 1 1 3 3 ALA H H 3 8.325 8.325 8.374 -0.049 25342 9213 1 12 . 1 1 4 4 LYS N N 4 121.813 121.813 121.221 0.592 25342 9214 1 12 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.626 -0.399 25342 9215 1 12 . 1 1 4 4 LYS C C 4 174.574 174.574 174.164 0.410 25342 9216 1 12 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.746 -1.965 25342 9217 1 12 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.401 -2.912 25342 9218 1 12 . 1 1 4 4 LYS H H 4 8.486 8.486 7.991 0.495 25342 9219 1 12 . 1 1 5 5 LYS N N 5 129.722 129.722 123.086 6.636 25342 9220 1 12 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.665 -0.147 25342 9221 1 12 . 1 1 5 5 LYS C C 5 174.720 174.720 174.465 0.255 25342 9222 1 12 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.875 -1.153 25342 9223 1 12 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.497 -6.712 25342 9224 1 12 . 1 1 5 5 LYS H H 5 10.015 10.015 8.213 1.802 25342 9225 1 12 . 1 1 6 6 THR N N 6 126.254 126.254 116.289 9.965 25342 9226 1 12 . 1 1 6 6 THR HA H 6 5.654 5.654 5.321 0.333 25342 9227 1 12 . 1 1 6 6 THR C C 6 169.926 169.926 173.074 -3.148 25342 9228 1 12 . 1 1 6 6 THR CA C 6 60.598 60.598 62.491 -1.893 25342 9229 1 12 . 1 1 6 6 THR CB C 6 68.041 68.041 70.292 -2.251 25342 9230 1 12 . 1 1 6 6 THR H H 6 8.538 8.538 8.788 -0.250 25342 9231 1 12 . 1 1 7 7 LEU N N 7 130.775 130.775 127.898 2.877 25342 9232 1 12 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.706 -0.112 25342 9233 1 12 . 1 1 7 7 LEU C C 7 170.404 170.404 174.449 -4.045 25342 9234 1 12 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.010 -3.077 25342 9235 1 12 . 1 1 7 7 LEU CB C 7 40.728 40.728 45.146 -4.418 25342 9236 1 12 . 1 1 7 7 LEU H H 7 8.575 8.575 8.090 0.485 25342 9237 1 12 . 1 1 8 8 ILE N N 8 127.242 127.242 122.224 5.018 25342 9238 1 12 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.768 0.080 25342 9239 1 12 . 1 1 8 8 ILE C C 8 170.936 170.936 174.611 -3.675 25342 9240 1 12 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.428 -3.176 25342 9241 1 12 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.128 -3.193 25342 9242 1 12 . 1 1 8 8 ILE H H 8 9.217 9.217 7.708 1.509 25342 9243 1 12 . 1 1 9 9 LEU N N 9 127.183 127.183 127.949 -0.766 25342 9244 1 12 . 1 1 9 9 LEU HA H 9 5.694 5.694 5.013 0.681 25342 9245 1 12 . 1 1 9 9 LEU C C 9 173.824 173.824 175.706 -1.882 25342 9246 1 12 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.023 -4.184 25342 9247 1 12 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.952 1.011 25342 9248 1 12 . 1 1 9 9 LEU H H 9 9.248 9.248 9.092 0.156 25342 9249 1 12 . 1 1 10 10 TYR N N 10 113.330 113.330 122.487 -9.157 25342 9250 1 12 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.419 0.095 25342 9251 1 12 . 1 1 10 10 TYR C C 10 167.898 167.898 172.957 -5.059 25342 9252 1 12 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.343 -0.468 25342 9253 1 12 . 1 1 10 10 TYR CB C 10 38.436 38.436 41.256 -2.820 25342 9254 1 12 . 1 1 10 10 TYR H H 10 7.306 7.306 8.763 -1.457 25342 9255 1 12 . 1 1 11 11 TYR N N 11 121.297 121.297 122.931 -1.634 25342 9256 1 12 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.108 -0.346 25342 9257 1 12 . 1 1 11 11 TYR C C 11 169.698 169.698 174.667 -4.969 25342 9258 1 12 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.383 -0.336 25342 9259 1 12 . 1 1 11 11 TYR CB C 11 40.538 40.538 39.230 1.308 25342 9260 1 12 . 1 1 11 11 TYR H H 11 7.891 7.891 8.432 -0.541 25342 9261 1 12 . 1 1 12 12 SER N N 12 117.763 117.763 124.067 -6.304 25342 9262 1 12 . 1 1 12 12 SER HA H 12 4.679 4.679 3.766 0.913 25342 9263 1 12 . 1 1 12 12 SER C C 12 170.075 170.075 173.937 -3.862 25342 9264 1 12 . 1 1 12 12 SER CA C 12 53.619 53.619 57.020 -3.401 25342 9265 1 12 . 1 1 12 12 SER CB C 12 62.847 62.847 62.323 0.524 25342 9266 1 12 . 1 1 12 12 SER H H 12 7.557 7.557 7.878 -0.321 25342 9267 1 12 . 1 1 13 13 TRP N N 13 135.232 135.232 129.726 5.506 25342 9268 1 12 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.472 1.164 25342 9269 1 12 . 1 1 13 13 TRP C C 13 175.708 175.708 176.202 -0.494 25342 9270 1 12 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.247 -2.131 25342 9271 1 12 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.631 -1.996 25342 9272 1 12 . 1 1 13 13 TRP H H 13 9.755 9.755 7.768 1.987 25342 9273 1 12 . 1 1 14 14 SER N N 14 113.789 113.789 112.483 1.306 25342 9274 1 12 . 1 1 14 14 SER HA H 14 4.223 4.223 4.441 -0.218 25342 9275 1 12 . 1 1 14 14 SER C C 14 172.747 172.747 174.064 -1.317 25342 9276 1 12 . 1 1 14 14 SER CA C 14 53.828 53.828 58.175 -4.347 25342 9277 1 12 . 1 1 14 14 SER CB C 14 60.037 60.037 62.331 -2.295 25342 9278 1 12 . 1 1 14 14 SER H H 14 10.026 10.026 8.313 1.713 25342 9279 1 12 . 1 1 15 15 GLY N N 15 110.489 110.489 109.212 1.277 25342 9280 1 12 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.516 -0.857 25342 9281 1 12 . 1 1 15 15 GLY H H 15 7.391 7.391 8.405 -1.014 25342 9282 1 12 . 1 1 16 16 GLU N N 16 129.005 129.005 118.899 10.106 25342 9283 1 12 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.369 -0.306 25342 9284 1 12 . 1 1 16 16 GLU CA C 16 56.761 56.761 56.616 0.145 25342 9285 1 12 . 1 1 16 16 GLU CB C 16 26.412 26.412 30.639 -4.227 25342 9286 1 12 . 1 1 16 16 GLU H H 16 11.550 11.550 8.459 3.091 25342 9287 1 12 . 1 1 17 17 THR N N 17 123.016 123.016 115.574 7.442 25342 9288 1 12 . 1 1 17 17 THR HA H 17 4.035 4.035 4.045 -0.010 25342 9289 1 12 . 1 1 17 17 THR C C 17 173.360 173.360 176.353 -2.993 25342 9290 1 12 . 1 1 17 17 THR CA C 17 64.303 64.303 65.324 -1.021 25342 9291 1 12 . 1 1 17 17 THR CB C 17 63.999 63.999 67.993 -3.994 25342 9292 1 12 . 1 1 17 17 THR H H 17 11.293 11.293 8.352 2.941 25342 9293 1 12 . 1 1 18 18 LYS N N 18 120.156 120.156 122.122 -1.966 25342 9294 1 12 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.273 -1.417 25342 9295 1 12 . 1 1 18 18 LYS C C 18 173.901 173.901 178.546 -4.645 25342 9296 1 12 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.570 -2.736 25342 9297 1 12 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.375 -2.894 25342 9298 1 12 . 1 1 18 18 LYS H H 18 6.940 6.940 8.068 -1.128 25342 9299 1 12 . 1 1 19 19 LYS N N 19 117.237 117.237 118.393 -1.156 25342 9300 1 12 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.230 -0.307 25342 9301 1 12 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.623 -2.299 25342 9302 1 12 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.188 -2.827 25342 9303 1 12 . 1 1 19 19 LYS H H 19 7.212 7.212 7.937 -0.725 25342 9304 1 12 . 1 1 20 20 MET N N 20 119.268 119.268 115.853 3.415 25342 9305 1 12 . 1 1 20 20 MET HA H 20 4.413 4.413 4.401 0.012 25342 9306 1 12 . 1 1 20 20 MET C C 20 173.625 173.625 174.795 -1.170 25342 9307 1 12 . 1 1 20 20 MET CA C 20 52.261 52.261 54.121 -1.860 25342 9308 1 12 . 1 1 20 20 MET CB C 20 26.680 26.680 30.753 -4.073 25342 9309 1 12 . 1 1 20 20 MET H H 20 7.600 7.600 7.545 0.055 25342 9310 1 12 . 1 1 21 21 ALA N N 21 123.669 123.669 120.927 2.742 25342 9311 1 12 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.501 -1.019 25342 9312 1 12 . 1 1 21 21 ALA C C 21 176.628 176.628 178.681 -2.053 25342 9313 1 12 . 1 1 21 21 ALA CA C 21 52.374 52.374 53.145 -0.771 25342 9314 1 12 . 1 1 21 21 ALA CB C 21 16.495 16.495 19.784 -3.289 25342 9315 1 12 . 1 1 21 21 ALA H H 21 8.738 8.738 7.589 1.149 25342 9316 1 12 . 1 1 22 22 GLU N N 22 117.242 117.242 120.303 -3.061 25342 9317 1 12 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.809 -0.136 25342 9318 1 12 . 1 1 22 22 GLU C C 22 176.698 176.698 178.930 -2.232 25342 9319 1 12 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.782 -3.242 25342 9320 1 12 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.411 -2.977 25342 9321 1 12 . 1 1 22 22 GLU H H 22 7.959 7.959 7.819 0.140 25342 9322 1 12 . 1 1 23 23 LYS N N 23 123.302 123.302 119.022 4.280 25342 9323 1 12 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.021 -0.200 25342 9324 1 12 . 1 1 23 23 LYS C C 23 177.389 177.389 179.165 -1.776 25342 9325 1 12 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.168 -2.246 25342 9326 1 12 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.234 -2.720 25342 9327 1 12 . 1 1 23 23 LYS H H 23 7.703 7.703 7.493 0.210 25342 9328 1 12 . 1 1 24 24 ILE N N 24 122.208 122.208 117.262 4.946 25342 9329 1 12 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.704 -0.421 25342 9330 1 12 . 1 1 24 24 ILE C C 24 174.934 174.934 178.176 -3.242 25342 9331 1 12 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.512 -1.220 25342 9332 1 12 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.697 -2.958 25342 9333 1 12 . 1 1 24 24 ILE H H 24 8.535 8.535 7.419 1.116 25342 9334 1 12 . 1 1 25 25 ASN N N 25 118.640 118.640 117.947 0.693 25342 9335 1 12 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.378 -0.151 25342 9336 1 12 . 1 1 25 25 ASN C C 25 173.530 173.530 177.462 -3.932 25342 9337 1 12 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.188 -3.977 25342 9338 1 12 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.503 -0.399 25342 9339 1 12 . 1 1 25 25 ASN H H 25 8.317 8.317 8.257 0.061 25342 9340 1 12 . 1 1 26 26 SER N N 26 111.990 111.990 113.717 -1.727 25342 9341 1 12 . 1 1 26 26 SER HA H 26 4.153 4.153 4.314 -0.161 25342 9342 1 12 . 1 1 26 26 SER C C 26 172.110 172.110 174.971 -2.861 25342 9343 1 12 . 1 1 26 26 SER CA C 26 57.905 57.905 60.085 -2.180 25342 9344 1 12 . 1 1 26 26 SER CB C 26 60.655 60.655 63.429 -2.774 25342 9345 1 12 . 1 1 26 26 SER H H 26 7.369 7.369 7.666 -0.297 25342 9346 1 12 . 1 1 27 27 GLU N N 27 120.201 120.201 119.206 0.995 25342 9347 1 12 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.405 -0.304 25342 9348 1 12 . 1 1 27 27 GLU C C 27 173.673 173.673 175.637 -1.964 25342 9349 1 12 . 1 1 27 27 GLU CA C 27 54.235 54.235 55.784 -1.549 25342 9350 1 12 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.118 -3.517 25342 9351 1 12 . 1 1 27 27 GLU H H 27 7.451 7.451 7.670 -0.219 25342 9352 1 12 . 1 1 28 28 ILE N N 28 118.762 118.762 118.039 0.723 25342 9353 1 12 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.343 -0.144 25342 9354 1 12 . 1 1 28 28 ILE C C 28 172.487 172.487 175.290 -2.803 25342 9355 1 12 . 1 1 28 28 ILE CA C 28 57.732 57.732 59.659 -1.927 25342 9356 1 12 . 1 1 28 28 ILE CB C 28 35.738 35.738 41.176 -5.438 25342 9357 1 12 . 1 1 28 28 ILE H H 28 7.255 7.255 7.349 -0.094 25342 9358 1 12 . 1 1 29 29 LYS N N 29 130.563 130.563 122.309 8.254 25342 9359 1 12 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.226 -0.224 25342 9360 1 12 . 1 1 29 29 LYS C C 29 174.386 174.386 176.638 -2.252 25342 9361 1 12 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.753 -1.218 25342 9362 1 12 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.798 -3.212 25342 9363 1 12 . 1 1 29 29 LYS H H 29 8.564 8.564 8.483 0.081 25342 9364 1 12 . 1 1 30 30 ASP N N 30 119.357 119.357 119.481 -0.124 25342 9365 1 12 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.479 -0.077 25342 9366 1 12 . 1 1 30 30 ASP C C 30 172.570 172.570 174.969 -2.399 25342 9367 1 12 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.831 -1.395 25342 9368 1 12 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.533 -2.789 25342 9369 1 12 . 1 1 30 30 ASP H H 30 8.920 8.920 8.664 0.256 25342 9370 1 12 . 1 1 31 31 SER N N 31 114.019 114.019 118.265 -4.246 25342 9371 1 12 . 1 1 31 31 SER HA H 31 4.782 4.782 4.923 -0.141 25342 9372 1 12 . 1 1 31 31 SER C C 31 171.150 171.150 174.155 -3.005 25342 9373 1 12 . 1 1 31 31 SER CA C 31 55.551 55.551 57.252 -1.701 25342 9374 1 12 . 1 1 31 31 SER CB C 31 62.259 62.259 65.916 -3.657 25342 9375 1 12 . 1 1 31 31 SER H H 31 8.006 8.006 8.150 -0.144 25342 9376 1 12 . 1 1 32 32 GLU N N 32 121.455 121.455 123.298 -1.843 25342 9377 1 12 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.341 0.399 25342 9378 1 12 . 1 1 32 32 GLU C C 32 171.185 171.185 175.810 -4.625 25342 9379 1 12 . 1 1 32 32 GLU CA C 32 52.081 52.081 56.045 -3.964 25342 9380 1 12 . 1 1 32 32 GLU CB C 32 30.827 30.827 30.621 0.206 25342 9381 1 12 . 1 1 32 32 GLU H H 32 8.145 8.145 8.700 -0.555 25342 9382 1 12 . 1 1 33 33 LEU N N 33 126.176 126.176 121.659 4.517 25342 9383 1 12 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.393 0.913 25342 9384 1 12 . 1 1 33 33 LEU C C 33 173.365 173.365 175.352 -1.987 25342 9385 1 12 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.410 -2.970 25342 9386 1 12 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.333 0.302 25342 9387 1 12 . 1 1 33 33 LEU H H 33 8.589 8.589 8.363 0.226 25342 9388 1 12 . 1 1 34 34 LYS N N 34 127.200 127.200 125.519 1.681 25342 9389 1 12 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.740 -0.144 25342 9390 1 12 . 1 1 34 34 LYS C C 34 169.622 169.622 174.854 -5.232 25342 9391 1 12 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.131 -1.802 25342 9392 1 12 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.001 -1.801 25342 9393 1 12 . 1 1 34 34 LYS H H 34 9.380 9.380 8.601 0.779 25342 9394 1 12 . 1 1 35 35 GLU N N 35 122.324 122.324 121.725 0.599 25342 9395 1 12 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.492 -2.159 25342 9396 1 12 . 1 1 35 35 GLU C C 35 172.734 172.734 175.697 -2.963 25342 9397 1 12 . 1 1 35 35 GLU CA C 35 52.612 52.612 55.076 -2.464 25342 9398 1 12 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.608 -3.289 25342 9399 1 12 . 1 1 35 35 GLU H H 35 8.094 8.094 8.584 -0.490 25342 9400 1 12 . 1 1 36 36 VAL N N 36 126.781 126.781 121.350 5.431 25342 9401 1 12 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.533 -0.694 25342 9402 1 12 . 1 1 36 36 VAL C C 36 171.482 171.482 175.663 -4.181 25342 9403 1 12 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.781 -1.376 25342 9404 1 12 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.021 -5.673 25342 9405 1 12 . 1 1 36 36 VAL H H 36 8.660 8.660 8.963 -0.303 25342 9406 1 12 . 1 1 37 37 LYS N N 37 126.065 126.065 121.971 4.094 25342 9407 1 12 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.823 0.142 25342 9408 1 12 . 1 1 37 37 LYS C C 37 173.187 173.187 175.413 -2.226 25342 9409 1 12 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.823 -2.543 25342 9410 1 12 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.619 -2.698 25342 9411 1 12 . 1 1 37 37 LYS H H 37 7.809 7.809 8.045 -0.236 25342 9412 1 12 . 1 1 38 38 VAL N N 38 111.020 111.020 115.605 -4.585 25342 9413 1 12 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.815 0.009 25342 9414 1 12 . 1 1 38 38 VAL C C 38 173.604 173.604 175.973 -2.369 25342 9415 1 12 . 1 1 38 38 VAL CA C 38 56.383 56.383 58.821 -2.438 25342 9416 1 12 . 1 1 38 38 VAL CB C 38 32.376 32.376 33.873 -1.497 25342 9417 1 12 . 1 1 38 38 VAL H H 38 8.305 8.305 8.067 0.238 25342 9418 1 12 . 1 1 39 39 SER N N 39 117.887 117.887 114.999 2.888 25342 9419 1 12 . 1 1 39 39 SER HA H 39 4.183 4.183 4.374 -0.191 25342 9420 1 12 . 1 1 39 39 SER C C 39 173.538 173.538 174.744 -1.206 25342 9421 1 12 . 1 1 39 39 SER CA C 39 56.279 56.279 59.195 -2.916 25342 9422 1 12 . 1 1 39 39 SER CB C 39 60.537 60.537 63.711 -3.174 25342 9423 1 12 . 1 1 39 39 SER H H 39 8.847 8.847 8.278 0.569 25342 9424 1 12 . 1 1 40 40 GLU N N 40 126.316 126.316 120.099 6.217 25342 9425 1 12 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.321 -0.167 25342 9426 1 12 . 1 1 40 40 GLU C C 40 174.586 174.586 177.216 -2.630 25342 9427 1 12 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.130 -1.318 25342 9428 1 12 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.931 -3.211 25342 9429 1 12 . 1 1 40 40 GLU H H 40 9.049 9.049 8.737 0.312 25342 9430 1 12 . 1 1 41 41 GLY N N 41 112.494 112.494 113.795 -1.301 25342 9431 1 12 . 1 1 41 41 GLY C C 41 171.994 171.994 175.384 -3.390 25342 9432 1 12 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.851 -3.389 25342 9433 1 12 . 1 1 41 41 GLY H H 41 8.780 8.780 8.880 -0.100 25342 9434 1 12 . 1 1 42 42 THR N N 42 118.631 118.631 114.226 4.405 25342 9435 1 12 . 1 1 42 42 THR HA H 42 3.582 3.582 3.714 -0.132 25342 9436 1 12 . 1 1 42 42 THR C C 42 171.225 171.225 172.957 -1.732 25342 9437 1 12 . 1 1 42 42 THR CA C 42 64.104 64.104 64.612 -0.508 25342 9438 1 12 . 1 1 42 42 THR CB C 42 65.914 65.914 69.176 -3.262 25342 9439 1 12 . 1 1 42 42 THR H H 42 7.737 7.737 7.939 -0.202 25342 9440 1 12 . 1 1 43 43 PHE N N 43 116.279 116.279 113.799 2.480 25342 9441 1 12 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.468 0.552 25342 9442 1 12 . 1 1 43 43 PHE C C 43 170.141 170.141 173.652 -3.511 25342 9443 1 12 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.720 -4.248 25342 9444 1 12 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.519 -4.134 25342 9445 1 12 . 1 1 43 43 PHE H H 43 8.114 8.114 7.256 0.858 25342 9446 1 12 . 1 1 44 44 ASP N N 44 121.513 121.513 119.204 2.309 25342 9447 1 12 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.923 -0.072 25342 9448 1 12 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.176 -2.964 25342 9449 1 12 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.619 -0.234 25342 9450 1 12 . 1 1 44 44 ASP H H 44 7.774 7.774 8.340 -0.566 25342 9451 1 12 . 1 1 45 45 ALA N N 45 125.663 125.663 121.384 4.279 25342 9452 1 12 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.502 -0.291 25342 9453 1 12 . 1 1 45 45 ALA C C 45 175.139 175.139 177.562 -2.423 25342 9454 1 12 . 1 1 45 45 ALA CA C 45 51.436 51.436 53.651 -2.216 25342 9455 1 12 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.212 -2.980 25342 9456 1 12 . 1 1 45 45 ALA H H 45 8.324 8.324 8.408 -0.084 25342 9457 1 12 . 1 1 46 46 ASP N N 46 119.288 119.288 118.755 0.533 25342 9458 1 12 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.739 0.086 25342 9459 1 12 . 1 1 46 46 ASP C C 46 175.013 175.013 177.776 -2.763 25342 9460 1 12 . 1 1 46 46 ASP CA C 46 51.161 51.161 52.816 -1.655 25342 9461 1 12 . 1 1 46 46 ASP CB C 46 41.233 41.233 41.631 -0.398 25342 9462 1 12 . 1 1 46 46 ASP H H 46 9.618 9.618 7.807 1.811 25342 9463 1 12 . 1 1 47 47 MET N N 47 127.347 127.347 121.881 5.466 25342 9464 1 12 . 1 1 47 47 MET HA H 47 3.456 3.456 4.130 -0.674 25342 9465 1 12 . 1 1 47 47 MET C C 47 173.605 173.605 177.833 -4.228 25342 9466 1 12 . 1 1 47 47 MET CA C 47 56.699 56.699 59.003 -2.304 25342 9467 1 12 . 1 1 47 47 MET CB C 47 29.930 29.930 32.410 -2.480 25342 9468 1 12 . 1 1 47 47 MET H H 47 9.178 9.178 8.347 0.831 25342 9469 1 12 . 1 1 48 48 TYR N N 48 121.040 121.040 117.440 3.600 25342 9470 1 12 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.268 -0.396 25342 9471 1 12 . 1 1 48 48 TYR CA C 48 58.712 58.712 60.047 -1.335 25342 9472 1 12 . 1 1 48 48 TYR CB C 48 33.638 33.638 36.673 -3.035 25342 9473 1 12 . 1 1 48 48 TYR H H 48 7.881 7.881 7.610 0.271 25342 9474 1 12 . 1 1 49 49 LYS N N 49 121.754 121.754 119.926 1.828 25342 9475 1 12 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.179 -0.074 25342 9476 1 12 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.072 -2.687 25342 9477 1 12 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.000 -2.836 25342 9478 1 12 . 1 1 49 49 LYS H H 49 8.365 8.365 7.674 0.691 25342 9479 1 12 . 1 1 50 50 THR N N 50 117.557 117.557 112.127 5.430 25342 9480 1 12 . 1 1 50 50 THR HA H 50 3.586 3.586 4.008 -0.422 25342 9481 1 12 . 1 1 50 50 THR CA C 50 65.634 65.634 66.527 -0.893 25342 9482 1 12 . 1 1 50 50 THR CB C 50 65.904 65.904 67.805 -1.901 25342 9483 1 12 . 1 1 50 50 THR H H 50 8.007 8.007 7.842 0.165 25342 9484 1 12 . 1 1 51 51 SER N N 51 115.110 115.110 117.432 -2.322 25342 9485 1 12 . 1 1 51 51 SER HA H 51 3.974 3.974 4.402 -0.428 25342 9486 1 12 . 1 1 51 51 SER CA C 51 59.042 59.042 61.570 -2.528 25342 9487 1 12 . 1 1 51 51 SER CB C 51 59.835 59.835 62.928 -3.093 25342 9488 1 12 . 1 1 51 51 SER H H 51 7.606 7.606 8.038 -0.432 25342 9489 1 12 . 1 1 52 52 ASP N N 52 119.713 119.713 122.252 -2.539 25342 9490 1 12 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.583 -0.275 25342 9491 1 12 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.840 -2.314 25342 9492 1 12 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.778 -4.090 25342 9493 1 12 . 1 1 52 52 ASP H H 52 7.552 7.552 7.781 -0.229 25342 9494 1 12 . 1 1 53 53 ILE N N 53 121.982 121.982 121.143 0.839 25342 9495 1 12 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.602 0.120 25342 9496 1 12 . 1 1 53 53 ILE C C 53 175.325 175.325 177.889 -2.564 25342 9497 1 12 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.610 -3.066 25342 9498 1 12 . 1 1 53 53 ILE CB C 53 36.699 36.699 38.046 -1.347 25342 9499 1 12 . 1 1 53 53 ILE H H 53 7.815 7.815 7.807 0.008 25342 9500 1 12 . 1 1 54 54 ALA N N 54 121.552 121.552 120.403 1.149 25342 9501 1 12 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.305 0.012 25342 9502 1 12 . 1 1 54 54 ALA C C 54 177.475 177.475 178.347 -0.872 25342 9503 1 12 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.044 -2.022 25342 9504 1 12 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.514 -2.530 25342 9505 1 12 . 1 1 54 54 ALA H H 54 8.332 8.332 7.702 0.630 25342 9506 1 12 . 1 1 55 55 LEU N N 55 117.176 117.176 118.886 -1.710 25342 9507 1 12 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.093 -0.159 25342 9508 1 12 . 1 1 55 55 LEU C C 55 176.532 176.532 177.839 -1.307 25342 9509 1 12 . 1 1 55 55 LEU CA C 55 55.331 55.331 56.951 -1.620 25342 9510 1 12 . 1 1 55 55 LEU CB C 55 38.428 38.428 42.232 -3.804 25342 9511 1 12 . 1 1 55 55 LEU H H 55 8.195 8.195 8.053 0.142 25342 9512 1 12 . 1 1 56 56 ASP N N 56 120.056 120.056 119.615 0.441 25342 9513 1 12 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.292 0.175 25342 9514 1 12 . 1 1 56 56 ASP C C 56 176.585 176.585 178.791 -2.206 25342 9515 1 12 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.715 -3.165 25342 9516 1 12 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.803 -2.498 25342 9517 1 12 . 1 1 56 56 ASP H H 56 7.806 7.806 8.232 -0.426 25342 9518 1 12 . 1 1 57 57 GLN N N 57 120.020 120.020 115.532 4.488 25342 9519 1 12 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.406 -0.283 25342 9520 1 12 . 1 1 57 57 GLN C C 57 175.689 175.689 175.843 -0.154 25342 9521 1 12 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.083 -1.678 25342 9522 1 12 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.244 -4.475 25342 9523 1 12 . 1 1 57 57 GLN H H 57 7.661 7.661 7.474 0.187 25342 9524 1 12 . 1 1 58 58 ILE N N 58 120.644 120.644 118.305 2.339 25342 9525 1 12 . 1 1 58 58 ILE HA H 58 3.576 3.576 3.931 -0.355 25342 9526 1 12 . 1 1 58 58 ILE C C 58 176.237 176.237 177.012 -0.775 25342 9527 1 12 . 1 1 58 58 ILE CA C 58 62.506 62.506 61.652 0.854 25342 9528 1 12 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.585 -3.556 25342 9529 1 12 . 1 1 58 58 ILE H H 58 8.228 8.228 7.651 0.577 25342 9530 1 12 . 1 1 59 59 GLN N N 59 115.498 115.498 118.641 -3.143 25342 9531 1 12 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.251 -0.109 25342 9532 1 12 . 1 1 59 59 GLN C C 59 173.781 173.781 177.151 -3.370 25342 9533 1 12 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.396 -3.414 25342 9534 1 12 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.587 -2.976 25342 9535 1 12 . 1 1 59 59 GLN H H 59 8.331 8.331 8.614 -0.283 25342 9536 1 12 . 1 1 60 60 GLY N N 60 106.623 106.623 106.170 0.453 25342 9537 1 12 . 1 1 60 60 GLY C C 60 172.068 172.068 175.120 -3.052 25342 9538 1 12 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.260 -2.387 25342 9539 1 12 . 1 1 60 60 GLY H H 60 7.611 7.611 7.913 -0.302 25342 9540 1 12 . 1 1 61 61 ASN N N 61 117.691 117.691 118.411 -0.720 25342 9541 1 12 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.593 -0.049 25342 9542 1 12 . 1 1 61 61 ASN C C 61 171.946 171.946 176.106 -4.160 25342 9543 1 12 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.468 -2.898 25342 9544 1 12 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.894 -2.534 25342 9545 1 12 . 1 1 61 61 ASN H H 61 8.151 8.151 8.353 -0.202 25342 9546 1 12 . 1 1 62 62 LYS N N 62 118.289 118.289 119.163 -0.874 25342 9547 1 12 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.527 -0.199 25342 9548 1 12 . 1 1 62 62 LYS C C 62 171.773 171.773 174.759 -2.986 25342 9549 1 12 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.814 -3.518 25342 9550 1 12 . 1 1 62 62 LYS CB C 62 34.683 34.683 34.478 0.205 25342 9551 1 12 . 1 1 62 62 LYS H H 62 7.242 7.242 7.811 -0.569 25342 9552 1 12 . 1 1 63 63 ASP N N 63 119.888 119.888 117.776 2.112 25342 9553 1 12 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.506 -0.090 25342 9554 1 12 . 1 1 63 63 ASP C C 63 174.476 174.476 175.112 -0.636 25342 9555 1 12 . 1 1 63 63 ASP CA C 63 51.461 51.461 51.781 -0.320 25342 9556 1 12 . 1 1 63 63 ASP CB C 63 38.515 38.515 42.876 -4.361 25342 9557 1 12 . 1 1 63 63 ASP H H 63 8.230 8.230 8.079 0.151 25342 9558 1 12 . 1 1 64 64 PHE N N 64 119.789 119.789 117.138 2.651 25342 9559 1 12 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.609 -0.793 25342 9560 1 12 . 1 1 64 64 PHE CA C 64 56.250 56.250 55.492 0.758 25342 9561 1 12 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.057 -3.023 25342 9562 1 12 . 1 1 64 64 PHE H H 64 8.428 8.428 7.667 0.761 25342 9563 1 12 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.584 -0.271 25342 9564 1 12 . 1 1 65 65 PRO C C 65 173.975 173.975 176.569 -2.594 25342 9565 1 12 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.581 -2.526 25342 9566 1 12 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.509 -2.989 25342 9567 1 12 . 1 1 66 66 GLU N N 66 121.326 121.326 120.587 0.739 25342 9568 1 12 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.328 -0.095 25342 9569 1 12 . 1 1 66 66 GLU C C 66 173.978 173.978 175.085 -1.107 25342 9570 1 12 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.293 -2.762 25342 9571 1 12 . 1 1 66 66 GLU CB C 66 27.700 27.700 30.608 -2.908 25342 9572 1 12 . 1 1 66 66 GLU H H 66 8.225 8.225 8.563 -0.338 25342 9573 1 12 . 1 1 67 67 ILE N N 67 113.897 113.897 114.961 -1.064 25342 9574 1 12 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.882 0.287 25342 9575 1 12 . 1 1 67 67 ILE C C 67 172.791 172.791 175.500 -2.709 25342 9576 1 12 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.237 -1.962 25342 9577 1 12 . 1 1 67 67 ILE CB C 67 39.016 39.016 42.338 -3.322 25342 9578 1 12 . 1 1 67 67 ILE H H 67 8.366 8.366 7.997 0.369 25342 9579 1 12 . 1 1 68 68 GLN N N 68 121.654 121.654 120.933 0.721 25342 9580 1 12 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.706 -0.187 25342 9581 1 12 . 1 1 68 68 GLN C C 68 171.562 171.562 174.301 -2.739 25342 9582 1 12 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.591 -2.278 25342 9583 1 12 . 1 1 68 68 GLN CB C 68 26.785 26.785 27.603 -0.818 25342 9584 1 12 . 1 1 68 68 GLN H H 68 8.763 8.763 8.489 0.274 25342 9585 1 12 . 1 1 69 69 LEU N N 69 125.289 125.289 123.043 2.246 25342 9586 1 12 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.648 -0.129 25342 9587 1 12 . 1 1 69 69 LEU C C 69 172.567 172.567 175.222 -2.655 25342 9588 1 12 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.268 -2.471 25342 9589 1 12 . 1 1 69 69 LEU CB C 69 42.742 42.742 45.435 -2.693 25342 9590 1 12 . 1 1 69 69 LEU H H 69 7.996 7.996 7.775 0.221 25342 9591 1 12 . 1 1 70 70 ASP N N 70 123.170 123.170 119.476 3.694 25342 9592 1 12 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.916 -0.510 25342 9593 1 12 . 1 1 70 70 ASP C C 70 171.978 171.978 174.899 -2.921 25342 9594 1 12 . 1 1 70 70 ASP CA C 70 51.682 51.682 52.969 -1.287 25342 9595 1 12 . 1 1 70 70 ASP CB C 70 38.729 38.729 43.687 -4.958 25342 9596 1 12 . 1 1 70 70 ASP H H 70 8.278 8.278 8.309 -0.031 25342 9597 1 12 . 1 1 71 71 ASN N N 71 117.524 117.524 118.517 -0.993 25342 9598 1 12 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.641 -0.314 25342 9599 1 12 . 1 1 71 71 ASN C C 71 171.825 171.825 174.591 -2.766 25342 9600 1 12 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.737 -2.080 25342 9601 1 12 . 1 1 71 71 ASN CB C 71 35.230 35.230 39.046 -3.816 25342 9602 1 12 . 1 1 71 71 ASN H H 71 8.372 8.372 8.484 -0.112 25342 9603 1 12 . 1 1 72 72 ILE N N 72 124.515 124.515 124.727 -0.212 25342 9604 1 12 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.093 -0.164 25342 9605 1 12 . 1 1 72 72 ILE C C 72 171.607 171.607 174.560 -2.953 25342 9606 1 12 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.993 -2.704 25342 9607 1 12 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.829 -3.069 25342 9608 1 12 . 1 1 72 72 ILE H H 72 7.653 7.653 8.174 -0.521 25342 9609 1 12 . 1 1 73 73 ASP N N 73 125.182 125.182 125.033 0.149 25342 9610 1 12 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.615 0.013 25342 9611 1 12 . 1 1 73 73 ASP C C 73 173.980 173.980 176.479 -2.499 25342 9612 1 12 . 1 1 73 73 ASP CA C 73 49.214 49.214 53.549 -4.335 25342 9613 1 12 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.008 -4.106 25342 9614 1 12 . 1 1 73 73 ASP H H 73 8.382 8.382 8.511 -0.129 25342 9615 1 12 . 1 1 74 74 TYR N N 74 123.092 123.092 123.761 -0.669 25342 9616 1 12 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.533 -0.668 25342 9617 1 12 . 1 1 74 74 TYR C C 74 173.582 173.582 177.483 -3.901 25342 9618 1 12 . 1 1 74 74 TYR CA C 74 59.486 59.486 59.027 0.459 25342 9619 1 12 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.048 -3.240 25342 9620 1 12 . 1 1 74 74 TYR H H 74 7.348 7.348 7.912 -0.564 25342 9621 1 12 . 1 1 75 75 ASN N N 75 109.447 109.447 117.451 -8.004 25342 9622 1 12 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.778 0.147 25342 9623 1 12 . 1 1 75 75 ASN C C 75 172.570 172.570 175.627 -3.057 25342 9624 1 12 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.900 -2.282 25342 9625 1 12 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.182 -2.648 25342 9626 1 12 . 1 1 75 75 ASN H H 75 8.040 8.040 8.162 -0.122 25342 9627 1 12 . 1 1 76 76 ASN N N 76 117.411 117.411 116.932 0.479 25342 9628 1 12 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.651 -0.197 25342 9629 1 12 . 1 1 76 76 ASN C C 76 171.155 171.155 174.406 -3.251 25342 9630 1 12 . 1 1 76 76 ASN CA C 76 50.934 50.934 54.203 -3.268 25342 9631 1 12 . 1 1 76 76 ASN CB C 76 35.658 35.658 39.665 -4.007 25342 9632 1 12 . 1 1 76 76 ASN H H 76 7.750 7.750 7.888 -0.138 25342 9633 1 12 . 1 1 77 77 TYR N N 77 116.878 116.878 119.344 -2.466 25342 9634 1 12 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.739 -0.385 25342 9635 1 12 . 1 1 77 77 TYR C C 77 172.224 172.224 175.250 -3.026 25342 9636 1 12 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.640 -2.400 25342 9637 1 12 . 1 1 77 77 TYR CB C 77 37.113 37.113 40.627 -3.514 25342 9638 1 12 . 1 1 77 77 TYR H H 77 7.789 7.789 8.149 -0.360 25342 9639 1 12 . 1 1 78 78 ASP N N 78 121.352 121.352 125.279 -3.927 25342 9640 1 12 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.753 0.044 25342 9641 1 12 . 1 1 78 78 ASP C C 78 172.623 172.623 175.357 -2.734 25342 9642 1 12 . 1 1 78 78 ASP CA C 78 53.190 53.190 55.554 -2.364 25342 9643 1 12 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.268 -1.233 25342 9644 1 12 . 1 1 78 78 ASP H H 78 9.036 9.036 8.662 0.374 25342 9645 1 12 . 1 1 79 79 LEU N N 79 123.073 123.073 117.676 5.397 25342 9646 1 12 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.232 -0.124 25342 9647 1 12 . 1 1 79 79 LEU C C 79 170.730 170.730 174.494 -3.764 25342 9648 1 12 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.926 -2.669 25342 9649 1 12 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.254 -3.970 25342 9650 1 12 . 1 1 79 79 LEU H H 79 7.877 7.877 7.950 -0.073 25342 9651 1 12 . 1 1 80 80 ILE N N 80 126.348 126.348 121.670 4.678 25342 9652 1 12 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.922 0.147 25342 9653 1 12 . 1 1 80 80 ILE C C 80 171.584 171.584 174.126 -2.542 25342 9654 1 12 . 1 1 80 80 ILE CA C 80 57.415 57.415 59.876 -2.461 25342 9655 1 12 . 1 1 80 80 ILE CB C 80 37.998 37.998 41.856 -3.858 25342 9656 1 12 . 1 1 80 80 ILE H H 80 8.704 8.704 8.811 -0.107 25342 9657 1 12 . 1 1 81 81 LEU N N 81 126.303 126.303 126.203 0.100 25342 9658 1 12 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.733 0.390 25342 9659 1 12 . 1 1 81 81 LEU C C 81 172.779 172.779 175.266 -2.487 25342 9660 1 12 . 1 1 81 81 LEU CA C 81 49.509 49.509 52.828 -3.320 25342 9661 1 12 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.804 -2.089 25342 9662 1 12 . 1 1 81 81 LEU H H 81 9.202 9.202 8.724 0.478 25342 9663 1 12 . 1 1 82 82 ILE N N 82 120.931 120.931 120.830 0.101 25342 9664 1 12 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.787 0.060 25342 9665 1 12 . 1 1 82 82 ILE C C 82 172.796 172.796 174.826 -2.030 25342 9666 1 12 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.511 -2.630 25342 9667 1 12 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.546 -4.749 25342 9668 1 12 . 1 1 82 82 ILE H H 82 8.846 8.846 8.149 0.697 25342 9669 1 12 . 1 1 83 83 GLY N N 83 120.905 120.905 110.896 10.009 25342 9670 1 12 . 1 1 83 83 GLY CA C 83 40.557 40.557 44.056 -3.499 25342 9671 1 12 . 1 1 83 83 GLY H H 83 9.558 9.558 7.966 1.592 25342 9672 1 12 . 1 1 84 84 SER N N 84 116.601 116.601 115.464 1.137 25342 9673 1 12 . 1 1 84 84 SER HA H 84 5.476 5.476 5.076 0.400 25342 9674 1 12 . 1 1 84 84 SER CA C 84 51.324 51.324 55.707 -4.383 25342 9675 1 12 . 1 1 84 84 SER CB C 84 64.271 64.271 64.629 -0.358 25342 9676 1 12 . 1 1 84 84 SER H H 84 7.533 7.533 8.636 -1.103 25342 9677 1 12 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.508 0.655 25342 9678 1 12 . 1 1 85 85 PRO C C 85 175.590 175.590 176.300 -0.710 25342 9679 1 12 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.197 -3.314 25342 9680 1 12 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.580 -2.106 25342 9681 1 12 . 1 1 86 86 VAL N N 86 116.295 116.295 118.396 -2.101 25342 9682 1 12 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.405 -0.584 25342 9683 1 12 . 1 1 86 86 VAL C C 86 172.692 172.692 175.583 -2.891 25342 9684 1 12 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.070 -1.258 25342 9685 1 12 . 1 1 86 86 VAL CB C 86 30.083 30.083 33.556 -3.473 25342 9686 1 12 . 1 1 86 86 VAL H H 86 7.246 7.246 8.059 -0.813 25342 9687 1 12 . 1 1 87 87 TRP N N 87 131.042 131.042 127.990 3.052 25342 9688 1 12 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.556 -0.245 25342 9689 1 12 . 1 1 87 87 TRP C C 87 173.323 173.323 176.848 -3.525 25342 9690 1 12 . 1 1 87 87 TRP CA C 87 50.887 50.887 58.124 -7.237 25342 9691 1 12 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.471 -4.161 25342 9692 1 12 . 1 1 87 87 TRP H H 87 9.555 9.555 8.665 0.890 25342 9693 1 12 . 1 1 88 88 SER N N 88 122.660 122.660 117.154 5.506 25342 9694 1 12 . 1 1 88 88 SER HA H 88 4.582 4.582 4.121 0.461 25342 9695 1 12 . 1 1 88 88 SER C C 88 172.096 172.096 174.488 -2.392 25342 9696 1 12 . 1 1 88 88 SER CA C 88 55.391 55.391 59.828 -4.437 25342 9697 1 12 . 1 1 88 88 SER CB C 88 57.813 57.813 61.956 -4.143 25342 9698 1 12 . 1 1 88 88 SER H H 88 10.257 10.257 9.000 1.257 25342 9699 1 12 . 1 1 89 89 GLY N N 89 128.381 128.381 110.223 18.158 25342 9700 1 12 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.118 -2.489 25342 9701 1 12 . 1 1 89 89 GLY H H 89 6.372 6.372 8.326 -1.954 25342 9702 1 12 . 1 1 90 90 TYR N N 90 120.345 120.345 116.070 4.275 25342 9703 1 12 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.038 -0.849 25342 9704 1 12 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.233 0.316 25342 9705 1 12 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.571 -0.376 25342 9706 1 12 . 1 1 90 90 TYR H H 90 8.113 8.113 6.966 1.147 25342 9707 1 12 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.681 0.153 25342 9708 1 12 . 1 1 91 91 PRO C C 91 170.911 170.911 177.156 -6.245 25342 9709 1 12 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.507 -3.672 25342 9710 1 12 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.937 -6.867 25342 9711 1 12 . 1 1 92 92 ALA N N 92 120.629 120.629 121.641 -1.012 25342 9712 1 12 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.672 -0.053 25342 9713 1 12 . 1 1 92 92 ALA C C 92 176.782 176.782 176.635 0.147 25342 9714 1 12 . 1 1 92 92 ALA CA C 92 49.417 49.417 52.162 -2.745 25342 9715 1 12 . 1 1 92 92 ALA CB C 92 15.516 15.516 18.407 -2.892 25342 9716 1 12 . 1 1 92 92 ALA H H 92 7.554 7.554 8.717 -1.163 25342 9717 1 12 . 1 1 93 93 THR N N 93 112.558 112.558 108.351 4.207 25342 9718 1 12 . 1 1 93 93 THR CB C 93 64.173 64.173 67.592 -3.419 25342 9719 1 12 . 1 1 93 93 THR H H 93 6.730 6.730 7.452 -0.722 25342 9720 1 12 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.620 -0.761 25342 9721 1 12 . 1 1 94 94 PRO C C 94 173.309 173.309 176.138 -2.829 25342 9722 1 12 . 1 1 94 94 PRO CA C 94 63.063 63.063 63.804 -0.741 25342 9723 1 12 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.261 -2.982 25342 9724 1 12 . 1 1 95 95 ILE N N 95 111.014 111.014 117.260 -6.246 25342 9725 1 12 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.392 -0.787 25342 9726 1 12 . 1 1 95 95 ILE C C 95 174.302 174.302 177.071 -2.769 25342 9727 1 12 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.701 -2.520 25342 9728 1 12 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.845 -5.062 25342 9729 1 12 . 1 1 95 95 ILE H H 95 7.995 7.995 8.013 -0.018 25342 9730 1 12 . 1 1 96 96 LYS N N 96 123.208 123.208 123.041 0.167 25342 9731 1 12 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.050 -0.958 25342 9732 1 12 . 1 1 96 96 LYS C C 96 174.451 174.451 178.526 -4.075 25342 9733 1 12 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.566 -2.525 25342 9734 1 12 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.889 -3.142 25342 9735 1 12 . 1 1 96 96 LYS H H 96 6.928 6.928 7.478 -0.550 25342 9736 1 12 . 1 1 97 97 THR N N 97 113.320 113.320 113.830 -0.510 25342 9737 1 12 . 1 1 97 97 THR HA H 97 3.436 3.436 3.828 -0.392 25342 9738 1 12 . 1 1 97 97 THR C C 97 173.221 173.221 176.225 -3.004 25342 9739 1 12 . 1 1 97 97 THR CA C 97 62.710 62.710 65.562 -2.852 25342 9740 1 12 . 1 1 97 97 THR CB C 97 65.562 65.562 68.484 -2.922 25342 9741 1 12 . 1 1 97 97 THR H H 97 6.325 6.325 8.315 -1.990 25342 9742 1 12 . 1 1 98 98 LEU N N 98 120.963 120.963 121.997 -1.034 25342 9743 1 12 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.183 -0.558 25342 9744 1 12 . 1 1 98 98 LEU C C 98 174.713 174.713 177.807 -3.094 25342 9745 1 12 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.369 -1.855 25342 9746 1 12 . 1 1 98 98 LEU CB C 98 39.728 39.728 42.004 -2.276 25342 9747 1 12 . 1 1 98 98 LEU H H 98 7.536 7.536 7.642 -0.106 25342 9748 1 12 . 1 1 99 99 LEU N N 99 118.859 118.859 117.611 1.248 25342 9749 1 12 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.944 -0.272 25342 9750 1 12 . 1 1 99 99 LEU C C 99 177.458 177.458 179.106 -1.648 25342 9751 1 12 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.252 -3.107 25342 9752 1 12 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.195 -2.338 25342 9753 1 12 . 1 1 99 99 LEU H H 99 8.179 8.179 8.331 -0.152 25342 9754 1 12 . 1 1 100 100 ASP N N 100 118.703 118.703 119.280 -0.577 25342 9755 1 12 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.324 -0.103 25342 9756 1 12 . 1 1 100 100 ASP C C 100 176.472 176.472 178.378 -1.906 25342 9757 1 12 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.618 -3.312 25342 9758 1 12 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.667 -3.309 25342 9759 1 12 . 1 1 100 100 ASP H H 100 7.867 7.867 7.997 -0.130 25342 9760 1 12 . 1 1 101 101 GLN N N 101 117.829 117.829 115.067 2.762 25342 9761 1 12 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.310 -0.110 25342 9762 1 12 . 1 1 101 101 GLN C C 101 174.508 174.508 176.349 -1.841 25342 9763 1 12 . 1 1 101 101 GLN CA C 101 54.688 54.688 57.083 -2.395 25342 9764 1 12 . 1 1 101 101 GLN CB C 101 25.597 25.597 28.527 -2.930 25342 9765 1 12 . 1 1 101 101 GLN H H 101 7.597 7.597 7.610 -0.013 25342 9766 1 12 . 1 1 102 102 MET N N 102 118.406 118.406 112.072 6.334 25342 9767 1 12 . 1 1 102 102 MET HA H 102 3.864 3.864 5.158 -1.294 25342 9768 1 12 . 1 1 102 102 MET C C 102 172.820 172.820 176.473 -3.653 25342 9769 1 12 . 1 1 102 102 MET CA C 102 53.298 53.298 54.675 -1.377 25342 9770 1 12 . 1 1 102 102 MET CB C 102 31.207 31.207 33.806 -2.599 25342 9771 1 12 . 1 1 102 102 MET H H 102 7.434 7.434 7.781 -0.347 25342 9772 1 12 . 1 1 103 103 LYS N N 103 115.889 115.889 123.340 -7.451 25342 9773 1 12 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.015 -0.096 25342 9774 1 12 . 1 1 103 103 LYS C C 103 173.938 173.938 178.033 -4.095 25342 9775 1 12 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.727 -3.290 25342 9776 1 12 . 1 1 103 103 LYS CB C 103 29.263 29.263 32.326 -3.063 25342 9777 1 12 . 1 1 103 103 LYS H H 103 6.881 6.881 7.759 -0.878 25342 9778 1 12 . 1 1 104 104 ASN N N 104 114.951 114.951 114.224 0.727 25342 9779 1 12 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.639 0.092 25342 9780 1 12 . 1 1 104 104 ASN C C 104 172.617 172.617 175.778 -3.161 25342 9781 1 12 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.724 -3.458 25342 9782 1 12 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.271 -2.488 25342 9783 1 12 . 1 1 104 104 ASN H H 104 8.493 8.493 8.224 0.269 25342 9784 1 12 . 1 1 105 105 TYR N N 105 122.680 122.680 122.228 0.452 25342 9785 1 12 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.479 0.083 25342 9786 1 12 . 1 1 105 105 TYR CA C 105 55.433 55.433 60.133 -4.700 25342 9787 1 12 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.507 -3.675 25342 9788 1 12 . 1 1 105 105 TYR H H 105 8.217 8.217 7.760 0.457 25342 9789 1 12 . 1 1 106 106 ARG N N 106 128.872 128.872 124.655 4.217 25342 9790 1 12 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.376 -0.111 25342 9791 1 12 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.446 -2.464 25342 9792 1 12 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.015 -2.885 25342 9793 1 12 . 1 1 106 106 ARG H H 106 8.801 8.801 8.218 0.583 25342 9794 1 12 . 1 1 107 107 GLY CA C 107 42.401 42.401 43.159 -0.758 25342 9795 1 12 . 1 1 108 108 GLU N N 108 117.000 117.000 120.278 -3.278 25342 9796 1 12 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.493 0.133 25342 9797 1 12 . 1 1 108 108 GLU C C 108 174.125 174.125 175.635 -1.510 25342 9798 1 12 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.681 -2.893 25342 9799 1 12 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.645 -1.205 25342 9800 1 12 . 1 1 108 108 GLU H H 108 7.514 7.514 8.271 -0.757 25342 9801 1 12 . 1 1 109 109 VAL N N 109 123.398 123.398 121.825 1.573 25342 9802 1 12 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.198 0.139 25342 9803 1 12 . 1 1 109 109 VAL C C 109 170.606 170.606 173.939 -3.333 25342 9804 1 12 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.382 -3.102 25342 9805 1 12 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.184 -2.527 25342 9806 1 12 . 1 1 109 109 VAL H H 109 8.942 8.942 8.370 0.572 25342 9807 1 12 . 1 1 110 110 ALA N N 110 127.905 127.905 128.609 -0.704 25342 9808 1 12 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.077 -0.450 25342 9809 1 12 . 1 1 110 110 ALA C C 110 173.195 173.195 174.717 -1.522 25342 9810 1 12 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.342 -1.996 25342 9811 1 12 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.531 -4.206 25342 9812 1 12 . 1 1 110 110 ALA H H 110 8.776 8.776 8.197 0.579 25342 9813 1 12 . 1 1 111 111 SER N N 111 110.523 110.523 114.308 -3.785 25342 9814 1 12 . 1 1 111 111 SER HA H 111 5.562 5.562 4.661 0.901 25342 9815 1 12 . 1 1 111 111 SER C C 111 170.719 170.719 172.424 -1.705 25342 9816 1 12 . 1 1 111 111 SER CA C 111 51.314 51.314 56.693 -5.378 25342 9817 1 12 . 1 1 111 111 SER CB C 111 61.907 61.907 64.722 -2.815 25342 9818 1 12 . 1 1 111 111 SER H H 111 7.480 7.480 7.759 -0.279 25342 9819 1 12 . 1 1 112 112 PHE N N 112 125.567 125.567 123.727 1.840 25342 9820 1 12 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.060 1.296 25342 9821 1 12 . 1 1 112 112 PHE C C 112 169.536 169.536 173.964 -4.428 25342 9822 1 12 . 1 1 112 112 PHE CA C 112 50.371 50.371 54.971 -4.599 25342 9823 1 12 . 1 1 112 112 PHE CB C 112 39.788 39.788 41.267 -1.479 25342 9824 1 12 . 1 1 112 112 PHE H H 112 7.848 7.848 8.350 -0.502 25342 9825 1 12 . 1 1 113 113 PHE N N 113 115.065 115.065 119.138 -4.073 25342 9826 1 12 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.738 0.366 25342 9827 1 12 . 1 1 113 113 PHE C C 113 173.006 173.006 175.535 -2.529 25342 9828 1 12 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.914 -5.652 25342 9829 1 12 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.496 -4.747 25342 9830 1 12 . 1 1 113 113 PHE H H 113 7.361 7.361 8.684 -1.323 25342 9831 1 12 . 1 1 114 114 THR N N 114 108.014 108.014 108.986 -0.972 25342 9832 1 12 . 1 1 114 114 THR HA H 114 4.999 4.999 4.723 0.276 25342 9833 1 12 . 1 1 114 114 THR C C 114 169.874 169.874 174.901 -5.027 25342 9834 1 12 . 1 1 114 114 THR CA C 114 56.500 56.500 60.793 -4.293 25342 9835 1 12 . 1 1 114 114 THR CB C 114 68.809 68.809 69.629 -0.820 25342 9836 1 12 . 1 1 114 114 THR H H 114 7.867 7.867 8.523 -0.656 25342 9837 1 12 . 1 1 115 115 SER N N 115 115.049 115.049 118.153 -3.104 25342 9838 1 12 . 1 1 115 115 SER HA H 115 5.613 5.613 4.116 1.497 25342 9839 1 12 . 1 1 115 115 SER C C 115 171.247 171.247 174.702 -3.455 25342 9840 1 12 . 1 1 115 115 SER CA C 115 54.830 54.830 58.443 -3.613 25342 9841 1 12 . 1 1 115 115 SER CB C 115 63.992 63.992 63.556 0.436 25342 9842 1 12 . 1 1 115 115 SER H H 115 8.970 8.970 7.556 1.414 25342 9843 1 12 . 1 1 116 116 ALA N N 116 122.671 122.671 123.763 -1.092 25342 9844 1 12 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.276 0.709 25342 9845 1 12 . 1 1 116 116 ALA C C 116 176.180 176.180 177.798 -1.618 25342 9846 1 12 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.914 -2.714 25342 9847 1 12 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.825 -1.830 25342 9848 1 12 . 1 1 116 116 ALA H H 116 8.963 8.963 8.787 0.176 25342 9849 1 12 . 1 1 117 117 GLY N N 117 107.387 107.387 106.810 0.577 25342 9850 1 12 . 1 1 117 117 GLY C C 117 172.528 172.528 174.102 -1.574 25342 9851 1 12 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.429 -1.697 25342 9852 1 12 . 1 1 117 117 GLY H H 117 9.340 9.340 7.897 1.443 25342 9853 1 12 . 1 1 118 118 THR N N 118 113.481 113.481 110.740 2.741 25342 9854 1 12 . 1 1 118 118 THR HA H 118 4.651 4.651 4.386 0.265 25342 9855 1 12 . 1 1 118 118 THR C C 118 172.067 172.067 174.643 -2.576 25342 9856 1 12 . 1 1 118 118 THR CA C 118 57.357 57.357 60.522 -3.165 25342 9857 1 12 . 1 1 118 118 THR CB C 118 69.475 69.475 69.602 -0.127 25342 9858 1 12 . 1 1 118 118 THR H H 118 9.373 9.373 7.472 1.901 25342 9859 1 12 . 1 1 119 119 ASN N N 119 113.202 113.202 118.955 -5.753 25342 9860 1 12 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.410 0.208 25342 9861 1 12 . 1 1 119 119 ASN C C 119 173.114 173.114 175.894 -2.780 25342 9862 1 12 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.590 -2.906 25342 9863 1 12 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.449 -3.719 25342 9864 1 12 . 1 1 119 119 ASN H H 119 8.908 8.908 8.941 -0.033 25342 9865 1 12 . 1 1 120 120 HIS N N 120 117.315 117.315 115.636 1.679 25342 9866 1 12 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.685 -0.899 25342 9867 1 12 . 1 1 120 120 HIS C C 120 174.381 174.381 175.666 -1.285 25342 9868 1 12 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.119 -3.603 25342 9869 1 12 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.784 -3.280 25342 9870 1 12 . 1 1 120 120 HIS H H 120 8.074 8.074 8.875 -0.801 25342 9871 1 12 . 1 1 121 121 LYS N N 121 118.678 118.678 119.430 -0.752 25342 9872 1 12 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.166 -0.332 25342 9873 1 12 . 1 1 121 121 LYS C C 121 176.564 176.564 177.594 -1.030 25342 9874 1 12 . 1 1 121 121 LYS CA C 121 57.295 57.295 57.413 -0.117 25342 9875 1 12 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.312 -3.370 25342 9876 1 12 . 1 1 121 121 LYS H H 121 8.336 8.336 7.893 0.443 25342 9877 1 12 . 1 1 122 122 ALA N N 122 122.146 122.146 123.344 -1.198 25342 9878 1 12 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.310 -0.615 25342 9879 1 12 . 1 1 122 122 ALA C C 122 175.163 175.163 179.929 -4.766 25342 9880 1 12 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.745 -3.053 25342 9881 1 12 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.356 -2.638 25342 9882 1 12 . 1 1 122 122 ALA H H 122 7.584 7.584 8.109 -0.525 25342 9883 1 12 . 1 1 123 123 TYR N N 123 119.730 119.730 117.433 2.297 25342 9884 1 12 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.138 -0.985 25342 9885 1 12 . 1 1 123 123 TYR C C 123 174.340 174.340 177.340 -3.000 25342 9886 1 12 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.930 -0.532 25342 9887 1 12 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.280 -2.617 25342 9888 1 12 . 1 1 123 123 TYR H H 123 7.317 7.317 8.407 -1.090 25342 9889 1 12 . 1 1 124 124 VAL N N 124 118.649 118.649 118.461 0.188 25342 9890 1 12 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.298 -0.096 25342 9891 1 12 . 1 1 124 124 VAL C C 124 175.603 175.603 178.342 -2.739 25342 9892 1 12 . 1 1 124 124 VAL CA C 124 64.680 64.680 65.376 -0.696 25342 9893 1 12 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.477 -1.188 25342 9894 1 12 . 1 1 124 124 VAL H H 124 7.799 7.799 7.013 0.786 25342 9895 1 12 . 1 1 125 125 SER N N 125 114.475 114.475 114.886 -0.411 25342 9896 1 12 . 1 1 125 125 SER HA H 125 4.032 4.032 4.081 -0.049 25342 9897 1 12 . 1 1 125 125 SER C C 125 174.849 174.849 176.575 -1.726 25342 9898 1 12 . 1 1 125 125 SER CA C 125 59.002 59.002 61.316 -2.314 25342 9899 1 12 . 1 1 125 125 SER CB C 125 59.613 59.613 63.293 -3.680 25342 9900 1 12 . 1 1 125 125 SER H H 125 7.766 7.766 7.910 -0.143 25342 9901 1 12 . 1 1 126 126 HIS N N 126 119.326 119.326 123.373 -4.047 25342 9902 1 12 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.374 -0.247 25342 9903 1 12 . 1 1 126 126 HIS C C 126 172.865 172.865 178.046 -5.181 25342 9904 1 12 . 1 1 126 126 HIS CA C 126 55.706 55.706 60.110 -4.404 25342 9905 1 12 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.727 -4.734 25342 9906 1 12 . 1 1 126 126 HIS H H 126 8.569 8.569 8.321 0.248 25342 9907 1 12 . 1 1 127 127 PHE N N 127 121.044 121.044 118.561 2.483 25342 9908 1 12 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.411 -1.237 25342 9909 1 12 . 1 1 127 127 PHE C C 127 173.378 173.378 177.672 -4.294 25342 9910 1 12 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.536 0.331 25342 9911 1 12 . 1 1 127 127 PHE CB C 127 36.054 36.054 38.201 -2.147 25342 9912 1 12 . 1 1 127 127 PHE H H 127 9.139 9.139 8.311 0.828 25342 9913 1 12 . 1 1 128 128 ASN N N 128 114.893 114.893 118.627 -3.734 25342 9914 1 12 . 1 1 128 128 ASN HA H 128 4.040 4.040 3.605 0.435 25342 9915 1 12 . 1 1 128 128 ASN C C 128 175.230 175.230 176.749 -1.519 25342 9916 1 12 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.258 -1.958 25342 9917 1 12 . 1 1 128 128 ASN CB C 128 36.171 36.171 37.582 -1.411 25342 9918 1 12 . 1 1 128 128 ASN H H 128 7.774 7.774 7.480 0.294 25342 9919 1 12 . 1 1 129 129 GLU N N 129 119.804 119.804 118.461 1.343 25342 9920 1 12 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.754 0.286 25342 9921 1 12 . 1 1 129 129 GLU C C 129 177.052 177.052 177.074 -0.022 25342 9922 1 12 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.149 -1.419 25342 9923 1 12 . 1 1 129 129 GLU CB C 129 27.196 27.196 28.965 -1.769 25342 9924 1 12 . 1 1 129 129 GLU H H 129 7.577 7.577 7.415 0.162 25342 9925 1 12 . 1 1 130 130 TRP N N 130 120.979 120.979 116.956 4.023 25342 9926 1 12 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.689 -0.232 25342 9927 1 12 . 1 1 130 130 TRP C C 130 174.329 174.329 174.610 -0.281 25342 9928 1 12 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.021 -1.333 25342 9929 1 12 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.439 -2.448 25342 9930 1 12 . 1 1 130 130 TRP H H 130 8.225 8.225 7.302 0.923 25342 9931 1 12 . 1 1 131 131 ALA N N 131 120.450 120.450 120.183 0.267 25342 9932 1 12 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.494 -0.558 25342 9933 1 12 . 1 1 131 131 ALA C C 131 172.487 172.487 175.505 -3.018 25342 9934 1 12 . 1 1 131 131 ALA CA C 131 48.434 48.434 52.047 -3.613 25342 9935 1 12 . 1 1 131 131 ALA CB C 131 16.288 16.288 20.777 -4.489 25342 9936 1 12 . 1 1 131 131 ALA H H 131 8.081 8.081 7.651 0.430 25342 9937 1 12 . 1 1 132 132 ASP N N 132 117.813 117.813 120.451 -2.638 25342 9938 1 12 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.480 -0.272 25342 9939 1 12 . 1 1 132 132 ASP C C 132 173.804 173.804 176.832 -3.028 25342 9940 1 12 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.321 -1.140 25342 9941 1 12 . 1 1 132 132 ASP CB C 132 39.321 39.321 41.443 -2.122 25342 9942 1 12 . 1 1 132 132 ASP H H 132 6.772 6.772 7.817 -1.045 25342 9943 1 12 . 1 1 133 133 GLY N N 133 115.052 115.052 113.169 1.883 25342 9944 1 12 . 1 1 133 133 GLY C C 133 172.078 172.078 173.265 -1.187 25342 9945 1 12 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.751 -2.331 25342 9946 1 12 . 1 1 133 133 GLY H H 133 8.626 8.626 8.612 0.014 25342 9947 1 12 . 1 1 134 134 LEU N N 134 120.063 120.063 120.893 -0.830 25342 9948 1 12 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.786 -0.314 25342 9949 1 12 . 1 1 134 134 LEU C C 134 174.079 174.079 175.864 -1.785 25342 9950 1 12 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.716 -2.752 25342 9951 1 12 . 1 1 134 134 LEU CB C 134 40.370 40.370 44.789 -4.419 25342 9952 1 12 . 1 1 134 134 LEU H H 134 8.094 8.094 7.563 0.531 25342 9953 1 12 . 1 1 135 135 ASN N N 135 119.292 119.292 122.150 -2.858 25342 9954 1 12 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.714 -0.091 25342 9955 1 12 . 1 1 135 135 ASN C C 135 170.527 170.527 174.653 -4.126 25342 9956 1 12 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.696 -3.694 25342 9957 1 12 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.138 -4.577 25342 9958 1 12 . 1 1 135 135 ASN H H 135 8.513 8.513 8.686 -0.173 25342 9959 1 12 . 1 1 136 136 VAL N N 136 125.412 125.412 124.425 0.987 25342 9960 1 12 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.491 0.115 25342 9961 1 12 . 1 1 136 136 VAL C C 136 175.420 175.420 176.919 -1.499 25342 9962 1 12 . 1 1 136 136 VAL CA C 136 58.382 58.382 62.855 -4.473 25342 9963 1 12 . 1 1 136 136 VAL CB C 136 29.247 29.247 32.272 -3.025 25342 9964 1 12 . 1 1 136 136 VAL H H 136 7.648 7.648 8.137 -0.489 25342 9965 1 12 . 1 1 137 137 ILE N N 137 121.881 121.881 120.360 1.521 25342 9966 1 12 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.650 -0.217 25342 9967 1 12 . 1 1 137 137 ILE C C 137 173.906 173.906 175.119 -1.213 25342 9968 1 12 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.536 -1.558 25342 9969 1 12 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.706 -2.510 25342 9970 1 12 . 1 1 137 137 ILE H H 137 9.139 9.139 8.763 0.376 25342 9971 1 12 . 1 1 138 138 GLY N N 138 108.226 108.226 107.057 1.169 25342 9972 1 12 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.684 -2.293 25342 9973 1 12 . 1 1 138 138 GLY H H 138 6.645 6.645 7.475 -0.830 25342 9974 1 12 . 1 1 139 139 VAL N N 139 119.408 119.408 119.587 -0.179 25342 9975 1 12 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.288 0.069 25342 9976 1 12 . 1 1 139 139 VAL C C 139 172.327 172.327 174.814 -2.487 25342 9977 1 12 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.153 -2.886 25342 9978 1 12 . 1 1 139 139 VAL CB C 139 32.743 32.743 35.561 -2.818 25342 9979 1 12 . 1 1 139 139 VAL H H 139 8.092 8.092 8.802 -0.710 25342 9980 1 12 . 1 1 140 140 ALA N N 140 127.415 127.415 128.577 -1.162 25342 9981 1 12 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.270 -0.825 25342 9982 1 12 . 1 1 140 140 ALA C C 140 170.718 170.718 176.043 -5.325 25342 9983 1 12 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.129 -2.229 25342 9984 1 12 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.539 -1.480 25342 9985 1 12 . 1 1 140 140 ALA H H 140 9.093 9.093 8.263 0.830 25342 9986 1 12 . 1 1 141 141 ARG N N 141 119.287 119.287 118.586 0.701 25342 9987 1 12 . 1 1 141 141 ARG HA H 141 2.487 2.487 4.566 -2.079 25342 9988 1 12 . 1 1 141 141 ARG C C 141 173.375 173.375 174.407 -1.032 25342 9989 1 12 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.606 -3.722 25342 9990 1 12 . 1 1 141 141 ARG CB C 141 28.684 28.684 30.607 -1.923 25342 9991 1 12 . 1 1 141 141 ARG H H 141 7.620 7.620 8.814 -1.194 25342 9992 1 12 . 1 1 142 142 ASP N N 142 125.999 125.999 117.233 8.766 25342 9993 1 12 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.681 -0.957 25342 9994 1 12 . 1 1 142 142 ASP C C 142 169.292 169.292 175.285 -5.993 25342 9995 1 12 . 1 1 142 142 ASP CA C 142 53.338 53.338 53.482 -0.144 25342 9996 1 12 . 1 1 142 142 ASP CB C 142 36.677 36.677 42.261 -5.584 25342 9997 1 12 . 1 1 142 142 ASP H H 142 9.482 9.482 7.862 1.620 25342 9998 1 12 . 1 1 143 143 ASP N N 143 119.293 119.293 116.286 3.007 25342 9999 1 12 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.549 -0.243 25342 10000 1 12 . 1 1 143 143 ASP C C 143 175.686 175.686 177.207 -1.521 25342 10001 1 12 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.154 -5.249 25342 10002 1 12 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.264 -3.952 25342 10003 1 12 . 1 1 143 143 ASP H H 143 8.108 8.108 8.478 -0.370 25342 10004 1 12 . 1 1 144 144 SER N N 144 115.303 115.303 115.273 0.030 25342 10005 1 12 . 1 1 144 144 SER HA H 144 3.740 3.740 4.276 -0.536 25342 10006 1 12 . 1 1 144 144 SER C C 144 172.925 172.925 174.608 -1.683 25342 10007 1 12 . 1 1 144 144 SER CA C 144 59.213 59.213 60.444 -1.231 25342 10008 1 12 . 1 1 144 144 SER CB C 144 60.806 60.806 62.681 -1.875 25342 10009 1 12 . 1 1 144 144 SER H H 144 7.642 7.642 8.468 -0.826 25342 10010 1 12 . 1 1 145 145 GLU N N 145 119.523 119.523 119.248 0.275 25342 10011 1 12 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.160 0.146 25342 10012 1 12 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.347 -3.308 25342 10013 1 12 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.577 -2.777 25342 10014 1 12 . 1 1 145 145 GLU H H 145 7.771 7.771 7.821 -0.050 25342 10015 1 12 . 1 1 146 146 VAL N N 146 118.683 118.683 120.750 -2.067 25342 10016 1 12 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.619 -0.678 25342 10017 1 12 . 1 1 146 146 VAL C C 146 174.591 174.591 177.186 -2.595 25342 10018 1 12 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.640 -2.708 25342 10019 1 12 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.544 -2.497 25342 10020 1 12 . 1 1 146 146 VAL H H 146 6.352 6.352 7.008 -0.656 25342 10021 1 12 . 1 1 147 147 ASP N N 147 119.312 119.312 118.621 0.691 25342 10022 1 12 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.330 -0.275 25342 10023 1 12 . 1 1 147 147 ASP C C 147 174.783 174.783 177.717 -2.934 25342 10024 1 12 . 1 1 147 147 ASP CA C 147 54.241 54.241 57.008 -2.767 25342 10025 1 12 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.057 -2.824 25342 10026 1 12 . 1 1 147 147 ASP H H 147 8.370 8.370 8.700 -0.330 25342 10027 1 12 . 1 1 148 148 LYS N N 148 119.342 119.342 117.738 1.604 25342 10028 1 12 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.380 -0.444 25342 10029 1 12 . 1 1 148 148 LYS C C 148 176.384 176.384 178.092 -1.708 25342 10030 1 12 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.288 -1.582 25342 10031 1 12 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.278 -2.767 25342 10032 1 12 . 1 1 148 148 LYS H H 148 7.040 7.040 7.287 -0.247 25342 10033 1 12 . 1 1 149 149 TRP N N 149 118.258 118.258 119.989 -1.731 25342 10034 1 12 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.931 -0.340 25342 10035 1 12 . 1 1 149 149 TRP C C 149 174.212 174.212 176.036 -1.824 25342 10036 1 12 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.754 -2.009 25342 10037 1 12 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.794 -1.855 25342 10038 1 12 . 1 1 149 149 TRP H H 149 7.811 7.811 7.253 0.558 25342 10039 1 12 . 1 1 150 150 SER N N 150 109.618 109.618 114.606 -4.988 25342 10040 1 12 . 1 1 150 150 SER HA H 150 4.234 4.234 4.700 -0.466 25342 10041 1 12 . 1 1 150 150 SER C C 150 170.189 170.189 174.607 -4.418 25342 10042 1 12 . 1 1 150 150 SER CA C 150 56.695 56.695 57.067 -0.372 25342 10043 1 12 . 1 1 150 150 SER CB C 150 61.935 61.935 63.613 -1.678 25342 10044 1 12 . 1 1 150 150 SER H H 150 7.793 7.793 7.560 0.233 25342 10045 1 13 . 1 1 3 3 ALA N N 3 125.638 125.638 127.609 -1.971 25342 10046 1 13 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.545 -0.180 25342 10047 1 13 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.506 -3.208 25342 10048 1 13 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.231 -2.372 25342 10049 1 13 . 1 1 3 3 ALA H H 3 8.325 8.325 8.605 -0.280 25342 10050 1 13 . 1 1 4 4 LYS N N 4 121.813 121.813 118.845 2.968 25342 10051 1 13 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.603 -0.376 25342 10052 1 13 . 1 1 4 4 LYS C C 4 174.574 174.574 173.765 0.809 25342 10053 1 13 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.350 -1.569 25342 10054 1 13 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.169 -2.679 25342 10055 1 13 . 1 1 4 4 LYS H H 4 8.486 8.486 7.683 0.803 25342 10056 1 13 . 1 1 5 5 LYS N N 5 129.722 129.722 119.642 10.080 25342 10057 1 13 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.439 0.079 25342 10058 1 13 . 1 1 5 5 LYS C C 5 174.720 174.720 174.395 0.325 25342 10059 1 13 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.945 -1.223 25342 10060 1 13 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.193 -6.408 25342 10061 1 13 . 1 1 5 5 LYS H H 5 10.015 10.015 8.369 1.646 25342 10062 1 13 . 1 1 6 6 THR N N 6 126.254 126.254 116.801 9.453 25342 10063 1 13 . 1 1 6 6 THR HA H 6 5.654 5.654 5.152 0.502 25342 10064 1 13 . 1 1 6 6 THR C C 6 169.926 169.926 172.932 -3.006 25342 10065 1 13 . 1 1 6 6 THR CA C 6 60.598 60.598 62.286 -1.688 25342 10066 1 13 . 1 1 6 6 THR CB C 6 68.041 68.041 70.009 -1.968 25342 10067 1 13 . 1 1 6 6 THR H H 6 8.538 8.538 8.704 -0.166 25342 10068 1 13 . 1 1 7 7 LEU N N 7 130.775 130.775 129.156 1.619 25342 10069 1 13 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.954 -0.360 25342 10070 1 13 . 1 1 7 7 LEU C C 7 170.404 170.404 174.268 -3.864 25342 10071 1 13 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.289 -3.356 25342 10072 1 13 . 1 1 7 7 LEU CB C 7 40.728 40.728 44.077 -3.349 25342 10073 1 13 . 1 1 7 7 LEU H H 7 8.575 8.575 8.815 -0.240 25342 10074 1 13 . 1 1 8 8 ILE N N 8 127.242 127.242 123.233 4.009 25342 10075 1 13 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.706 0.142 25342 10076 1 13 . 1 1 8 8 ILE C C 8 170.936 170.936 174.267 -3.331 25342 10077 1 13 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.211 -2.959 25342 10078 1 13 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.294 -3.359 25342 10079 1 13 . 1 1 8 8 ILE H H 8 9.217 9.217 7.825 1.392 25342 10080 1 13 . 1 1 9 9 LEU N N 9 127.183 127.183 126.002 1.181 25342 10081 1 13 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.632 1.062 25342 10082 1 13 . 1 1 9 9 LEU C C 9 173.824 173.824 174.522 -0.698 25342 10083 1 13 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.785 -3.946 25342 10084 1 13 . 1 1 9 9 LEU CB C 9 43.963 43.963 45.403 -1.440 25342 10085 1 13 . 1 1 9 9 LEU H H 9 9.248 9.248 8.617 0.631 25342 10086 1 13 . 1 1 10 10 TYR N N 10 113.330 113.330 115.141 -1.811 25342 10087 1 13 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.274 0.240 25342 10088 1 13 . 1 1 10 10 TYR C C 10 167.898 167.898 173.941 -6.043 25342 10089 1 13 . 1 1 10 10 TYR CA C 10 52.875 52.875 55.408 -2.533 25342 10090 1 13 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.327 -1.891 25342 10091 1 13 . 1 1 10 10 TYR H H 10 7.306 7.306 8.059 -0.753 25342 10092 1 13 . 1 1 11 11 TYR N N 11 121.297 121.297 124.957 -3.660 25342 10093 1 13 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.400 -0.638 25342 10094 1 13 . 1 1 11 11 TYR C C 11 169.698 169.698 175.353 -5.655 25342 10095 1 13 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.439 -1.392 25342 10096 1 13 . 1 1 11 11 TYR CB C 11 40.538 40.538 39.201 1.337 25342 10097 1 13 . 1 1 11 11 TYR H H 11 7.891 7.891 8.276 -0.385 25342 10098 1 13 . 1 1 12 12 SER N N 12 117.763 117.763 124.713 -6.950 25342 10099 1 13 . 1 1 12 12 SER HA H 12 4.679 4.679 4.376 0.303 25342 10100 1 13 . 1 1 12 12 SER C C 12 170.075 170.075 174.127 -4.052 25342 10101 1 13 . 1 1 12 12 SER CA C 12 53.619 53.619 57.667 -4.048 25342 10102 1 13 . 1 1 12 12 SER CB C 12 62.847 62.847 63.257 -0.410 25342 10103 1 13 . 1 1 12 12 SER H H 12 7.557 7.557 8.617 -1.060 25342 10104 1 13 . 1 1 13 13 TRP N N 13 135.232 135.232 130.368 4.864 25342 10105 1 13 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.814 0.822 25342 10106 1 13 . 1 1 13 13 TRP C C 13 175.708 175.708 176.850 -1.142 25342 10107 1 13 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.945 -1.829 25342 10108 1 13 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.720 -2.085 25342 10109 1 13 . 1 1 13 13 TRP H H 13 9.755 9.755 7.930 1.825 25342 10110 1 13 . 1 1 14 14 SER N N 14 113.789 113.789 113.295 0.494 25342 10111 1 13 . 1 1 14 14 SER HA H 14 4.223 4.223 4.502 -0.279 25342 10112 1 13 . 1 1 14 14 SER C C 14 172.747 172.747 174.467 -1.720 25342 10113 1 13 . 1 1 14 14 SER CA C 14 53.828 53.828 58.086 -4.258 25342 10114 1 13 . 1 1 14 14 SER CB C 14 60.037 60.037 62.819 -2.782 25342 10115 1 13 . 1 1 14 14 SER H H 14 10.026 10.026 8.556 1.470 25342 10116 1 13 . 1 1 15 15 GLY N N 15 110.489 110.489 109.608 0.881 25342 10117 1 13 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.404 -0.745 25342 10118 1 13 . 1 1 15 15 GLY H H 15 7.391 7.391 8.119 -0.728 25342 10119 1 13 . 1 1 16 16 GLU N N 16 129.005 129.005 120.880 8.125 25342 10120 1 13 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.232 -0.169 25342 10121 1 13 . 1 1 16 16 GLU CA C 16 56.761 56.761 58.293 -1.532 25342 10122 1 13 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.686 -3.274 25342 10123 1 13 . 1 1 16 16 GLU H H 16 11.550 11.550 8.513 3.037 25342 10124 1 13 . 1 1 17 17 THR N N 17 123.016 123.016 113.601 9.415 25342 10125 1 13 . 1 1 17 17 THR HA H 17 4.035 4.035 3.971 0.064 25342 10126 1 13 . 1 1 17 17 THR C C 17 173.360 173.360 175.539 -2.179 25342 10127 1 13 . 1 1 17 17 THR CA C 17 64.303 64.303 64.479 -0.176 25342 10128 1 13 . 1 1 17 17 THR CB C 17 63.999 63.999 68.518 -4.519 25342 10129 1 13 . 1 1 17 17 THR H H 17 11.293 11.293 8.326 2.967 25342 10130 1 13 . 1 1 18 18 LYS N N 18 120.156 120.156 120.273 -0.117 25342 10131 1 13 . 1 1 18 18 LYS HA H 18 2.856 2.856 3.992 -1.136 25342 10132 1 13 . 1 1 18 18 LYS C C 18 173.901 173.901 178.378 -4.477 25342 10133 1 13 . 1 1 18 18 LYS CA C 18 56.834 56.834 58.253 -1.419 25342 10134 1 13 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.447 -2.966 25342 10135 1 13 . 1 1 18 18 LYS H H 18 6.940 6.940 7.853 -0.913 25342 10136 1 13 . 1 1 19 19 LYS N N 19 117.237 117.237 118.856 -1.619 25342 10137 1 13 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.016 -0.093 25342 10138 1 13 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.586 -2.262 25342 10139 1 13 . 1 1 19 19 LYS CB C 19 29.361 29.361 31.939 -2.578 25342 10140 1 13 . 1 1 19 19 LYS H H 19 7.212 7.212 7.974 -0.762 25342 10141 1 13 . 1 1 20 20 MET N N 20 119.268 119.268 114.774 4.494 25342 10142 1 13 . 1 1 20 20 MET HA H 20 4.413 4.413 4.155 0.258 25342 10143 1 13 . 1 1 20 20 MET C C 20 173.625 173.625 175.628 -2.003 25342 10144 1 13 . 1 1 20 20 MET CA C 20 52.261 52.261 54.987 -2.726 25342 10145 1 13 . 1 1 20 20 MET CB C 20 26.680 26.680 31.500 -4.820 25342 10146 1 13 . 1 1 20 20 MET H H 20 7.600 7.600 8.242 -0.642 25342 10147 1 13 . 1 1 21 21 ALA N N 21 123.669 123.669 120.489 3.180 25342 10148 1 13 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.883 -0.401 25342 10149 1 13 . 1 1 21 21 ALA C C 21 176.628 176.628 178.943 -2.315 25342 10150 1 13 . 1 1 21 21 ALA CA C 21 52.374 52.374 53.434 -1.060 25342 10151 1 13 . 1 1 21 21 ALA CB C 21 16.495 16.495 19.196 -2.701 25342 10152 1 13 . 1 1 21 21 ALA H H 21 8.738 8.738 7.573 1.165 25342 10153 1 13 . 1 1 22 22 GLU N N 22 117.242 117.242 119.387 -2.145 25342 10154 1 13 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.924 -0.251 25342 10155 1 13 . 1 1 22 22 GLU C C 22 176.698 176.698 178.923 -2.225 25342 10156 1 13 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.349 -2.809 25342 10157 1 13 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.349 -2.915 25342 10158 1 13 . 1 1 22 22 GLU H H 22 7.959 7.959 8.113 -0.154 25342 10159 1 13 . 1 1 23 23 LYS N N 23 123.302 123.302 119.816 3.486 25342 10160 1 13 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.011 -0.190 25342 10161 1 13 . 1 1 23 23 LYS C C 23 177.389 177.389 178.436 -1.047 25342 10162 1 13 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.278 -2.356 25342 10163 1 13 . 1 1 23 23 LYS CB C 23 29.514 29.514 31.855 -2.341 25342 10164 1 13 . 1 1 23 23 LYS H H 23 7.703 7.703 7.402 0.301 25342 10165 1 13 . 1 1 24 24 ILE N N 24 122.208 122.208 118.277 3.931 25342 10166 1 13 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.653 -0.370 25342 10167 1 13 . 1 1 24 24 ILE C C 24 174.934 174.934 177.470 -2.536 25342 10168 1 13 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.187 -1.895 25342 10169 1 13 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.733 -2.995 25342 10170 1 13 . 1 1 24 24 ILE H H 24 8.535 8.535 8.018 0.517 25342 10171 1 13 . 1 1 25 25 ASN N N 25 118.640 118.640 118.046 0.594 25342 10172 1 13 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.417 -0.190 25342 10173 1 13 . 1 1 25 25 ASN C C 25 173.530 173.530 177.238 -3.708 25342 10174 1 13 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.553 -4.342 25342 10175 1 13 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.734 -0.630 25342 10176 1 13 . 1 1 25 25 ASN H H 25 8.317 8.317 7.983 0.334 25342 10177 1 13 . 1 1 26 26 SER N N 26 111.990 111.990 115.414 -3.424 25342 10178 1 13 . 1 1 26 26 SER HA H 26 4.153 4.153 4.295 -0.142 25342 10179 1 13 . 1 1 26 26 SER C C 26 172.110 172.110 175.774 -3.664 25342 10180 1 13 . 1 1 26 26 SER CA C 26 57.905 57.905 61.086 -3.181 25342 10181 1 13 . 1 1 26 26 SER CB C 26 60.655 60.655 63.409 -2.754 25342 10182 1 13 . 1 1 26 26 SER H H 26 7.369 7.369 7.662 -0.293 25342 10183 1 13 . 1 1 27 27 GLU N N 27 120.201 120.201 118.972 1.229 25342 10184 1 13 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.236 -0.135 25342 10185 1 13 . 1 1 27 27 GLU C C 27 173.673 173.673 177.251 -3.578 25342 10186 1 13 . 1 1 27 27 GLU CA C 27 54.235 54.235 57.414 -3.179 25342 10187 1 13 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.316 -3.715 25342 10188 1 13 . 1 1 27 27 GLU H H 27 7.451 7.451 8.090 -0.639 25342 10189 1 13 . 1 1 28 28 ILE N N 28 118.762 118.762 118.834 -0.072 25342 10190 1 13 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.122 0.077 25342 10191 1 13 . 1 1 28 28 ILE C C 28 172.487 172.487 174.997 -2.510 25342 10192 1 13 . 1 1 28 28 ILE CA C 28 57.732 57.732 61.038 -3.306 25342 10193 1 13 . 1 1 28 28 ILE CB C 28 35.738 35.738 39.485 -3.747 25342 10194 1 13 . 1 1 28 28 ILE H H 28 7.255 7.255 7.504 -0.249 25342 10195 1 13 . 1 1 29 29 LYS N N 29 130.563 130.563 123.807 6.756 25342 10196 1 13 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.454 -0.452 25342 10197 1 13 . 1 1 29 29 LYS C C 29 174.386 174.386 176.390 -2.004 25342 10198 1 13 . 1 1 29 29 LYS CA C 29 55.535 55.535 55.927 -0.392 25342 10199 1 13 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.780 -4.194 25342 10200 1 13 . 1 1 29 29 LYS H H 29 8.564 8.564 8.633 -0.069 25342 10201 1 13 . 1 1 30 30 ASP N N 30 119.357 119.357 122.291 -2.934 25342 10202 1 13 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.383 0.019 25342 10203 1 13 . 1 1 30 30 ASP C C 30 172.570 172.570 175.204 -2.634 25342 10204 1 13 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.944 -1.508 25342 10205 1 13 . 1 1 30 30 ASP CB C 30 36.744 36.744 40.240 -3.496 25342 10206 1 13 . 1 1 30 30 ASP H H 30 8.920 8.920 8.863 0.057 25342 10207 1 13 . 1 1 31 31 SER N N 31 114.019 114.019 113.533 0.486 25342 10208 1 13 . 1 1 31 31 SER HA H 31 4.782 4.782 5.061 -0.279 25342 10209 1 13 . 1 1 31 31 SER C C 31 171.150 171.150 175.102 -3.952 25342 10210 1 13 . 1 1 31 31 SER CA C 31 55.551 55.551 58.306 -2.755 25342 10211 1 13 . 1 1 31 31 SER CB C 31 62.259 62.259 64.493 -2.234 25342 10212 1 13 . 1 1 31 31 SER H H 31 8.006 8.006 8.006 0.000 25342 10213 1 13 . 1 1 32 32 GLU N N 32 121.455 121.455 123.744 -2.289 25342 10214 1 13 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.625 0.115 25342 10215 1 13 . 1 1 32 32 GLU C C 32 171.185 171.185 175.409 -4.224 25342 10216 1 13 . 1 1 32 32 GLU CA C 32 52.081 52.081 54.908 -2.827 25342 10217 1 13 . 1 1 32 32 GLU CB C 32 30.827 30.827 31.965 -1.139 25342 10218 1 13 . 1 1 32 32 GLU H H 32 8.145 8.145 9.022 -0.877 25342 10219 1 13 . 1 1 33 33 LEU N N 33 126.176 126.176 121.886 4.290 25342 10220 1 13 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.737 0.569 25342 10221 1 13 . 1 1 33 33 LEU C C 33 173.365 173.365 175.791 -2.426 25342 10222 1 13 . 1 1 33 33 LEU CA C 33 51.440 51.440 53.979 -2.539 25342 10223 1 13 . 1 1 33 33 LEU CB C 33 43.635 43.635 45.000 -1.365 25342 10224 1 13 . 1 1 33 33 LEU H H 33 8.589 8.589 8.526 0.063 25342 10225 1 13 . 1 1 34 34 LYS N N 34 127.200 127.200 124.076 3.124 25342 10226 1 13 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.809 -0.213 25342 10227 1 13 . 1 1 34 34 LYS C C 34 169.622 169.622 174.577 -4.955 25342 10228 1 13 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.277 -1.948 25342 10229 1 13 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.737 -2.537 25342 10230 1 13 . 1 1 34 34 LYS H H 34 9.380 9.380 8.475 0.905 25342 10231 1 13 . 1 1 35 35 GLU N N 35 122.324 122.324 118.744 3.580 25342 10232 1 13 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.018 -1.685 25342 10233 1 13 . 1 1 35 35 GLU C C 35 172.734 172.734 174.980 -2.246 25342 10234 1 13 . 1 1 35 35 GLU CA C 35 52.612 52.612 55.044 -2.432 25342 10235 1 13 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.409 -3.090 25342 10236 1 13 . 1 1 35 35 GLU H H 35 8.094 8.094 8.381 -0.287 25342 10237 1 13 . 1 1 36 36 VAL N N 36 126.781 126.781 123.006 3.775 25342 10238 1 13 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.402 -0.563 25342 10239 1 13 . 1 1 36 36 VAL C C 36 171.482 171.482 175.046 -3.564 25342 10240 1 13 . 1 1 36 36 VAL CA C 36 59.405 59.405 61.376 -1.971 25342 10241 1 13 . 1 1 36 36 VAL CB C 36 29.348 29.348 33.939 -4.591 25342 10242 1 13 . 1 1 36 36 VAL H H 36 8.660 8.660 8.759 -0.099 25342 10243 1 13 . 1 1 37 37 LYS N N 37 126.065 126.065 123.179 2.886 25342 10244 1 13 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.235 0.730 25342 10245 1 13 . 1 1 37 37 LYS C C 37 173.187 173.187 174.792 -1.605 25342 10246 1 13 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.792 -2.512 25342 10247 1 13 . 1 1 37 37 LYS CB C 37 32.921 32.921 36.429 -3.508 25342 10248 1 13 . 1 1 37 37 LYS H H 37 7.809 7.809 8.095 -0.286 25342 10249 1 13 . 1 1 38 38 VAL N N 38 111.020 111.020 114.628 -3.608 25342 10250 1 13 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.623 0.201 25342 10251 1 13 . 1 1 38 38 VAL C C 38 173.604 173.604 175.203 -1.599 25342 10252 1 13 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.412 -3.029 25342 10253 1 13 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.574 -2.198 25342 10254 1 13 . 1 1 38 38 VAL H H 38 8.305 8.305 8.156 0.149 25342 10255 1 13 . 1 1 39 39 SER N N 39 117.887 117.887 115.889 1.998 25342 10256 1 13 . 1 1 39 39 SER HA H 39 4.183 4.183 4.481 -0.298 25342 10257 1 13 . 1 1 39 39 SER C C 39 173.538 173.538 174.495 -0.957 25342 10258 1 13 . 1 1 39 39 SER CA C 39 56.279 56.279 58.437 -2.158 25342 10259 1 13 . 1 1 39 39 SER CB C 39 60.537 60.537 64.092 -3.555 25342 10260 1 13 . 1 1 39 39 SER H H 39 8.847 8.847 8.545 0.302 25342 10261 1 13 . 1 1 40 40 GLU N N 40 126.316 126.316 120.106 6.210 25342 10262 1 13 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.356 -0.202 25342 10263 1 13 . 1 1 40 40 GLU C C 40 174.586 174.586 177.366 -2.780 25342 10264 1 13 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.444 -1.632 25342 10265 1 13 . 1 1 40 40 GLU CB C 40 26.720 26.720 30.034 -3.314 25342 10266 1 13 . 1 1 40 40 GLU H H 40 9.049 9.049 8.449 0.600 25342 10267 1 13 . 1 1 41 41 GLY N N 41 112.494 112.494 113.821 -1.327 25342 10268 1 13 . 1 1 41 41 GLY C C 41 171.994 171.994 175.622 -3.628 25342 10269 1 13 . 1 1 41 41 GLY CA C 41 42.462 42.462 46.107 -3.645 25342 10270 1 13 . 1 1 41 41 GLY H H 41 8.780 8.780 8.760 0.020 25342 10271 1 13 . 1 1 42 42 THR N N 42 118.631 118.631 115.433 3.198 25342 10272 1 13 . 1 1 42 42 THR HA H 42 3.582 3.582 3.755 -0.173 25342 10273 1 13 . 1 1 42 42 THR C C 42 171.225 171.225 173.468 -2.243 25342 10274 1 13 . 1 1 42 42 THR CA C 42 64.104 64.104 64.914 -0.810 25342 10275 1 13 . 1 1 42 42 THR CB C 42 65.914 65.914 69.306 -3.392 25342 10276 1 13 . 1 1 42 42 THR H H 42 7.737 7.737 7.510 0.227 25342 10277 1 13 . 1 1 43 43 PHE N N 43 116.279 116.279 115.472 0.807 25342 10278 1 13 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.631 0.389 25342 10279 1 13 . 1 1 43 43 PHE C C 43 170.141 170.141 174.128 -3.987 25342 10280 1 13 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.514 -4.042 25342 10281 1 13 . 1 1 43 43 PHE CB C 43 37.385 37.385 42.229 -4.844 25342 10282 1 13 . 1 1 43 43 PHE H H 43 8.114 8.114 7.678 0.436 25342 10283 1 13 . 1 1 44 44 ASP N N 44 121.513 121.513 121.314 0.199 25342 10284 1 13 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.888 -0.037 25342 10285 1 13 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.207 -2.995 25342 10286 1 13 . 1 1 44 44 ASP CB C 44 44.385 44.385 41.963 2.422 25342 10287 1 13 . 1 1 44 44 ASP H H 44 7.774 7.774 8.455 -0.681 25342 10288 1 13 . 1 1 45 45 ALA N N 45 125.663 125.663 118.690 6.973 25342 10289 1 13 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.561 -0.350 25342 10290 1 13 . 1 1 45 45 ALA C C 45 175.139 175.139 176.757 -1.618 25342 10291 1 13 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.012 -0.576 25342 10292 1 13 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.893 -3.661 25342 10293 1 13 . 1 1 45 45 ALA H H 45 8.324 8.324 8.344 -0.020 25342 10294 1 13 . 1 1 46 46 ASP N N 46 119.288 119.288 119.747 -0.459 25342 10295 1 13 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.748 0.077 25342 10296 1 13 . 1 1 46 46 ASP C C 46 175.013 175.013 176.076 -1.063 25342 10297 1 13 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.298 -2.137 25342 10298 1 13 . 1 1 46 46 ASP CB C 46 41.233 41.233 43.207 -1.974 25342 10299 1 13 . 1 1 46 46 ASP H H 46 9.618 9.618 7.954 1.664 25342 10300 1 13 . 1 1 47 47 MET N N 47 127.347 127.347 119.930 7.417 25342 10301 1 13 . 1 1 47 47 MET HA H 47 3.456 3.456 4.277 -0.821 25342 10302 1 13 . 1 1 47 47 MET C C 47 173.605 173.605 177.623 -4.018 25342 10303 1 13 . 1 1 47 47 MET CA C 47 56.699 56.699 58.608 -1.909 25342 10304 1 13 . 1 1 47 47 MET CB C 47 29.930 29.930 33.311 -3.381 25342 10305 1 13 . 1 1 47 47 MET H H 47 9.178 9.178 8.226 0.952 25342 10306 1 13 . 1 1 48 48 TYR N N 48 121.040 121.040 116.758 4.282 25342 10307 1 13 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.447 -0.575 25342 10308 1 13 . 1 1 48 48 TYR CA C 48 58.712 58.712 59.388 -0.676 25342 10309 1 13 . 1 1 48 48 TYR CB C 48 33.638 33.638 37.182 -3.544 25342 10310 1 13 . 1 1 48 48 TYR H H 48 7.881 7.881 8.319 -0.438 25342 10311 1 13 . 1 1 49 49 LYS N N 49 121.754 121.754 120.183 1.571 25342 10312 1 13 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.145 -0.040 25342 10313 1 13 . 1 1 49 49 LYS CA C 49 56.385 56.385 58.684 -2.299 25342 10314 1 13 . 1 1 49 49 LYS CB C 49 29.164 29.164 31.958 -2.794 25342 10315 1 13 . 1 1 49 49 LYS H H 49 8.365 8.365 7.239 1.126 25342 10316 1 13 . 1 1 50 50 THR N N 50 117.557 117.557 111.481 6.076 25342 10317 1 13 . 1 1 50 50 THR HA H 50 3.586 3.586 4.220 -0.634 25342 10318 1 13 . 1 1 50 50 THR CA C 50 65.634 65.634 65.732 -0.098 25342 10319 1 13 . 1 1 50 50 THR CB C 50 65.904 65.904 68.601 -2.697 25342 10320 1 13 . 1 1 50 50 THR H H 50 8.007 8.007 8.057 -0.050 25342 10321 1 13 . 1 1 51 51 SER N N 51 115.110 115.110 115.515 -0.405 25342 10322 1 13 . 1 1 51 51 SER HA H 51 3.974 3.974 4.530 -0.556 25342 10323 1 13 . 1 1 51 51 SER CA C 51 59.042 59.042 60.293 -1.251 25342 10324 1 13 . 1 1 51 51 SER CB C 51 59.835 59.835 62.970 -3.135 25342 10325 1 13 . 1 1 51 51 SER H H 51 7.606 7.606 7.870 -0.264 25342 10326 1 13 . 1 1 52 52 ASP N N 52 119.713 119.713 122.637 -2.924 25342 10327 1 13 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.693 -0.385 25342 10328 1 13 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.531 -2.005 25342 10329 1 13 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.968 -4.280 25342 10330 1 13 . 1 1 52 52 ASP H H 52 7.552 7.552 8.002 -0.450 25342 10331 1 13 . 1 1 53 53 ILE N N 53 121.982 121.982 120.909 1.073 25342 10332 1 13 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.677 0.045 25342 10333 1 13 . 1 1 53 53 ILE C C 53 175.325 175.325 178.050 -2.725 25342 10334 1 13 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.337 -2.793 25342 10335 1 13 . 1 1 53 53 ILE CB C 53 36.699 36.699 38.016 -1.317 25342 10336 1 13 . 1 1 53 53 ILE H H 53 7.815 7.815 7.710 0.105 25342 10337 1 13 . 1 1 54 54 ALA N N 54 121.552 121.552 119.216 2.336 25342 10338 1 13 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.387 -0.070 25342 10339 1 13 . 1 1 54 54 ALA C C 54 177.475 177.475 178.182 -0.707 25342 10340 1 13 . 1 1 54 54 ALA CA C 54 52.022 52.022 53.807 -1.786 25342 10341 1 13 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.933 -2.949 25342 10342 1 13 . 1 1 54 54 ALA H H 54 8.332 8.332 7.673 0.659 25342 10343 1 13 . 1 1 55 55 LEU N N 55 117.176 117.176 119.444 -2.268 25342 10344 1 13 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.308 -0.374 25342 10345 1 13 . 1 1 55 55 LEU C C 55 176.532 176.532 177.852 -1.320 25342 10346 1 13 . 1 1 55 55 LEU CA C 55 55.331 55.331 56.471 -1.140 25342 10347 1 13 . 1 1 55 55 LEU CB C 55 38.428 38.428 42.636 -4.208 25342 10348 1 13 . 1 1 55 55 LEU H H 55 8.195 8.195 7.632 0.563 25342 10349 1 13 . 1 1 56 56 ASP N N 56 120.056 120.056 120.217 -0.161 25342 10350 1 13 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.168 0.299 25342 10351 1 13 . 1 1 56 56 ASP C C 56 176.585 176.585 177.995 -1.410 25342 10352 1 13 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.805 -3.255 25342 10353 1 13 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.735 -2.430 25342 10354 1 13 . 1 1 56 56 ASP H H 56 7.806 7.806 8.551 -0.745 25342 10355 1 13 . 1 1 57 57 GLN N N 57 120.020 120.020 115.592 4.428 25342 10356 1 13 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.225 -0.102 25342 10357 1 13 . 1 1 57 57 GLN C C 57 175.689 175.689 177.229 -1.540 25342 10358 1 13 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.935 -2.530 25342 10359 1 13 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.913 -5.144 25342 10360 1 13 . 1 1 57 57 GLN H H 57 7.661 7.661 7.693 -0.032 25342 10361 1 13 . 1 1 58 58 ILE N N 58 120.644 120.644 118.676 1.968 25342 10362 1 13 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.363 -0.787 25342 10363 1 13 . 1 1 58 58 ILE C C 58 176.237 176.237 176.921 -0.684 25342 10364 1 13 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.232 0.274 25342 10365 1 13 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.210 -3.181 25342 10366 1 13 . 1 1 58 58 ILE H H 58 8.228 8.228 7.808 0.420 25342 10367 1 13 . 1 1 59 59 GLN N N 59 115.498 115.498 118.517 -3.019 25342 10368 1 13 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.234 -0.092 25342 10369 1 13 . 1 1 59 59 GLN C C 59 173.781 173.781 176.952 -3.171 25342 10370 1 13 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.968 -2.986 25342 10371 1 13 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.194 -2.583 25342 10372 1 13 . 1 1 59 59 GLN H H 59 8.331 8.331 8.345 -0.014 25342 10373 1 13 . 1 1 60 60 GLY N N 60 106.623 106.623 106.173 0.450 25342 10374 1 13 . 1 1 60 60 GLY C C 60 172.068 172.068 174.985 -2.917 25342 10375 1 13 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.248 -2.375 25342 10376 1 13 . 1 1 60 60 GLY H H 60 7.611 7.611 8.240 -0.629 25342 10377 1 13 . 1 1 61 61 ASN N N 61 117.691 117.691 117.384 0.307 25342 10378 1 13 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.737 -0.193 25342 10379 1 13 . 1 1 61 61 ASN C C 61 171.946 171.946 175.893 -3.947 25342 10380 1 13 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.190 -2.621 25342 10381 1 13 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.420 -3.060 25342 10382 1 13 . 1 1 61 61 ASN H H 61 8.151 8.151 8.209 -0.058 25342 10383 1 13 . 1 1 62 62 LYS N N 62 118.289 118.289 119.779 -1.490 25342 10384 1 13 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.621 -0.293 25342 10385 1 13 . 1 1 62 62 LYS C C 62 171.773 171.773 174.824 -3.051 25342 10386 1 13 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.512 -3.216 25342 10387 1 13 . 1 1 62 62 LYS CB C 62 34.683 34.683 34.268 0.415 25342 10388 1 13 . 1 1 62 62 LYS H H 62 7.242 7.242 7.720 -0.478 25342 10389 1 13 . 1 1 63 63 ASP N N 63 119.888 119.888 118.826 1.062 25342 10390 1 13 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.773 -0.357 25342 10391 1 13 . 1 1 63 63 ASP C C 63 174.476 174.476 175.832 -1.356 25342 10392 1 13 . 1 1 63 63 ASP CA C 63 51.461 51.461 52.819 -1.358 25342 10393 1 13 . 1 1 63 63 ASP CB C 63 38.515 38.515 42.556 -4.041 25342 10394 1 13 . 1 1 63 63 ASP H H 63 8.230 8.230 8.220 0.010 25342 10395 1 13 . 1 1 64 64 PHE N N 64 119.789 119.789 119.116 0.673 25342 10396 1 13 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.704 -0.888 25342 10397 1 13 . 1 1 64 64 PHE CA C 64 56.250 56.250 55.647 0.604 25342 10398 1 13 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.100 -3.066 25342 10399 1 13 . 1 1 64 64 PHE H H 64 8.428 8.428 7.882 0.546 25342 10400 1 13 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.424 -0.111 25342 10401 1 13 . 1 1 65 65 PRO C C 65 173.975 173.975 175.889 -1.914 25342 10402 1 13 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.606 -2.550 25342 10403 1 13 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.473 -2.953 25342 10404 1 13 . 1 1 66 66 GLU N N 66 121.326 121.326 118.584 2.742 25342 10405 1 13 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.441 -0.208 25342 10406 1 13 . 1 1 66 66 GLU C C 66 173.978 173.978 175.696 -1.718 25342 10407 1 13 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.439 -1.908 25342 10408 1 13 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.152 -3.452 25342 10409 1 13 . 1 1 66 66 GLU H H 66 8.225 8.225 8.388 -0.163 25342 10410 1 13 . 1 1 67 67 ILE N N 67 113.897 113.897 114.111 -0.214 25342 10411 1 13 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.669 0.500 25342 10412 1 13 . 1 1 67 67 ILE C C 67 172.791 172.791 176.023 -3.232 25342 10413 1 13 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.415 -3.140 25342 10414 1 13 . 1 1 67 67 ILE CB C 67 39.016 39.016 40.820 -1.804 25342 10415 1 13 . 1 1 67 67 ILE H H 67 8.366 8.366 8.109 0.257 25342 10416 1 13 . 1 1 68 68 GLN N N 68 121.654 121.654 119.986 1.668 25342 10417 1 13 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.660 -0.141 25342 10418 1 13 . 1 1 68 68 GLN C C 68 171.562 171.562 174.205 -2.643 25342 10419 1 13 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.899 -2.586 25342 10420 1 13 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.572 -1.787 25342 10421 1 13 . 1 1 68 68 GLN H H 68 8.763 8.763 8.398 0.365 25342 10422 1 13 . 1 1 69 69 LEU N N 69 125.289 125.289 119.975 5.314 25342 10423 1 13 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.613 -0.094 25342 10424 1 13 . 1 1 69 69 LEU C C 69 172.567 172.567 175.577 -3.010 25342 10425 1 13 . 1 1 69 69 LEU CA C 69 51.797 51.797 53.953 -2.156 25342 10426 1 13 . 1 1 69 69 LEU CB C 69 42.742 42.742 44.517 -1.775 25342 10427 1 13 . 1 1 69 69 LEU H H 69 7.996 7.996 7.696 0.300 25342 10428 1 13 . 1 1 70 70 ASP N N 70 123.170 123.170 120.038 3.132 25342 10429 1 13 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.860 -0.454 25342 10430 1 13 . 1 1 70 70 ASP C C 70 171.978 171.978 175.104 -3.126 25342 10431 1 13 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.165 -1.483 25342 10432 1 13 . 1 1 70 70 ASP CB C 70 38.729 38.729 42.640 -3.911 25342 10433 1 13 . 1 1 70 70 ASP H H 70 8.278 8.278 8.293 -0.015 25342 10434 1 13 . 1 1 71 71 ASN N N 71 117.524 117.524 118.403 -0.879 25342 10435 1 13 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.683 -0.356 25342 10436 1 13 . 1 1 71 71 ASN C C 71 171.825 171.825 174.867 -3.042 25342 10437 1 13 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.759 -2.102 25342 10438 1 13 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.841 -3.611 25342 10439 1 13 . 1 1 71 71 ASN H H 71 8.372 8.372 8.514 -0.142 25342 10440 1 13 . 1 1 72 72 ILE N N 72 124.515 124.515 123.877 0.638 25342 10441 1 13 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.217 -0.288 25342 10442 1 13 . 1 1 72 72 ILE C C 72 171.607 171.607 173.960 -2.353 25342 10443 1 13 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.438 -2.149 25342 10444 1 13 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.095 -2.335 25342 10445 1 13 . 1 1 72 72 ILE H H 72 7.653 7.653 8.076 -0.423 25342 10446 1 13 . 1 1 73 73 ASP N N 73 125.182 125.182 122.719 2.463 25342 10447 1 13 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.483 0.145 25342 10448 1 13 . 1 1 73 73 ASP C C 73 173.980 173.980 175.752 -1.772 25342 10449 1 13 . 1 1 73 73 ASP CA C 73 49.214 49.214 52.924 -3.710 25342 10450 1 13 . 1 1 73 73 ASP CB C 73 36.902 36.902 39.761 -2.860 25342 10451 1 13 . 1 1 73 73 ASP H H 73 8.382 8.382 8.393 -0.011 25342 10452 1 13 . 1 1 74 74 TYR N N 74 123.092 123.092 123.801 -0.709 25342 10453 1 13 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.518 -0.653 25342 10454 1 13 . 1 1 74 74 TYR C C 74 173.582 173.582 177.290 -3.708 25342 10455 1 13 . 1 1 74 74 TYR CA C 74 59.486 59.486 58.857 0.629 25342 10456 1 13 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.137 -3.329 25342 10457 1 13 . 1 1 74 74 TYR H H 74 7.348 7.348 8.158 -0.810 25342 10458 1 13 . 1 1 75 75 ASN N N 75 109.447 109.447 117.489 -8.042 25342 10459 1 13 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.611 0.314 25342 10460 1 13 . 1 1 75 75 ASN C C 75 172.570 172.570 175.340 -2.770 25342 10461 1 13 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.200 -2.582 25342 10462 1 13 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.476 -2.942 25342 10463 1 13 . 1 1 75 75 ASN H H 75 8.040 8.040 8.443 -0.403 25342 10464 1 13 . 1 1 76 76 ASN N N 76 117.411 117.411 115.538 1.873 25342 10465 1 13 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.630 -0.176 25342 10466 1 13 . 1 1 76 76 ASN C C 76 171.155 171.155 174.557 -3.402 25342 10467 1 13 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.053 -2.119 25342 10468 1 13 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.272 -2.614 25342 10469 1 13 . 1 1 76 76 ASN H H 76 7.750 7.750 7.994 -0.244 25342 10470 1 13 . 1 1 77 77 TYR N N 77 116.878 116.878 119.392 -2.514 25342 10471 1 13 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.540 -0.186 25342 10472 1 13 . 1 1 77 77 TYR C C 77 172.224 172.224 174.716 -2.492 25342 10473 1 13 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.587 -3.347 25342 10474 1 13 . 1 1 77 77 TYR CB C 77 37.113 37.113 40.187 -3.074 25342 10475 1 13 . 1 1 77 77 TYR H H 77 7.789 7.789 7.845 -0.056 25342 10476 1 13 . 1 1 78 78 ASP N N 78 121.352 121.352 120.944 0.408 25342 10477 1 13 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.675 0.122 25342 10478 1 13 . 1 1 78 78 ASP C C 78 172.623 172.623 175.723 -3.100 25342 10479 1 13 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.179 -2.989 25342 10480 1 13 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.754 -1.719 25342 10481 1 13 . 1 1 78 78 ASP H H 78 9.036 9.036 8.379 0.657 25342 10482 1 13 . 1 1 79 79 LEU N N 79 123.073 123.073 117.537 5.536 25342 10483 1 13 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.180 -0.072 25342 10484 1 13 . 1 1 79 79 LEU C C 79 170.730 170.730 174.555 -3.825 25342 10485 1 13 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.715 -2.458 25342 10486 1 13 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.185 -3.901 25342 10487 1 13 . 1 1 79 79 LEU H H 79 7.877 7.877 8.011 -0.134 25342 10488 1 13 . 1 1 80 80 ILE N N 80 126.348 126.348 123.793 2.555 25342 10489 1 13 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.685 0.384 25342 10490 1 13 . 1 1 80 80 ILE C C 80 171.584 171.584 174.436 -2.852 25342 10491 1 13 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.128 -2.713 25342 10492 1 13 . 1 1 80 80 ILE CB C 80 37.998 37.998 39.860 -1.862 25342 10493 1 13 . 1 1 80 80 ILE H H 80 8.704 8.704 8.454 0.250 25342 10494 1 13 . 1 1 81 81 LEU N N 81 126.303 126.303 127.903 -1.600 25342 10495 1 13 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.607 0.516 25342 10496 1 13 . 1 1 81 81 LEU C C 81 172.779 172.779 175.722 -2.943 25342 10497 1 13 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.804 -4.295 25342 10498 1 13 . 1 1 81 81 LEU CB C 81 41.715 41.715 42.193 -0.478 25342 10499 1 13 . 1 1 81 81 LEU H H 81 9.202 9.202 8.919 0.283 25342 10500 1 13 . 1 1 82 82 ILE N N 82 120.931 120.931 120.788 0.143 25342 10501 1 13 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.925 -0.078 25342 10502 1 13 . 1 1 82 82 ILE C C 82 172.796 172.796 174.216 -1.420 25342 10503 1 13 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.411 -2.530 25342 10504 1 13 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.740 -4.943 25342 10505 1 13 . 1 1 82 82 ILE H H 82 8.846 8.846 8.235 0.611 25342 10506 1 13 . 1 1 83 83 GLY N N 83 120.905 120.905 110.394 10.511 25342 10507 1 13 . 1 1 83 83 GLY CA C 83 40.557 40.557 44.636 -4.079 25342 10508 1 13 . 1 1 83 83 GLY H H 83 9.558 9.558 8.317 1.241 25342 10509 1 13 . 1 1 84 84 SER N N 84 116.601 116.601 113.421 3.180 25342 10510 1 13 . 1 1 84 84 SER HA H 84 5.476 5.476 5.164 0.312 25342 10511 1 13 . 1 1 84 84 SER CA C 84 51.324 51.324 56.196 -4.872 25342 10512 1 13 . 1 1 84 84 SER CB C 84 64.271 64.271 64.848 -0.577 25342 10513 1 13 . 1 1 84 84 SER H H 84 7.533 7.533 8.080 -0.547 25342 10514 1 13 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.480 0.683 25342 10515 1 13 . 1 1 85 85 PRO C C 85 175.590 175.590 175.912 -0.322 25342 10516 1 13 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.423 -3.540 25342 10517 1 13 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.653 -2.179 25342 10518 1 13 . 1 1 86 86 VAL N N 86 116.295 116.295 118.260 -1.965 25342 10519 1 13 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.387 -0.566 25342 10520 1 13 . 1 1 86 86 VAL C C 86 172.692 172.692 174.867 -2.175 25342 10521 1 13 . 1 1 86 86 VAL CA C 86 59.812 59.812 60.772 -0.960 25342 10522 1 13 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.926 -2.843 25342 10523 1 13 . 1 1 86 86 VAL H H 86 7.246 7.246 8.032 -0.786 25342 10524 1 13 . 1 1 87 87 TRP N N 87 131.042 131.042 128.604 2.438 25342 10525 1 13 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.599 -0.288 25342 10526 1 13 . 1 1 87 87 TRP C C 87 173.323 173.323 176.665 -3.342 25342 10527 1 13 . 1 1 87 87 TRP CA C 87 50.887 50.887 56.790 -5.903 25342 10528 1 13 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.081 -3.771 25342 10529 1 13 . 1 1 87 87 TRP H H 87 9.555 9.555 8.440 1.115 25342 10530 1 13 . 1 1 88 88 SER N N 88 122.660 122.660 116.158 6.502 25342 10531 1 13 . 1 1 88 88 SER HA H 88 4.582 4.582 4.173 0.409 25342 10532 1 13 . 1 1 88 88 SER C C 88 172.096 172.096 175.133 -3.037 25342 10533 1 13 . 1 1 88 88 SER CA C 88 55.391 55.391 60.212 -4.821 25342 10534 1 13 . 1 1 88 88 SER CB C 88 57.813 57.813 61.368 -3.555 25342 10535 1 13 . 1 1 88 88 SER H H 88 10.257 10.257 8.832 1.425 25342 10536 1 13 . 1 1 89 89 GLY N N 89 128.381 128.381 114.168 14.213 25342 10537 1 13 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.741 -2.112 25342 10538 1 13 . 1 1 89 89 GLY H H 89 6.372 6.372 8.439 -2.067 25342 10539 1 13 . 1 1 90 90 TYR N N 90 120.345 120.345 118.999 1.346 25342 10540 1 13 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.726 -0.537 25342 10541 1 13 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.059 -0.510 25342 10542 1 13 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.948 -1.753 25342 10543 1 13 . 1 1 90 90 TYR H H 90 8.113 8.113 6.960 1.153 25342 10544 1 13 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.723 0.111 25342 10545 1 13 . 1 1 91 91 PRO C C 91 170.911 170.911 177.166 -6.255 25342 10546 1 13 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.517 -3.682 25342 10547 1 13 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.749 -6.679 25342 10548 1 13 . 1 1 92 92 ALA N N 92 120.629 120.629 121.753 -1.124 25342 10549 1 13 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.329 0.290 25342 10550 1 13 . 1 1 92 92 ALA C C 92 176.782 176.782 176.557 0.225 25342 10551 1 13 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.262 -1.845 25342 10552 1 13 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.963 -2.447 25342 10553 1 13 . 1 1 92 92 ALA H H 92 7.554 7.554 8.418 -0.864 25342 10554 1 13 . 1 1 93 93 THR N N 93 112.558 112.558 109.133 3.425 25342 10555 1 13 . 1 1 93 93 THR CB C 93 64.173 64.173 67.407 -3.234 25342 10556 1 13 . 1 1 93 93 THR H H 93 6.730 6.730 7.634 -0.904 25342 10557 1 13 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.538 -0.679 25342 10558 1 13 . 1 1 94 94 PRO C C 94 173.309 173.309 177.535 -4.226 25342 10559 1 13 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.819 -1.756 25342 10560 1 13 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.983 -2.704 25342 10561 1 13 . 1 1 95 95 ILE N N 95 111.014 111.014 117.254 -6.240 25342 10562 1 13 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.175 -0.570 25342 10563 1 13 . 1 1 95 95 ILE C C 95 174.302 174.302 177.641 -3.339 25342 10564 1 13 . 1 1 95 95 ILE CA C 95 57.181 57.181 60.785 -3.604 25342 10565 1 13 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.437 -4.654 25342 10566 1 13 . 1 1 95 95 ILE H H 95 7.995 7.995 8.180 -0.185 25342 10567 1 13 . 1 1 96 96 LYS N N 96 123.208 123.208 121.460 1.748 25342 10568 1 13 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.826 -0.734 25342 10569 1 13 . 1 1 96 96 LYS C C 96 174.451 174.451 178.271 -3.820 25342 10570 1 13 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.636 -2.595 25342 10571 1 13 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.409 -2.662 25342 10572 1 13 . 1 1 96 96 LYS H H 96 6.928 6.928 7.576 -0.648 25342 10573 1 13 . 1 1 97 97 THR N N 97 113.320 113.320 114.764 -1.444 25342 10574 1 13 . 1 1 97 97 THR HA H 97 3.436 3.436 4.192 -0.756 25342 10575 1 13 . 1 1 97 97 THR C C 97 173.221 173.221 176.850 -3.629 25342 10576 1 13 . 1 1 97 97 THR CA C 97 62.710 62.710 65.823 -3.113 25342 10577 1 13 . 1 1 97 97 THR CB C 97 65.562 65.562 68.671 -3.109 25342 10578 1 13 . 1 1 97 97 THR H H 97 6.325 6.325 8.055 -1.730 25342 10579 1 13 . 1 1 98 98 LEU N N 98 120.963 120.963 122.018 -1.055 25342 10580 1 13 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.210 -0.585 25342 10581 1 13 . 1 1 98 98 LEU C C 98 174.713 174.713 178.889 -4.176 25342 10582 1 13 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.352 -1.838 25342 10583 1 13 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.634 -1.906 25342 10584 1 13 . 1 1 98 98 LEU H H 98 7.536 7.536 7.385 0.151 25342 10585 1 13 . 1 1 99 99 LEU N N 99 118.859 118.859 119.717 -0.858 25342 10586 1 13 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.646 0.026 25342 10587 1 13 . 1 1 99 99 LEU C C 99 177.458 177.458 178.865 -1.407 25342 10588 1 13 . 1 1 99 99 LEU CA C 99 55.145 55.145 57.918 -2.773 25342 10589 1 13 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.294 -2.437 25342 10590 1 13 . 1 1 99 99 LEU H H 99 8.179 8.179 8.342 -0.163 25342 10591 1 13 . 1 1 100 100 ASP N N 100 118.703 118.703 117.093 1.610 25342 10592 1 13 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.279 -0.058 25342 10593 1 13 . 1 1 100 100 ASP C C 100 176.472 176.472 177.735 -1.263 25342 10594 1 13 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.930 -2.623 25342 10595 1 13 . 1 1 100 100 ASP CB C 100 37.358 37.358 41.007 -3.649 25342 10596 1 13 . 1 1 100 100 ASP H H 100 7.867 7.867 7.681 0.186 25342 10597 1 13 . 1 1 101 101 GLN N N 101 117.829 117.829 117.687 0.142 25342 10598 1 13 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.205 -0.005 25342 10599 1 13 . 1 1 101 101 GLN C C 101 174.508 174.508 178.264 -3.756 25342 10600 1 13 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.480 -3.792 25342 10601 1 13 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.363 -3.765 25342 10602 1 13 . 1 1 101 101 GLN H H 101 7.597 7.597 7.475 0.122 25342 10603 1 13 . 1 1 102 102 MET N N 102 118.406 118.406 115.614 2.792 25342 10604 1 13 . 1 1 102 102 MET HA H 102 3.864 3.864 4.540 -0.676 25342 10605 1 13 . 1 1 102 102 MET C C 102 172.820 172.820 177.418 -4.598 25342 10606 1 13 . 1 1 102 102 MET CA C 102 53.298 53.298 56.158 -2.860 25342 10607 1 13 . 1 1 102 102 MET CB C 102 31.207 31.207 31.251 -0.044 25342 10608 1 13 . 1 1 102 102 MET H H 102 7.434 7.434 7.860 -0.426 25342 10609 1 13 . 1 1 103 103 LYS N N 103 115.889 115.889 120.088 -4.199 25342 10610 1 13 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.899 0.020 25342 10611 1 13 . 1 1 103 103 LYS C C 103 173.938 173.938 178.798 -4.860 25342 10612 1 13 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.949 -2.512 25342 10613 1 13 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.654 -2.391 25342 10614 1 13 . 1 1 103 103 LYS H H 103 6.881 6.881 7.821 -0.940 25342 10615 1 13 . 1 1 104 104 ASN N N 104 114.951 114.951 116.453 -1.502 25342 10616 1 13 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.736 -0.005 25342 10617 1 13 . 1 1 104 104 ASN C C 104 172.617 172.617 174.691 -2.074 25342 10618 1 13 . 1 1 104 104 ASN CA C 104 50.266 50.266 52.154 -1.888 25342 10619 1 13 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.024 -2.241 25342 10620 1 13 . 1 1 104 104 ASN H H 104 8.493 8.493 8.566 -0.073 25342 10621 1 13 . 1 1 105 105 TYR N N 105 122.680 122.680 120.604 2.076 25342 10622 1 13 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.768 -0.206 25342 10623 1 13 . 1 1 105 105 TYR CA C 105 55.433 55.433 57.021 -1.588 25342 10624 1 13 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.567 -3.735 25342 10625 1 13 . 1 1 105 105 TYR H H 105 8.217 8.217 7.988 0.229 25342 10626 1 13 . 1 1 106 106 ARG N N 106 128.872 128.872 119.375 9.497 25342 10627 1 13 . 1 1 106 106 ARG HA H 106 4.265 4.265 3.851 0.414 25342 10628 1 13 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.748 -1.766 25342 10629 1 13 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.397 -5.267 25342 10630 1 13 . 1 1 106 106 ARG H H 106 8.801 8.801 8.226 0.575 25342 10631 1 13 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.510 -2.108 25342 10632 1 13 . 1 1 108 108 GLU N N 108 117.000 117.000 122.359 -5.359 25342 10633 1 13 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.810 -0.184 25342 10634 1 13 . 1 1 108 108 GLU C C 108 174.125 174.125 175.052 -0.927 25342 10635 1 13 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.746 -1.958 25342 10636 1 13 . 1 1 108 108 GLU CB C 108 30.440 30.440 33.417 -2.977 25342 10637 1 13 . 1 1 108 108 GLU H H 108 7.514 7.514 8.490 -0.976 25342 10638 1 13 . 1 1 109 109 VAL N N 109 123.398 123.398 120.569 2.829 25342 10639 1 13 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.972 0.365 25342 10640 1 13 . 1 1 109 109 VAL C C 109 170.606 170.606 173.951 -3.345 25342 10641 1 13 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.742 -3.462 25342 10642 1 13 . 1 1 109 109 VAL CB C 109 32.657 32.657 36.649 -3.992 25342 10643 1 13 . 1 1 109 109 VAL H H 109 8.942 8.942 8.424 0.518 25342 10644 1 13 . 1 1 110 110 ALA N N 110 127.905 127.905 125.490 2.415 25342 10645 1 13 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.762 -0.135 25342 10646 1 13 . 1 1 110 110 ALA C C 110 173.195 173.195 174.655 -1.460 25342 10647 1 13 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.667 -2.321 25342 10648 1 13 . 1 1 110 110 ALA CB C 110 18.325 18.325 21.982 -3.657 25342 10649 1 13 . 1 1 110 110 ALA H H 110 8.776 8.776 8.163 0.613 25342 10650 1 13 . 1 1 111 111 SER N N 111 110.523 110.523 116.309 -5.786 25342 10651 1 13 . 1 1 111 111 SER HA H 111 5.562 5.562 5.097 0.465 25342 10652 1 13 . 1 1 111 111 SER C C 111 170.719 170.719 173.483 -2.764 25342 10653 1 13 . 1 1 111 111 SER CA C 111 51.314 51.314 55.426 -4.112 25342 10654 1 13 . 1 1 111 111 SER CB C 111 61.907 61.907 63.256 -1.349 25342 10655 1 13 . 1 1 111 111 SER H H 111 7.480 7.480 7.614 -0.134 25342 10656 1 13 . 1 1 112 112 PHE N N 112 125.567 125.567 123.939 1.628 25342 10657 1 13 . 1 1 112 112 PHE HA H 112 6.356 6.356 6.081 0.275 25342 10658 1 13 . 1 1 112 112 PHE C C 112 169.536 169.536 174.923 -5.387 25342 10659 1 13 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.060 -4.689 25342 10660 1 13 . 1 1 112 112 PHE CB C 112 39.788 39.788 40.685 -0.897 25342 10661 1 13 . 1 1 112 112 PHE H H 112 7.848 7.848 8.085 -0.237 25342 10662 1 13 . 1 1 113 113 PHE N N 113 115.065 115.065 113.748 1.317 25342 10663 1 13 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.175 0.929 25342 10664 1 13 . 1 1 113 113 PHE C C 113 173.006 173.006 173.477 -0.471 25342 10665 1 13 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.886 -5.624 25342 10666 1 13 . 1 1 113 113 PHE CB C 113 38.749 38.749 40.837 -2.088 25342 10667 1 13 . 1 1 113 113 PHE H H 113 7.361 7.361 8.236 -0.875 25342 10668 1 13 . 1 1 114 114 THR N N 114 108.014 108.014 113.823 -5.809 25342 10669 1 13 . 1 1 114 114 THR HA H 114 4.999 4.999 4.376 0.623 25342 10670 1 13 . 1 1 114 114 THR C C 114 169.874 169.874 174.285 -4.411 25342 10671 1 13 . 1 1 114 114 THR CA C 114 56.500 56.500 60.380 -3.880 25342 10672 1 13 . 1 1 114 114 THR CB C 114 68.809 68.809 69.067 -0.258 25342 10673 1 13 . 1 1 114 114 THR H H 114 7.867 7.867 7.993 -0.126 25342 10674 1 13 . 1 1 115 115 SER N N 115 115.049 115.049 120.011 -4.962 25342 10675 1 13 . 1 1 115 115 SER HA H 115 5.613 5.613 4.196 1.417 25342 10676 1 13 . 1 1 115 115 SER C C 115 171.247 171.247 175.567 -4.320 25342 10677 1 13 . 1 1 115 115 SER CA C 115 54.830 54.830 57.487 -2.657 25342 10678 1 13 . 1 1 115 115 SER CB C 115 63.992 63.992 63.168 0.824 25342 10679 1 13 . 1 1 115 115 SER H H 115 8.970 8.970 7.460 1.510 25342 10680 1 13 . 1 1 116 116 ALA N N 116 122.671 122.671 124.334 -1.663 25342 10681 1 13 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.209 0.776 25342 10682 1 13 . 1 1 116 116 ALA C C 116 176.180 176.180 177.396 -1.216 25342 10683 1 13 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.694 -2.494 25342 10684 1 13 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.102 -1.107 25342 10685 1 13 . 1 1 116 116 ALA H H 116 8.963 8.963 8.674 0.289 25342 10686 1 13 . 1 1 117 117 GLY N N 117 107.387 107.387 106.963 0.424 25342 10687 1 13 . 1 1 117 117 GLY C C 117 172.528 172.528 174.239 -1.711 25342 10688 1 13 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.660 -1.928 25342 10689 1 13 . 1 1 117 117 GLY H H 117 9.340 9.340 7.890 1.450 25342 10690 1 13 . 1 1 118 118 THR N N 118 113.481 113.481 110.285 3.196 25342 10691 1 13 . 1 1 118 118 THR HA H 118 4.651 4.651 4.538 0.113 25342 10692 1 13 . 1 1 118 118 THR C C 118 172.067 172.067 174.043 -1.976 25342 10693 1 13 . 1 1 118 118 THR CA C 118 57.357 57.357 60.251 -2.894 25342 10694 1 13 . 1 1 118 118 THR CB C 118 69.475 69.475 71.142 -1.667 25342 10695 1 13 . 1 1 118 118 THR H H 118 9.373 9.373 7.548 1.825 25342 10696 1 13 . 1 1 119 119 ASN N N 119 113.202 113.202 116.362 -3.160 25342 10697 1 13 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.405 0.213 25342 10698 1 13 . 1 1 119 119 ASN C C 119 173.114 173.114 176.141 -3.027 25342 10699 1 13 . 1 1 119 119 ASN CA C 119 51.684 51.684 53.957 -2.273 25342 10700 1 13 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.074 -3.344 25342 10701 1 13 . 1 1 119 119 ASN H H 119 8.908 8.908 8.835 0.073 25342 10702 1 13 . 1 1 120 120 HIS N N 120 117.315 117.315 119.916 -2.601 25342 10703 1 13 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.579 -0.793 25342 10704 1 13 . 1 1 120 120 HIS C C 120 174.381 174.381 176.820 -2.439 25342 10705 1 13 . 1 1 120 120 HIS CA C 120 54.516 54.516 60.058 -5.542 25342 10706 1 13 . 1 1 120 120 HIS CB C 120 26.504 26.504 30.210 -3.706 25342 10707 1 13 . 1 1 120 120 HIS H H 120 8.074 8.074 8.687 -0.613 25342 10708 1 13 . 1 1 121 121 LYS N N 121 118.678 118.678 119.047 -0.369 25342 10709 1 13 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.098 -0.264 25342 10710 1 13 . 1 1 121 121 LYS C C 121 176.564 176.564 179.056 -2.492 25342 10711 1 13 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.393 -2.098 25342 10712 1 13 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.262 -3.320 25342 10713 1 13 . 1 1 121 121 LYS H H 121 8.336 8.336 8.701 -0.365 25342 10714 1 13 . 1 1 122 122 ALA N N 122 122.146 122.146 122.201 -0.055 25342 10715 1 13 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.283 -0.588 25342 10716 1 13 . 1 1 122 122 ALA C C 122 175.163 175.163 179.524 -4.361 25342 10717 1 13 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.936 -3.244 25342 10718 1 13 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.898 -2.180 25342 10719 1 13 . 1 1 122 122 ALA H H 122 7.584 7.584 8.189 -0.605 25342 10720 1 13 . 1 1 123 123 TYR N N 123 119.730 119.730 119.647 0.083 25342 10721 1 13 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.098 -0.945 25342 10722 1 13 . 1 1 123 123 TYR C C 123 174.340 174.340 177.289 -2.949 25342 10723 1 13 . 1 1 123 123 TYR CA C 123 60.398 60.398 62.270 -1.872 25342 10724 1 13 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.878 -3.215 25342 10725 1 13 . 1 1 123 123 TYR H H 123 7.317 7.317 7.851 -0.534 25342 10726 1 13 . 1 1 124 124 VAL N N 124 118.649 118.649 118.033 0.616 25342 10727 1 13 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.194 0.008 25342 10728 1 13 . 1 1 124 124 VAL C C 124 175.603 175.603 177.890 -2.287 25342 10729 1 13 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.549 -1.869 25342 10730 1 13 . 1 1 124 124 VAL CB C 124 29.289 29.289 31.082 -1.794 25342 10731 1 13 . 1 1 124 124 VAL H H 124 7.799 7.799 7.451 0.348 25342 10732 1 13 . 1 1 125 125 SER N N 125 114.475 114.475 114.958 -0.483 25342 10733 1 13 . 1 1 125 125 SER HA H 125 4.032 4.032 4.012 0.020 25342 10734 1 13 . 1 1 125 125 SER C C 125 174.849 174.849 176.703 -1.854 25342 10735 1 13 . 1 1 125 125 SER CA C 125 59.002 59.002 61.587 -2.585 25342 10736 1 13 . 1 1 125 125 SER CB C 125 59.613 59.613 62.968 -3.354 25342 10737 1 13 . 1 1 125 125 SER H H 125 7.766 7.766 8.168 -0.402 25342 10738 1 13 . 1 1 126 126 HIS N N 126 119.326 119.326 120.916 -1.590 25342 10739 1 13 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.341 -0.214 25342 10740 1 13 . 1 1 126 126 HIS C C 126 172.865 172.865 177.407 -4.542 25342 10741 1 13 . 1 1 126 126 HIS CA C 126 55.706 55.706 60.086 -4.380 25342 10742 1 13 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.327 -4.334 25342 10743 1 13 . 1 1 126 126 HIS H H 126 8.569 8.569 8.061 0.508 25342 10744 1 13 . 1 1 127 127 PHE N N 127 121.044 121.044 119.667 1.377 25342 10745 1 13 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.002 -0.828 25342 10746 1 13 . 1 1 127 127 PHE C C 127 173.378 173.378 177.022 -3.644 25342 10747 1 13 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.973 -0.106 25342 10748 1 13 . 1 1 127 127 PHE CB C 127 36.054 36.054 38.781 -2.727 25342 10749 1 13 . 1 1 127 127 PHE H H 127 9.139 9.139 8.531 0.608 25342 10750 1 13 . 1 1 128 128 ASN N N 128 114.893 114.893 116.846 -1.953 25342 10751 1 13 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.200 -0.160 25342 10752 1 13 . 1 1 128 128 ASN C C 128 175.230 175.230 178.015 -2.785 25342 10753 1 13 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.793 -2.493 25342 10754 1 13 . 1 1 128 128 ASN CB C 128 36.171 36.171 37.886 -1.715 25342 10755 1 13 . 1 1 128 128 ASN H H 128 7.774 7.774 8.058 -0.284 25342 10756 1 13 . 1 1 129 129 GLU N N 129 119.804 119.804 120.825 -1.021 25342 10757 1 13 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.695 0.345 25342 10758 1 13 . 1 1 129 129 GLU C C 129 177.052 177.052 178.797 -1.745 25342 10759 1 13 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.766 -2.036 25342 10760 1 13 . 1 1 129 129 GLU CB C 129 27.196 27.196 28.925 -1.729 25342 10761 1 13 . 1 1 129 129 GLU H H 129 7.577 7.577 7.687 -0.110 25342 10762 1 13 . 1 1 130 130 TRP N N 130 120.979 120.979 116.801 4.178 25342 10763 1 13 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.221 0.236 25342 10764 1 13 . 1 1 130 130 TRP C C 130 174.329 174.329 175.358 -1.029 25342 10765 1 13 . 1 1 130 130 TRP CA C 130 54.688 54.688 57.555 -2.867 25342 10766 1 13 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.067 -2.076 25342 10767 1 13 . 1 1 130 130 TRP H H 130 8.225 8.225 7.207 1.018 25342 10768 1 13 . 1 1 131 131 ALA N N 131 120.450 120.450 117.521 2.929 25342 10769 1 13 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.279 -0.343 25342 10770 1 13 . 1 1 131 131 ALA C C 131 172.487 172.487 175.580 -3.093 25342 10771 1 13 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.111 -2.677 25342 10772 1 13 . 1 1 131 131 ALA CB C 131 16.288 16.288 20.096 -3.808 25342 10773 1 13 . 1 1 131 131 ALA H H 131 8.081 8.081 7.135 0.946 25342 10774 1 13 . 1 1 132 132 ASP N N 132 117.813 117.813 119.782 -1.969 25342 10775 1 13 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.343 -0.135 25342 10776 1 13 . 1 1 132 132 ASP C C 132 173.804 173.804 176.347 -2.543 25342 10777 1 13 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.583 -1.402 25342 10778 1 13 . 1 1 132 132 ASP CB C 132 39.321 39.321 41.654 -2.333 25342 10779 1 13 . 1 1 132 132 ASP H H 132 6.772 6.772 7.530 -0.758 25342 10780 1 13 . 1 1 133 133 GLY N N 133 115.052 115.052 112.344 2.708 25342 10781 1 13 . 1 1 133 133 GLY C C 133 172.078 172.078 174.686 -2.608 25342 10782 1 13 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.575 -2.155 25342 10783 1 13 . 1 1 133 133 GLY H H 133 8.626 8.626 8.124 0.502 25342 10784 1 13 . 1 1 134 134 LEU N N 134 120.063 120.063 121.254 -1.191 25342 10785 1 13 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.460 0.012 25342 10786 1 13 . 1 1 134 134 LEU C C 134 174.079 174.079 175.926 -1.847 25342 10787 1 13 . 1 1 134 134 LEU CA C 134 50.964 50.964 54.746 -3.782 25342 10788 1 13 . 1 1 134 134 LEU CB C 134 40.370 40.370 42.570 -2.200 25342 10789 1 13 . 1 1 134 134 LEU H H 134 8.094 8.094 7.547 0.547 25342 10790 1 13 . 1 1 135 135 ASN N N 135 119.292 119.292 117.233 2.059 25342 10791 1 13 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.928 -0.305 25342 10792 1 13 . 1 1 135 135 ASN C C 135 170.527 170.527 173.501 -2.974 25342 10793 1 13 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.690 -3.688 25342 10794 1 13 . 1 1 135 135 ASN CB C 135 33.560 33.560 41.059 -7.499 25342 10795 1 13 . 1 1 135 135 ASN H H 135 8.513 8.513 8.373 0.140 25342 10796 1 13 . 1 1 136 136 VAL N N 136 125.412 125.412 122.388 3.024 25342 10797 1 13 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.586 0.020 25342 10798 1 13 . 1 1 136 136 VAL C C 136 175.420 175.420 174.305 1.115 25342 10799 1 13 . 1 1 136 136 VAL CA C 136 58.382 58.382 61.027 -2.645 25342 10800 1 13 . 1 1 136 136 VAL CB C 136 29.247 29.247 34.838 -5.591 25342 10801 1 13 . 1 1 136 136 VAL H H 136 7.648 7.648 8.327 -0.679 25342 10802 1 13 . 1 1 137 137 ILE N N 137 121.881 121.881 118.155 3.726 25342 10803 1 13 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.659 -0.226 25342 10804 1 13 . 1 1 137 137 ILE C C 137 173.906 173.906 174.662 -0.756 25342 10805 1 13 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.152 -1.174 25342 10806 1 13 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.734 -2.538 25342 10807 1 13 . 1 1 137 137 ILE H H 137 9.139 9.139 8.766 0.373 25342 10808 1 13 . 1 1 138 138 GLY N N 138 108.226 108.226 107.039 1.187 25342 10809 1 13 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.207 -1.816 25342 10810 1 13 . 1 1 138 138 GLY H H 138 6.645 6.645 7.130 -0.485 25342 10811 1 13 . 1 1 139 139 VAL N N 139 119.408 119.408 119.291 0.117 25342 10812 1 13 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.994 0.363 25342 10813 1 13 . 1 1 139 139 VAL C C 139 172.327 172.327 175.407 -3.080 25342 10814 1 13 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.570 -2.303 25342 10815 1 13 . 1 1 139 139 VAL CB C 139 32.743 32.743 32.483 0.260 25342 10816 1 13 . 1 1 139 139 VAL H H 139 8.092 8.092 8.510 -0.418 25342 10817 1 13 . 1 1 140 140 ALA N N 140 127.415 127.415 131.392 -3.977 25342 10818 1 13 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.087 -0.642 25342 10819 1 13 . 1 1 140 140 ALA C C 140 170.718 170.718 175.522 -4.804 25342 10820 1 13 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.095 -2.195 25342 10821 1 13 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.144 -1.085 25342 10822 1 13 . 1 1 140 140 ALA H H 140 9.093 9.093 8.497 0.596 25342 10823 1 13 . 1 1 141 141 ARG N N 141 119.287 119.287 118.927 0.360 25342 10824 1 13 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.466 -2.979 25342 10825 1 13 . 1 1 141 141 ARG C C 141 173.375 173.375 176.549 -3.174 25342 10826 1 13 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.912 -3.028 25342 10827 1 13 . 1 1 141 141 ARG CB C 141 28.684 28.684 32.429 -3.745 25342 10828 1 13 . 1 1 141 141 ARG H H 141 7.620 7.620 8.732 -1.112 25342 10829 1 13 . 1 1 142 142 ASP N N 142 125.999 125.999 120.882 5.117 25342 10830 1 13 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.093 -0.369 25342 10831 1 13 . 1 1 142 142 ASP C C 142 169.292 169.292 176.015 -6.723 25342 10832 1 13 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.818 -3.479 25342 10833 1 13 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.570 -3.893 25342 10834 1 13 . 1 1 142 142 ASP H H 142 9.482 9.482 8.697 0.785 25342 10835 1 13 . 1 1 143 143 ASP N N 143 119.293 119.293 120.472 -1.179 25342 10836 1 13 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.449 -0.143 25342 10837 1 13 . 1 1 143 143 ASP C C 143 175.686 175.686 177.204 -1.518 25342 10838 1 13 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.904 -5.000 25342 10839 1 13 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.158 -3.846 25342 10840 1 13 . 1 1 143 143 ASP H H 143 8.108 8.108 8.423 -0.315 25342 10841 1 13 . 1 1 144 144 SER N N 144 115.303 115.303 117.810 -2.507 25342 10842 1 13 . 1 1 144 144 SER HA H 144 3.740 3.740 4.102 -0.362 25342 10843 1 13 . 1 1 144 144 SER C C 144 172.925 172.925 175.290 -2.365 25342 10844 1 13 . 1 1 144 144 SER CA C 144 59.213 59.213 61.154 -1.941 25342 10845 1 13 . 1 1 144 144 SER CB C 144 60.806 60.806 63.360 -2.554 25342 10846 1 13 . 1 1 144 144 SER H H 144 7.642 7.642 7.750 -0.108 25342 10847 1 13 . 1 1 145 145 GLU N N 145 119.523 119.523 116.718 2.805 25342 10848 1 13 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.227 0.079 25342 10849 1 13 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.350 -3.311 25342 10850 1 13 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.538 -2.738 25342 10851 1 13 . 1 1 145 145 GLU H H 145 7.771 7.771 8.115 -0.344 25342 10852 1 13 . 1 1 146 146 VAL N N 146 118.683 118.683 121.030 -2.347 25342 10853 1 13 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.820 -0.879 25342 10854 1 13 . 1 1 146 146 VAL C C 146 174.591 174.591 175.558 -0.967 25342 10855 1 13 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.163 -2.231 25342 10856 1 13 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.976 -2.929 25342 10857 1 13 . 1 1 146 146 VAL H H 146 6.352 6.352 7.023 -0.671 25342 10858 1 13 . 1 1 147 147 ASP N N 147 119.312 119.312 114.180 5.132 25342 10859 1 13 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.423 -0.368 25342 10860 1 13 . 1 1 147 147 ASP C C 147 174.783 174.783 176.655 -1.872 25342 10861 1 13 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.073 -1.832 25342 10862 1 13 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.641 -3.408 25342 10863 1 13 . 1 1 147 147 ASP H H 147 8.370 8.370 8.604 -0.234 25342 10864 1 13 . 1 1 148 148 LYS N N 148 119.342 119.342 116.036 3.306 25342 10865 1 13 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.564 -0.627 25342 10866 1 13 . 1 1 148 148 LYS C C 148 176.384 176.384 178.149 -1.765 25342 10867 1 13 . 1 1 148 148 LYS CA C 148 55.706 55.706 56.813 -1.107 25342 10868 1 13 . 1 1 148 148 LYS CB C 148 29.511 29.511 33.663 -4.152 25342 10869 1 13 . 1 1 148 148 LYS H H 148 7.040 7.040 7.428 -0.388 25342 10870 1 13 . 1 1 149 149 TRP N N 149 118.258 118.258 121.505 -3.247 25342 10871 1 13 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.844 -0.253 25342 10872 1 13 . 1 1 149 149 TRP C C 149 174.212 174.212 176.165 -1.953 25342 10873 1 13 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.893 -2.148 25342 10874 1 13 . 1 1 149 149 TRP CB C 149 26.940 26.940 27.849 -0.909 25342 10875 1 13 . 1 1 149 149 TRP H H 149 7.811 7.811 8.119 -0.308 25342 10876 1 13 . 1 1 150 150 SER N N 150 109.618 109.618 113.601 -3.983 25342 10877 1 13 . 1 1 150 150 SER HA H 150 4.234 4.234 4.658 -0.424 25342 10878 1 13 . 1 1 150 150 SER C C 150 170.189 170.189 173.318 -3.129 25342 10879 1 13 . 1 1 150 150 SER CA C 150 56.695 56.695 58.133 -1.438 25342 10880 1 13 . 1 1 150 150 SER CB C 150 61.935 61.935 63.737 -1.802 25342 10881 1 13 . 1 1 150 150 SER H H 150 7.793 7.793 7.895 -0.102 25342 10882 1 14 . 1 1 3 3 ALA N N 3 125.638 125.638 126.140 -0.502 25342 10883 1 14 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.628 -0.263 25342 10884 1 14 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.656 -3.358 25342 10885 1 14 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.757 -2.898 25342 10886 1 14 . 1 1 3 3 ALA H H 3 8.325 8.325 8.647 -0.322 25342 10887 1 14 . 1 1 4 4 LYS N N 4 121.813 121.813 120.022 1.791 25342 10888 1 14 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.464 -0.237 25342 10889 1 14 . 1 1 4 4 LYS C C 4 174.574 174.574 174.201 0.373 25342 10890 1 14 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.200 -1.419 25342 10891 1 14 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.128 -2.638 25342 10892 1 14 . 1 1 4 4 LYS H H 4 8.486 8.486 7.710 0.776 25342 10893 1 14 . 1 1 5 5 LYS N N 5 129.722 129.722 120.306 9.416 25342 10894 1 14 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.615 -0.097 25342 10895 1 14 . 1 1 5 5 LYS C C 5 174.720 174.720 174.716 0.004 25342 10896 1 14 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.540 -0.818 25342 10897 1 14 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.470 -6.685 25342 10898 1 14 . 1 1 5 5 LYS H H 5 10.015 10.015 8.360 1.655 25342 10899 1 14 . 1 1 6 6 THR N N 6 126.254 126.254 116.910 9.344 25342 10900 1 14 . 1 1 6 6 THR HA H 6 5.654 5.654 5.014 0.640 25342 10901 1 14 . 1 1 6 6 THR C C 6 169.926 169.926 173.007 -3.081 25342 10902 1 14 . 1 1 6 6 THR CA C 6 60.598 60.598 62.013 -1.415 25342 10903 1 14 . 1 1 6 6 THR CB C 6 68.041 68.041 69.493 -1.452 25342 10904 1 14 . 1 1 6 6 THR H H 6 8.538 8.538 8.575 -0.037 25342 10905 1 14 . 1 1 7 7 LEU N N 7 130.775 130.775 127.941 2.834 25342 10906 1 14 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.428 0.166 25342 10907 1 14 . 1 1 7 7 LEU C C 7 170.404 170.404 174.365 -3.961 25342 10908 1 14 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.987 -4.054 25342 10909 1 14 . 1 1 7 7 LEU CB C 7 40.728 40.728 43.555 -2.827 25342 10910 1 14 . 1 1 7 7 LEU H H 7 8.575 8.575 8.436 0.139 25342 10911 1 14 . 1 1 8 8 ILE N N 8 127.242 127.242 124.493 2.749 25342 10912 1 14 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.819 0.029 25342 10913 1 14 . 1 1 8 8 ILE C C 8 170.936 170.936 174.507 -3.571 25342 10914 1 14 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.461 -3.209 25342 10915 1 14 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.423 -3.489 25342 10916 1 14 . 1 1 8 8 ILE H H 8 9.217 9.217 8.256 0.961 25342 10917 1 14 . 1 1 9 9 LEU N N 9 127.183 127.183 128.144 -0.961 25342 10918 1 14 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.955 0.739 25342 10919 1 14 . 1 1 9 9 LEU C C 9 173.824 173.824 175.501 -1.677 25342 10920 1 14 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.416 -4.577 25342 10921 1 14 . 1 1 9 9 LEU CB C 9 43.963 43.963 43.126 0.837 25342 10922 1 14 . 1 1 9 9 LEU H H 9 9.248 9.248 8.880 0.368 25342 10923 1 14 . 1 1 10 10 TYR N N 10 113.330 113.330 122.335 -9.005 25342 10924 1 14 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.185 0.329 25342 10925 1 14 . 1 1 10 10 TYR C C 10 167.898 167.898 173.052 -5.154 25342 10926 1 14 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.220 -0.345 25342 10927 1 14 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.934 -2.498 25342 10928 1 14 . 1 1 10 10 TYR H H 10 7.306 7.306 8.404 -1.098 25342 10929 1 14 . 1 1 11 11 TYR N N 11 121.297 121.297 122.840 -1.543 25342 10930 1 14 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.892 -0.130 25342 10931 1 14 . 1 1 11 11 TYR C C 11 169.698 169.698 174.623 -4.925 25342 10932 1 14 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.685 -0.638 25342 10933 1 14 . 1 1 11 11 TYR CB C 11 40.538 40.538 40.063 0.475 25342 10934 1 14 . 1 1 11 11 TYR H H 11 7.891 7.891 8.441 -0.550 25342 10935 1 14 . 1 1 12 12 SER N N 12 117.763 117.763 124.058 -6.295 25342 10936 1 14 . 1 1 12 12 SER HA H 12 4.679 4.679 3.845 0.834 25342 10937 1 14 . 1 1 12 12 SER C C 12 170.075 170.075 174.040 -3.965 25342 10938 1 14 . 1 1 12 12 SER CA C 12 53.619 53.619 57.029 -3.410 25342 10939 1 14 . 1 1 12 12 SER CB C 12 62.847 62.847 62.249 0.598 25342 10940 1 14 . 1 1 12 12 SER H H 12 7.557 7.557 8.114 -0.557 25342 10941 1 14 . 1 1 13 13 TRP N N 13 135.232 135.232 130.078 5.154 25342 10942 1 14 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.774 0.862 25342 10943 1 14 . 1 1 13 13 TRP C C 13 175.708 175.708 176.161 -0.453 25342 10944 1 14 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.919 -1.803 25342 10945 1 14 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.477 -1.842 25342 10946 1 14 . 1 1 13 13 TRP H H 13 9.755 9.755 7.706 2.049 25342 10947 1 14 . 1 1 14 14 SER N N 14 113.789 113.789 108.702 5.087 25342 10948 1 14 . 1 1 14 14 SER HA H 14 4.223 4.223 4.338 -0.115 25342 10949 1 14 . 1 1 14 14 SER C C 14 172.747 172.747 173.860 -1.113 25342 10950 1 14 . 1 1 14 14 SER CA C 14 53.828 53.828 58.431 -4.604 25342 10951 1 14 . 1 1 14 14 SER CB C 14 60.037 60.037 64.647 -4.610 25342 10952 1 14 . 1 1 14 14 SER H H 14 10.026 10.026 8.386 1.640 25342 10953 1 14 . 1 1 15 15 GLY N N 15 110.489 110.489 109.037 1.452 25342 10954 1 14 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.610 -0.951 25342 10955 1 14 . 1 1 15 15 GLY H H 15 7.391 7.391 8.418 -1.027 25342 10956 1 14 . 1 1 16 16 GLU N N 16 129.005 129.005 121.904 7.101 25342 10957 1 14 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.222 -0.159 25342 10958 1 14 . 1 1 16 16 GLU CA C 16 56.761 56.761 59.344 -2.583 25342 10959 1 14 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.618 -3.206 25342 10960 1 14 . 1 1 16 16 GLU H H 16 11.550 11.550 8.706 2.844 25342 10961 1 14 . 1 1 17 17 THR N N 17 123.016 123.016 115.068 7.948 25342 10962 1 14 . 1 1 17 17 THR HA H 17 4.035 4.035 4.062 -0.027 25342 10963 1 14 . 1 1 17 17 THR C C 17 173.360 173.360 177.009 -3.649 25342 10964 1 14 . 1 1 17 17 THR CA C 17 64.303 64.303 65.547 -1.244 25342 10965 1 14 . 1 1 17 17 THR CB C 17 63.999 63.999 68.514 -4.515 25342 10966 1 14 . 1 1 17 17 THR H H 17 11.293 11.293 8.418 2.875 25342 10967 1 14 . 1 1 18 18 LYS N N 18 120.156 120.156 121.975 -1.819 25342 10968 1 14 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.299 -1.443 25342 10969 1 14 . 1 1 18 18 LYS C C 18 173.901 173.901 178.916 -5.015 25342 10970 1 14 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.681 -2.847 25342 10971 1 14 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.326 -2.845 25342 10972 1 14 . 1 1 18 18 LYS H H 18 6.940 6.940 8.239 -1.299 25342 10973 1 14 . 1 1 19 19 LYS N N 19 117.237 117.237 117.628 -0.391 25342 10974 1 14 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.077 -0.154 25342 10975 1 14 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.053 -2.729 25342 10976 1 14 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.100 -2.739 25342 10977 1 14 . 1 1 19 19 LYS H H 19 7.212 7.212 7.838 -0.626 25342 10978 1 14 . 1 1 20 20 MET N N 20 119.268 119.268 117.687 1.581 25342 10979 1 14 . 1 1 20 20 MET HA H 20 4.413 4.413 4.220 0.193 25342 10980 1 14 . 1 1 20 20 MET C C 20 173.625 173.625 177.232 -3.607 25342 10981 1 14 . 1 1 20 20 MET CA C 20 52.261 52.261 56.288 -4.027 25342 10982 1 14 . 1 1 20 20 MET CB C 20 26.680 26.680 32.048 -5.368 25342 10983 1 14 . 1 1 20 20 MET H H 20 7.600 7.600 7.838 -0.238 25342 10984 1 14 . 1 1 21 21 ALA N N 21 123.669 123.669 121.888 1.781 25342 10985 1 14 . 1 1 21 21 ALA HA H 21 3.482 3.482 3.772 -0.290 25342 10986 1 14 . 1 1 21 21 ALA C C 21 176.628 176.628 179.394 -2.766 25342 10987 1 14 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.158 -2.784 25342 10988 1 14 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.501 -1.006 25342 10989 1 14 . 1 1 21 21 ALA H H 21 8.738 8.738 7.476 1.262 25342 10990 1 14 . 1 1 22 22 GLU N N 22 117.242 117.242 118.219 -0.977 25342 10991 1 14 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.847 -0.174 25342 10992 1 14 . 1 1 22 22 GLU C C 22 176.698 176.698 178.803 -2.105 25342 10993 1 14 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.404 -2.864 25342 10994 1 14 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.354 -2.920 25342 10995 1 14 . 1 1 22 22 GLU H H 22 7.959 7.959 7.720 0.239 25342 10996 1 14 . 1 1 23 23 LYS N N 23 123.302 123.302 119.097 4.205 25342 10997 1 14 . 1 1 23 23 LYS HA H 23 3.821 3.821 3.979 -0.158 25342 10998 1 14 . 1 1 23 23 LYS C C 23 177.389 177.389 178.257 -0.868 25342 10999 1 14 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.028 -2.106 25342 11000 1 14 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.287 -2.773 25342 11001 1 14 . 1 1 23 23 LYS H H 23 7.703 7.703 7.303 0.400 25342 11002 1 14 . 1 1 24 24 ILE N N 24 122.208 122.208 116.457 5.751 25342 11003 1 14 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.686 -0.403 25342 11004 1 14 . 1 1 24 24 ILE C C 24 174.934 174.934 177.609 -2.675 25342 11005 1 14 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.129 -0.838 25342 11006 1 14 . 1 1 24 24 ILE CB C 24 34.738 34.738 38.010 -3.272 25342 11007 1 14 . 1 1 24 24 ILE H H 24 8.535 8.535 7.544 0.991 25342 11008 1 14 . 1 1 25 25 ASN N N 25 118.640 118.640 118.935 -0.295 25342 11009 1 14 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.371 -0.144 25342 11010 1 14 . 1 1 25 25 ASN C C 25 173.530 173.530 177.730 -4.200 25342 11011 1 14 . 1 1 25 25 ASN CA C 25 52.211 52.211 55.790 -3.579 25342 11012 1 14 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.639 -0.535 25342 11013 1 14 . 1 1 25 25 ASN H H 25 8.317 8.317 8.468 -0.151 25342 11014 1 14 . 1 1 26 26 SER N N 26 111.990 111.990 113.803 -1.813 25342 11015 1 14 . 1 1 26 26 SER HA H 26 4.153 4.153 4.429 -0.276 25342 11016 1 14 . 1 1 26 26 SER C C 26 172.110 172.110 174.969 -2.859 25342 11017 1 14 . 1 1 26 26 SER CA C 26 57.905 57.905 59.883 -1.978 25342 11018 1 14 . 1 1 26 26 SER CB C 26 60.655 60.655 62.539 -1.884 25342 11019 1 14 . 1 1 26 26 SER H H 26 7.369 7.369 8.341 -0.972 25342 11020 1 14 . 1 1 27 27 GLU N N 27 120.201 120.201 119.357 0.844 25342 11021 1 14 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.471 -0.370 25342 11022 1 14 . 1 1 27 27 GLU C C 27 173.673 173.673 175.765 -2.092 25342 11023 1 14 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.211 -1.976 25342 11024 1 14 . 1 1 27 27 GLU CB C 27 26.601 26.601 31.080 -4.479 25342 11025 1 14 . 1 1 27 27 GLU H H 27 7.451 7.451 7.786 -0.335 25342 11026 1 14 . 1 1 28 28 ILE N N 28 118.762 118.762 119.054 -0.292 25342 11027 1 14 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.319 -0.120 25342 11028 1 14 . 1 1 28 28 ILE C C 28 172.487 172.487 175.852 -3.365 25342 11029 1 14 . 1 1 28 28 ILE CA C 28 57.732 57.732 59.847 -2.115 25342 11030 1 14 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.580 -4.842 25342 11031 1 14 . 1 1 28 28 ILE H H 28 7.255 7.255 7.225 0.030 25342 11032 1 14 . 1 1 29 29 LYS N N 29 130.563 130.563 121.760 8.803 25342 11033 1 14 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.127 -0.125 25342 11034 1 14 . 1 1 29 29 LYS C C 29 174.386 174.386 178.180 -3.794 25342 11035 1 14 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.414 -1.879 25342 11036 1 14 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.916 -3.330 25342 11037 1 14 . 1 1 29 29 LYS H H 29 8.564 8.564 8.561 0.003 25342 11038 1 14 . 1 1 30 30 ASP N N 30 119.357 119.357 119.742 -0.385 25342 11039 1 14 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.483 -0.081 25342 11040 1 14 . 1 1 30 30 ASP C C 30 172.570 172.570 175.521 -2.951 25342 11041 1 14 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.702 -1.266 25342 11042 1 14 . 1 1 30 30 ASP CB C 30 36.744 36.744 38.828 -2.084 25342 11043 1 14 . 1 1 30 30 ASP H H 30 8.920 8.920 8.632 0.288 25342 11044 1 14 . 1 1 31 31 SER N N 31 114.019 114.019 114.327 -0.308 25342 11045 1 14 . 1 1 31 31 SER HA H 31 4.782 4.782 4.402 0.380 25342 11046 1 14 . 1 1 31 31 SER C C 31 171.150 171.150 174.750 -3.600 25342 11047 1 14 . 1 1 31 31 SER CA C 31 55.551 55.551 58.798 -3.247 25342 11048 1 14 . 1 1 31 31 SER CB C 31 62.259 62.259 64.020 -1.761 25342 11049 1 14 . 1 1 31 31 SER H H 31 8.006 8.006 7.813 0.193 25342 11050 1 14 . 1 1 32 32 GLU N N 32 121.455 121.455 121.645 -0.190 25342 11051 1 14 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.186 0.554 25342 11052 1 14 . 1 1 32 32 GLU C C 32 171.185 171.185 175.175 -3.990 25342 11053 1 14 . 1 1 32 32 GLU CA C 32 52.081 52.081 56.745 -4.665 25342 11054 1 14 . 1 1 32 32 GLU CB C 32 30.827 30.827 30.526 0.301 25342 11055 1 14 . 1 1 32 32 GLU H H 32 8.145 8.145 8.649 -0.504 25342 11056 1 14 . 1 1 33 33 LEU N N 33 126.176 126.176 120.748 5.428 25342 11057 1 14 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.508 0.798 25342 11058 1 14 . 1 1 33 33 LEU C C 33 173.365 173.365 175.731 -2.366 25342 11059 1 14 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.155 -2.715 25342 11060 1 14 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.316 0.319 25342 11061 1 14 . 1 1 33 33 LEU H H 33 8.589 8.589 8.204 0.385 25342 11062 1 14 . 1 1 34 34 LYS N N 34 127.200 127.200 126.380 0.820 25342 11063 1 14 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.755 -0.159 25342 11064 1 14 . 1 1 34 34 LYS C C 34 169.622 169.622 174.859 -5.237 25342 11065 1 14 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.252 -1.923 25342 11066 1 14 . 1 1 34 34 LYS CB C 34 34.200 34.200 34.075 0.125 25342 11067 1 14 . 1 1 34 34 LYS H H 34 9.380 9.380 8.846 0.534 25342 11068 1 14 . 1 1 35 35 GLU N N 35 122.324 122.324 118.366 3.958 25342 11069 1 14 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.417 -2.084 25342 11070 1 14 . 1 1 35 35 GLU C C 35 172.734 172.734 174.520 -1.786 25342 11071 1 14 . 1 1 35 35 GLU CA C 35 52.612 52.612 55.107 -2.495 25342 11072 1 14 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.910 -4.591 25342 11073 1 14 . 1 1 35 35 GLU H H 35 8.094 8.094 8.532 -0.438 25342 11074 1 14 . 1 1 36 36 VAL N N 36 126.781 126.781 118.350 8.431 25342 11075 1 14 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.616 -0.777 25342 11076 1 14 . 1 1 36 36 VAL C C 36 171.482 171.482 175.328 -3.846 25342 11077 1 14 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.470 -1.065 25342 11078 1 14 . 1 1 36 36 VAL CB C 36 29.348 29.348 34.321 -4.973 25342 11079 1 14 . 1 1 36 36 VAL H H 36 8.660 8.660 8.787 -0.127 25342 11080 1 14 . 1 1 37 37 LYS N N 37 126.065 126.065 120.691 5.374 25342 11081 1 14 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.848 0.117 25342 11082 1 14 . 1 1 37 37 LYS C C 37 173.187 173.187 174.839 -1.652 25342 11083 1 14 . 1 1 37 37 LYS CA C 37 52.280 52.280 55.132 -2.852 25342 11084 1 14 . 1 1 37 37 LYS CB C 37 32.921 32.921 37.052 -4.131 25342 11085 1 14 . 1 1 37 37 LYS H H 37 7.809 7.809 7.910 -0.101 25342 11086 1 14 . 1 1 38 38 VAL N N 38 111.020 111.020 115.041 -4.021 25342 11087 1 14 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.536 0.288 25342 11088 1 14 . 1 1 38 38 VAL C C 38 173.604 173.604 175.787 -2.183 25342 11089 1 14 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.332 -2.949 25342 11090 1 14 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.137 -1.761 25342 11091 1 14 . 1 1 38 38 VAL H H 38 8.305 8.305 8.150 0.155 25342 11092 1 14 . 1 1 39 39 SER N N 39 117.887 117.887 114.906 2.981 25342 11093 1 14 . 1 1 39 39 SER HA H 39 4.183 4.183 4.430 -0.247 25342 11094 1 14 . 1 1 39 39 SER C C 39 173.538 173.538 174.427 -0.889 25342 11095 1 14 . 1 1 39 39 SER CA C 39 56.279 56.279 58.193 -1.914 25342 11096 1 14 . 1 1 39 39 SER CB C 39 60.537 60.537 63.663 -3.127 25342 11097 1 14 . 1 1 39 39 SER H H 39 8.847 8.847 8.376 0.471 25342 11098 1 14 . 1 1 40 40 GLU N N 40 126.316 126.316 118.679 7.637 25342 11099 1 14 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.458 -0.304 25342 11100 1 14 . 1 1 40 40 GLU C C 40 174.586 174.586 177.324 -2.738 25342 11101 1 14 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.277 -0.465 25342 11102 1 14 . 1 1 40 40 GLU CB C 40 26.720 26.720 30.127 -3.407 25342 11103 1 14 . 1 1 40 40 GLU H H 40 9.049 9.049 8.394 0.655 25342 11104 1 14 . 1 1 41 41 GLY N N 41 112.494 112.494 115.162 -2.668 25342 11105 1 14 . 1 1 41 41 GLY C C 41 171.994 171.994 174.952 -2.958 25342 11106 1 14 . 1 1 41 41 GLY CA C 41 42.462 42.462 46.474 -4.012 25342 11107 1 14 . 1 1 41 41 GLY H H 41 8.780 8.780 9.036 -0.256 25342 11108 1 14 . 1 1 42 42 THR N N 42 118.631 118.631 113.710 4.921 25342 11109 1 14 . 1 1 42 42 THR HA H 42 3.582 3.582 3.796 -0.214 25342 11110 1 14 . 1 1 42 42 THR C C 42 171.225 171.225 173.453 -2.228 25342 11111 1 14 . 1 1 42 42 THR CA C 42 64.104 64.104 64.222 -0.118 25342 11112 1 14 . 1 1 42 42 THR CB C 42 65.914 65.914 68.858 -2.944 25342 11113 1 14 . 1 1 42 42 THR H H 42 7.737 7.737 8.002 -0.265 25342 11114 1 14 . 1 1 43 43 PHE N N 43 116.279 116.279 116.439 -0.160 25342 11115 1 14 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.974 0.046 25342 11116 1 14 . 1 1 43 43 PHE C C 43 170.141 170.141 173.969 -3.828 25342 11117 1 14 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.133 -3.661 25342 11118 1 14 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.909 -4.524 25342 11119 1 14 . 1 1 43 43 PHE H H 43 8.114 8.114 7.374 0.740 25342 11120 1 14 . 1 1 44 44 ASP N N 44 121.513 121.513 119.974 1.539 25342 11121 1 14 . 1 1 44 44 ASP HA H 44 4.851 4.851 5.010 -0.159 25342 11122 1 14 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.058 -2.846 25342 11123 1 14 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.532 -0.147 25342 11124 1 14 . 1 1 44 44 ASP H H 44 7.774 7.774 8.937 -1.163 25342 11125 1 14 . 1 1 45 45 ALA N N 45 125.663 125.663 121.929 3.734 25342 11126 1 14 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.754 -0.543 25342 11127 1 14 . 1 1 45 45 ALA C C 45 175.139 175.139 175.573 -0.434 25342 11128 1 14 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.226 -0.790 25342 11129 1 14 . 1 1 45 45 ALA CB C 45 16.232 16.232 19.679 -3.447 25342 11130 1 14 . 1 1 45 45 ALA H H 45 8.324 8.324 8.320 0.004 25342 11131 1 14 . 1 1 46 46 ASP N N 46 119.288 119.288 121.345 -2.057 25342 11132 1 14 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.764 0.061 25342 11133 1 14 . 1 1 46 46 ASP C C 46 175.013 175.013 177.008 -1.995 25342 11134 1 14 . 1 1 46 46 ASP CA C 46 51.161 51.161 52.549 -1.388 25342 11135 1 14 . 1 1 46 46 ASP CB C 46 41.233 41.233 43.224 -1.991 25342 11136 1 14 . 1 1 46 46 ASP H H 46 9.618 9.618 8.176 1.442 25342 11137 1 14 . 1 1 47 47 MET N N 47 127.347 127.347 122.048 5.299 25342 11138 1 14 . 1 1 47 47 MET HA H 47 3.456 3.456 4.011 -0.555 25342 11139 1 14 . 1 1 47 47 MET C C 47 173.605 173.605 177.492 -3.887 25342 11140 1 14 . 1 1 47 47 MET CA C 47 56.699 56.699 58.992 -2.293 25342 11141 1 14 . 1 1 47 47 MET CB C 47 29.930 29.930 32.236 -2.306 25342 11142 1 14 . 1 1 47 47 MET H H 47 9.178 9.178 8.492 0.686 25342 11143 1 14 . 1 1 48 48 TYR N N 48 121.040 121.040 117.502 3.538 25342 11144 1 14 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.223 -0.351 25342 11145 1 14 . 1 1 48 48 TYR CA C 48 58.712 58.712 60.550 -1.837 25342 11146 1 14 . 1 1 48 48 TYR CB C 48 33.638 33.638 36.932 -3.294 25342 11147 1 14 . 1 1 48 48 TYR H H 48 7.881 7.881 7.728 0.153 25342 11148 1 14 . 1 1 49 49 LYS N N 49 121.754 121.754 119.958 1.796 25342 11149 1 14 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.019 0.086 25342 11150 1 14 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.104 -2.719 25342 11151 1 14 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.034 -2.870 25342 11152 1 14 . 1 1 49 49 LYS H H 49 8.365 8.365 6.964 1.401 25342 11153 1 14 . 1 1 50 50 THR N N 50 117.557 117.557 110.365 7.192 25342 11154 1 14 . 1 1 50 50 THR HA H 50 3.586 3.586 4.015 -0.429 25342 11155 1 14 . 1 1 50 50 THR CA C 50 65.634 65.634 64.389 1.244 25342 11156 1 14 . 1 1 50 50 THR CB C 50 65.904 65.904 67.355 -1.451 25342 11157 1 14 . 1 1 50 50 THR H H 50 8.007 8.007 7.994 0.013 25342 11158 1 14 . 1 1 51 51 SER N N 51 115.110 115.110 118.433 -3.323 25342 11159 1 14 . 1 1 51 51 SER HA H 51 3.974 3.974 3.977 -0.003 25342 11160 1 14 . 1 1 51 51 SER CA C 51 59.042 59.042 62.391 -3.349 25342 11161 1 14 . 1 1 51 51 SER CB C 51 59.835 59.835 62.761 -2.926 25342 11162 1 14 . 1 1 51 51 SER H H 51 7.606 7.606 7.582 0.024 25342 11163 1 14 . 1 1 52 52 ASP N N 52 119.713 119.713 121.584 -1.871 25342 11164 1 14 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.516 -0.208 25342 11165 1 14 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.775 -2.248 25342 11166 1 14 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.725 -3.037 25342 11167 1 14 . 1 1 52 52 ASP H H 52 7.552 7.552 7.553 -0.001 25342 11168 1 14 . 1 1 53 53 ILE N N 53 121.982 121.982 119.421 2.561 25342 11169 1 14 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.674 0.048 25342 11170 1 14 . 1 1 53 53 ILE C C 53 175.325 175.325 177.900 -2.575 25342 11171 1 14 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.843 -3.299 25342 11172 1 14 . 1 1 53 53 ILE CB C 53 36.699 36.699 38.084 -1.385 25342 11173 1 14 . 1 1 53 53 ILE H H 53 7.815 7.815 7.985 -0.170 25342 11174 1 14 . 1 1 54 54 ALA N N 54 121.552 121.552 121.965 -0.413 25342 11175 1 14 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.212 0.105 25342 11176 1 14 . 1 1 54 54 ALA C C 54 177.475 177.475 179.355 -1.880 25342 11177 1 14 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.706 -2.684 25342 11178 1 14 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.750 -2.766 25342 11179 1 14 . 1 1 54 54 ALA H H 54 8.332 8.332 7.459 0.873 25342 11180 1 14 . 1 1 55 55 LEU N N 55 117.176 117.176 119.406 -2.230 25342 11181 1 14 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.867 0.067 25342 11182 1 14 . 1 1 55 55 LEU C C 55 176.532 176.532 178.448 -1.916 25342 11183 1 14 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.395 -2.063 25342 11184 1 14 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.654 -3.226 25342 11185 1 14 . 1 1 55 55 LEU H H 55 8.195 8.195 7.610 0.585 25342 11186 1 14 . 1 1 56 56 ASP N N 56 120.056 120.056 118.442 1.614 25342 11187 1 14 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.286 0.181 25342 11188 1 14 . 1 1 56 56 ASP C C 56 176.585 176.585 178.321 -1.736 25342 11189 1 14 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.768 -3.218 25342 11190 1 14 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.696 -2.391 25342 11191 1 14 . 1 1 56 56 ASP H H 56 7.806 7.806 8.619 -0.813 25342 11192 1 14 . 1 1 57 57 GLN N N 57 120.020 120.020 118.119 1.901 25342 11193 1 14 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.397 -0.274 25342 11194 1 14 . 1 1 57 57 GLN C C 57 175.689 175.689 178.765 -3.076 25342 11195 1 14 . 1 1 57 57 GLN CA C 57 54.405 54.405 58.126 -3.721 25342 11196 1 14 . 1 1 57 57 GLN CB C 57 23.769 23.769 29.103 -5.334 25342 11197 1 14 . 1 1 57 57 GLN H H 57 7.661 7.661 7.505 0.156 25342 11198 1 14 . 1 1 58 58 ILE N N 58 120.644 120.644 119.898 0.746 25342 11199 1 14 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.011 -0.435 25342 11200 1 14 . 1 1 58 58 ILE C C 58 176.237 176.237 177.975 -1.738 25342 11201 1 14 . 1 1 58 58 ILE CA C 58 62.506 62.506 64.302 -1.796 25342 11202 1 14 . 1 1 58 58 ILE CB C 58 36.029 36.029 37.998 -1.969 25342 11203 1 14 . 1 1 58 58 ILE H H 58 8.228 8.228 7.863 0.365 25342 11204 1 14 . 1 1 59 59 GLN N N 59 115.498 115.498 118.506 -3.008 25342 11205 1 14 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.302 -0.160 25342 11206 1 14 . 1 1 59 59 GLN C C 59 173.781 173.781 176.579 -2.798 25342 11207 1 14 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.470 -2.488 25342 11208 1 14 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.134 -2.523 25342 11209 1 14 . 1 1 59 59 GLN H H 59 8.331 8.331 8.305 0.026 25342 11210 1 14 . 1 1 60 60 GLY N N 60 106.623 106.623 106.364 0.259 25342 11211 1 14 . 1 1 60 60 GLY C C 60 172.068 172.068 175.380 -3.312 25342 11212 1 14 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.563 -2.691 25342 11213 1 14 . 1 1 60 60 GLY H H 60 7.611 7.611 7.636 -0.025 25342 11214 1 14 . 1 1 61 61 ASN N N 61 117.691 117.691 118.118 -0.427 25342 11215 1 14 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.600 -0.056 25342 11216 1 14 . 1 1 61 61 ASN C C 61 171.946 171.946 175.590 -3.644 25342 11217 1 14 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.575 -3.006 25342 11218 1 14 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.886 -2.526 25342 11219 1 14 . 1 1 61 61 ASN H H 61 8.151 8.151 8.454 -0.303 25342 11220 1 14 . 1 1 62 62 LYS N N 62 118.289 118.289 119.749 -1.460 25342 11221 1 14 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.612 -0.284 25342 11222 1 14 . 1 1 62 62 LYS C C 62 171.773 171.773 175.417 -3.644 25342 11223 1 14 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.449 -3.153 25342 11224 1 14 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.004 -0.321 25342 11225 1 14 . 1 1 62 62 LYS H H 62 7.242 7.242 7.685 -0.443 25342 11226 1 14 . 1 1 63 63 ASP N N 63 119.888 119.888 121.766 -1.878 25342 11227 1 14 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.285 0.131 25342 11228 1 14 . 1 1 63 63 ASP C C 63 174.476 174.476 175.849 -1.373 25342 11229 1 14 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.725 -2.264 25342 11230 1 14 . 1 1 63 63 ASP CB C 63 38.515 38.515 40.734 -2.219 25342 11231 1 14 . 1 1 63 63 ASP H H 63 8.230 8.230 8.401 -0.171 25342 11232 1 14 . 1 1 64 64 PHE N N 64 119.789 119.789 114.743 5.046 25342 11233 1 14 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.654 -0.838 25342 11234 1 14 . 1 1 64 64 PHE CA C 64 56.250 56.250 55.275 0.975 25342 11235 1 14 . 1 1 64 64 PHE CB C 64 35.034 35.034 37.984 -2.950 25342 11236 1 14 . 1 1 64 64 PHE H H 64 8.428 8.428 7.545 0.883 25342 11237 1 14 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.620 -0.307 25342 11238 1 14 . 1 1 65 65 PRO C C 65 173.975 173.975 176.358 -2.383 25342 11239 1 14 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.511 -2.455 25342 11240 1 14 . 1 1 65 65 PRO CB C 65 29.520 29.520 33.116 -3.596 25342 11241 1 14 . 1 1 66 66 GLU N N 66 121.326 121.326 120.630 0.696 25342 11242 1 14 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.552 -0.319 25342 11243 1 14 . 1 1 66 66 GLU C C 66 173.978 173.978 175.600 -1.622 25342 11244 1 14 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.147 -2.616 25342 11245 1 14 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.022 -3.322 25342 11246 1 14 . 1 1 66 66 GLU H H 66 8.225 8.225 8.720 -0.495 25342 11247 1 14 . 1 1 67 67 ILE N N 67 113.897 113.897 115.206 -1.309 25342 11248 1 14 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.892 0.277 25342 11249 1 14 . 1 1 67 67 ILE C C 67 172.791 172.791 174.639 -1.848 25342 11250 1 14 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.683 -2.408 25342 11251 1 14 . 1 1 67 67 ILE CB C 67 39.016 39.016 42.072 -3.057 25342 11252 1 14 . 1 1 67 67 ILE H H 67 8.366 8.366 8.070 0.296 25342 11253 1 14 . 1 1 68 68 GLN N N 68 121.654 121.654 123.259 -1.605 25342 11254 1 14 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.803 -0.284 25342 11255 1 14 . 1 1 68 68 GLN C C 68 171.562 171.562 174.087 -2.525 25342 11256 1 14 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.774 -2.461 25342 11257 1 14 . 1 1 68 68 GLN CB C 68 26.785 26.785 31.058 -4.273 25342 11258 1 14 . 1 1 68 68 GLN H H 68 8.763 8.763 8.520 0.243 25342 11259 1 14 . 1 1 69 69 LEU N N 69 125.289 125.289 124.190 1.099 25342 11260 1 14 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.650 -0.131 25342 11261 1 14 . 1 1 69 69 LEU C C 69 172.567 172.567 175.574 -3.007 25342 11262 1 14 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.980 -3.183 25342 11263 1 14 . 1 1 69 69 LEU CB C 69 42.742 42.742 44.853 -2.111 25342 11264 1 14 . 1 1 69 69 LEU H H 69 7.996 7.996 8.389 -0.393 25342 11265 1 14 . 1 1 70 70 ASP N N 70 123.170 123.170 122.106 1.064 25342 11266 1 14 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.517 -0.111 25342 11267 1 14 . 1 1 70 70 ASP C C 70 171.978 171.978 175.284 -3.306 25342 11268 1 14 . 1 1 70 70 ASP CA C 70 51.682 51.682 55.373 -3.691 25342 11269 1 14 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.279 -2.550 25342 11270 1 14 . 1 1 70 70 ASP H H 70 8.278 8.278 8.512 -0.234 25342 11271 1 14 . 1 1 71 71 ASN N N 71 117.524 117.524 118.047 -0.523 25342 11272 1 14 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.736 -0.409 25342 11273 1 14 . 1 1 71 71 ASN C C 71 171.825 171.825 174.537 -2.712 25342 11274 1 14 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.016 -1.359 25342 11275 1 14 . 1 1 71 71 ASN CB C 71 35.230 35.230 39.023 -3.793 25342 11276 1 14 . 1 1 71 71 ASN H H 71 8.372 8.372 8.386 -0.014 25342 11277 1 14 . 1 1 72 72 ILE N N 72 124.515 124.515 124.932 -0.417 25342 11278 1 14 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.055 -0.126 25342 11279 1 14 . 1 1 72 72 ILE C C 72 171.607 171.607 174.605 -2.998 25342 11280 1 14 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.326 -3.037 25342 11281 1 14 . 1 1 72 72 ILE CB C 72 38.760 38.760 40.993 -2.233 25342 11282 1 14 . 1 1 72 72 ILE H H 72 7.653 7.653 8.178 -0.525 25342 11283 1 14 . 1 1 73 73 ASP N N 73 125.182 125.182 127.915 -2.733 25342 11284 1 14 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.532 0.096 25342 11285 1 14 . 1 1 73 73 ASP C C 73 173.980 173.980 176.170 -2.190 25342 11286 1 14 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.300 -5.086 25342 11287 1 14 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.578 -3.676 25342 11288 1 14 . 1 1 73 73 ASP H H 73 8.382 8.382 8.614 -0.232 25342 11289 1 14 . 1 1 74 74 TYR N N 74 123.092 123.092 123.871 -0.779 25342 11290 1 14 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.396 -0.531 25342 11291 1 14 . 1 1 74 74 TYR C C 74 173.582 173.582 175.618 -2.036 25342 11292 1 14 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.632 1.854 25342 11293 1 14 . 1 1 74 74 TYR CB C 74 34.808 34.808 37.652 -2.844 25342 11294 1 14 . 1 1 74 74 TYR H H 74 7.348 7.348 8.086 -0.738 25342 11295 1 14 . 1 1 75 75 ASN N N 75 109.447 109.447 115.544 -6.097 25342 11296 1 14 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.992 -0.067 25342 11297 1 14 . 1 1 75 75 ASN C C 75 172.570 172.570 175.717 -3.147 25342 11298 1 14 . 1 1 75 75 ASN CA C 75 52.618 52.618 53.281 -0.663 25342 11299 1 14 . 1 1 75 75 ASN CB C 75 35.534 35.534 39.301 -3.767 25342 11300 1 14 . 1 1 75 75 ASN H H 75 8.040 8.040 8.083 -0.043 25342 11301 1 14 . 1 1 76 76 ASN N N 76 117.411 117.411 117.356 0.055 25342 11302 1 14 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.766 -0.312 25342 11303 1 14 . 1 1 76 76 ASN C C 76 171.155 171.155 173.944 -2.789 25342 11304 1 14 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.453 -2.519 25342 11305 1 14 . 1 1 76 76 ASN CB C 76 35.658 35.658 39.172 -3.514 25342 11306 1 14 . 1 1 76 76 ASN H H 76 7.750 7.750 8.143 -0.393 25342 11307 1 14 . 1 1 77 77 TYR N N 77 116.878 116.878 118.034 -1.156 25342 11308 1 14 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.676 -0.322 25342 11309 1 14 . 1 1 77 77 TYR C C 77 172.224 172.224 175.302 -3.078 25342 11310 1 14 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.198 -1.958 25342 11311 1 14 . 1 1 77 77 TYR CB C 77 37.113 37.113 41.018 -3.905 25342 11312 1 14 . 1 1 77 77 TYR H H 77 7.789 7.789 7.533 0.256 25342 11313 1 14 . 1 1 78 78 ASP N N 78 121.352 121.352 123.774 -2.422 25342 11314 1 14 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.553 0.244 25342 11315 1 14 . 1 1 78 78 ASP C C 78 172.623 172.623 176.133 -3.510 25342 11316 1 14 . 1 1 78 78 ASP CA C 78 53.190 53.190 57.586 -4.396 25342 11317 1 14 . 1 1 78 78 ASP CB C 78 41.035 41.035 41.569 -0.534 25342 11318 1 14 . 1 1 78 78 ASP H H 78 9.036 9.036 8.885 0.151 25342 11319 1 14 . 1 1 79 79 LEU N N 79 123.073 123.073 117.285 5.788 25342 11320 1 14 . 1 1 79 79 LEU HA H 79 5.108 5.108 4.949 0.159 25342 11321 1 14 . 1 1 79 79 LEU C C 79 170.730 170.730 174.640 -3.910 25342 11322 1 14 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.891 -2.634 25342 11323 1 14 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.173 -3.889 25342 11324 1 14 . 1 1 79 79 LEU H H 79 7.877 7.877 8.011 -0.134 25342 11325 1 14 . 1 1 80 80 ILE N N 80 126.348 126.348 120.427 5.921 25342 11326 1 14 . 1 1 80 80 ILE HA H 80 5.069 5.069 5.074 -0.005 25342 11327 1 14 . 1 1 80 80 ILE C C 80 171.584 171.584 174.403 -2.819 25342 11328 1 14 . 1 1 80 80 ILE CA C 80 57.415 57.415 59.730 -2.315 25342 11329 1 14 . 1 1 80 80 ILE CB C 80 37.998 37.998 41.804 -3.806 25342 11330 1 14 . 1 1 80 80 ILE H H 80 8.704 8.704 8.747 -0.043 25342 11331 1 14 . 1 1 81 81 LEU N N 81 126.303 126.303 123.501 2.802 25342 11332 1 14 . 1 1 81 81 LEU HA H 81 5.123 5.123 5.298 -0.175 25342 11333 1 14 . 1 1 81 81 LEU C C 81 172.779 172.779 175.239 -2.460 25342 11334 1 14 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.984 -4.475 25342 11335 1 14 . 1 1 81 81 LEU CB C 81 41.715 41.715 46.597 -4.882 25342 11336 1 14 . 1 1 81 81 LEU H H 81 9.202 9.202 9.015 0.187 25342 11337 1 14 . 1 1 82 82 ILE N N 82 120.931 120.931 119.749 1.182 25342 11338 1 14 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.703 0.144 25342 11339 1 14 . 1 1 82 82 ILE C C 82 172.796 172.796 173.932 -1.136 25342 11340 1 14 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.913 -3.032 25342 11341 1 14 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.947 -5.150 25342 11342 1 14 . 1 1 82 82 ILE H H 82 8.846 8.846 8.812 0.034 25342 11343 1 14 . 1 1 83 83 GLY N N 83 120.905 120.905 110.371 10.534 25342 11344 1 14 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.691 -2.135 25342 11345 1 14 . 1 1 83 83 GLY H H 83 9.558 9.558 7.662 1.896 25342 11346 1 14 . 1 1 84 84 SER N N 84 116.601 116.601 116.442 0.159 25342 11347 1 14 . 1 1 84 84 SER HA H 84 5.476 5.476 4.784 0.692 25342 11348 1 14 . 1 1 84 84 SER CA C 84 51.324 51.324 55.403 -4.079 25342 11349 1 14 . 1 1 84 84 SER CB C 84 64.271 64.271 65.436 -1.165 25342 11350 1 14 . 1 1 84 84 SER H H 84 7.533 7.533 7.390 0.143 25342 11351 1 14 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.332 0.831 25342 11352 1 14 . 1 1 85 85 PRO C C 85 175.590 175.590 176.083 -0.493 25342 11353 1 14 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.310 -3.427 25342 11354 1 14 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.194 -1.720 25342 11355 1 14 . 1 1 86 86 VAL N N 86 116.295 116.295 117.375 -1.080 25342 11356 1 14 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.257 -0.436 25342 11357 1 14 . 1 1 86 86 VAL C C 86 172.692 172.692 175.346 -2.654 25342 11358 1 14 . 1 1 86 86 VAL CA C 86 59.812 59.812 60.794 -0.982 25342 11359 1 14 . 1 1 86 86 VAL CB C 86 30.083 30.083 34.068 -3.985 25342 11360 1 14 . 1 1 86 86 VAL H H 86 7.246 7.246 7.642 -0.396 25342 11361 1 14 . 1 1 87 87 TRP N N 87 131.042 131.042 125.666 5.376 25342 11362 1 14 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.748 -0.437 25342 11363 1 14 . 1 1 87 87 TRP C C 87 173.323 173.323 177.906 -4.583 25342 11364 1 14 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.484 -4.597 25342 11365 1 14 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.100 -3.790 25342 11366 1 14 . 1 1 87 87 TRP H H 87 9.555 9.555 8.162 1.393 25342 11367 1 14 . 1 1 88 88 SER N N 88 122.660 122.660 117.189 5.471 25342 11368 1 14 . 1 1 88 88 SER HA H 88 4.582 4.582 4.282 0.300 25342 11369 1 14 . 1 1 88 88 SER C C 88 172.096 172.096 174.818 -2.722 25342 11370 1 14 . 1 1 88 88 SER CA C 88 55.391 55.391 59.761 -4.370 25342 11371 1 14 . 1 1 88 88 SER CB C 88 57.813 57.813 62.770 -4.957 25342 11372 1 14 . 1 1 88 88 SER H H 88 10.257 10.257 8.673 1.584 25342 11373 1 14 . 1 1 89 89 GLY N N 89 128.381 128.381 106.827 21.554 25342 11374 1 14 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.353 -2.724 25342 11375 1 14 . 1 1 89 89 GLY H H 89 6.372 6.372 8.068 -1.696 25342 11376 1 14 . 1 1 90 90 TYR N N 90 120.345 120.345 122.222 -1.877 25342 11377 1 14 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.337 -1.148 25342 11378 1 14 . 1 1 90 90 TYR CA C 90 53.549 53.549 55.004 -1.455 25342 11379 1 14 . 1 1 90 90 TYR CB C 90 37.195 37.195 40.757 -3.562 25342 11380 1 14 . 1 1 90 90 TYR H H 90 8.113 8.113 7.917 0.196 25342 11381 1 14 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.470 0.364 25342 11382 1 14 . 1 1 91 91 PRO C C 91 170.911 170.911 176.643 -5.732 25342 11383 1 14 . 1 1 91 91 PRO CA C 91 58.835 58.835 61.957 -3.122 25342 11384 1 14 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.551 -6.481 25342 11385 1 14 . 1 1 92 92 ALA N N 92 120.629 120.629 122.748 -2.119 25342 11386 1 14 . 1 1 92 92 ALA HA H 92 3.619 3.619 4.000 -0.381 25342 11387 1 14 . 1 1 92 92 ALA C C 92 176.782 176.782 176.320 0.462 25342 11388 1 14 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.322 -1.905 25342 11389 1 14 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.293 -0.777 25342 11390 1 14 . 1 1 92 92 ALA H H 92 7.554 7.554 8.335 -0.781 25342 11391 1 14 . 1 1 93 93 THR N N 93 112.558 112.558 109.058 3.500 25342 11392 1 14 . 1 1 93 93 THR CB C 93 64.173 64.173 67.193 -3.020 25342 11393 1 14 . 1 1 93 93 THR H H 93 6.730 6.730 7.725 -0.995 25342 11394 1 14 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.379 -0.520 25342 11395 1 14 . 1 1 94 94 PRO C C 94 173.309 173.309 177.456 -4.147 25342 11396 1 14 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.792 -1.729 25342 11397 1 14 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.926 -2.647 25342 11398 1 14 . 1 1 95 95 ILE N N 95 111.014 111.014 117.819 -6.805 25342 11399 1 14 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.083 -0.478 25342 11400 1 14 . 1 1 95 95 ILE C C 95 174.302 174.302 177.979 -3.677 25342 11401 1 14 . 1 1 95 95 ILE CA C 95 57.181 57.181 61.245 -4.064 25342 11402 1 14 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.590 -4.807 25342 11403 1 14 . 1 1 95 95 ILE H H 95 7.995 7.995 8.022 -0.027 25342 11404 1 14 . 1 1 96 96 LYS N N 96 123.208 123.208 122.158 1.050 25342 11405 1 14 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.045 -0.953 25342 11406 1 14 . 1 1 96 96 LYS C C 96 174.451 174.451 178.486 -4.035 25342 11407 1 14 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.975 -2.934 25342 11408 1 14 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.761 -3.014 25342 11409 1 14 . 1 1 96 96 LYS H H 96 6.928 6.928 8.423 -1.495 25342 11410 1 14 . 1 1 97 97 THR N N 97 113.320 113.320 114.040 -0.720 25342 11411 1 14 . 1 1 97 97 THR HA H 97 3.436 3.436 3.804 -0.368 25342 11412 1 14 . 1 1 97 97 THR C C 97 173.221 173.221 176.347 -3.126 25342 11413 1 14 . 1 1 97 97 THR CA C 97 62.710 62.710 64.788 -2.078 25342 11414 1 14 . 1 1 97 97 THR CB C 97 65.562 65.562 68.687 -3.125 25342 11415 1 14 . 1 1 97 97 THR H H 97 6.325 6.325 7.965 -1.640 25342 11416 1 14 . 1 1 98 98 LEU N N 98 120.963 120.963 123.258 -2.295 25342 11417 1 14 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.194 -0.569 25342 11418 1 14 . 1 1 98 98 LEU C C 98 174.713 174.713 177.247 -2.534 25342 11419 1 14 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.454 -1.940 25342 11420 1 14 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.690 -1.962 25342 11421 1 14 . 1 1 98 98 LEU H H 98 7.536 7.536 7.409 0.127 25342 11422 1 14 . 1 1 99 99 LEU N N 99 118.859 118.859 119.471 -0.612 25342 11423 1 14 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.880 -0.208 25342 11424 1 14 . 1 1 99 99 LEU C C 99 177.458 177.458 178.362 -0.904 25342 11425 1 14 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.377 -3.232 25342 11426 1 14 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.072 -2.215 25342 11427 1 14 . 1 1 99 99 LEU H H 99 8.179 8.179 8.407 -0.228 25342 11428 1 14 . 1 1 100 100 ASP N N 100 118.703 118.703 118.059 0.644 25342 11429 1 14 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.220 0.001 25342 11430 1 14 . 1 1 100 100 ASP C C 100 176.472 176.472 178.665 -2.193 25342 11431 1 14 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.441 -3.134 25342 11432 1 14 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.647 -3.289 25342 11433 1 14 . 1 1 100 100 ASP H H 100 7.867 7.867 8.016 -0.149 25342 11434 1 14 . 1 1 101 101 GLN N N 101 117.829 117.829 118.484 -0.655 25342 11435 1 14 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.194 0.006 25342 11436 1 14 . 1 1 101 101 GLN C C 101 174.508 174.508 178.477 -3.969 25342 11437 1 14 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.055 -3.367 25342 11438 1 14 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.242 -3.645 25342 11439 1 14 . 1 1 101 101 GLN H H 101 7.597 7.597 7.605 -0.008 25342 11440 1 14 . 1 1 102 102 MET N N 102 118.406 118.406 118.238 0.168 25342 11441 1 14 . 1 1 102 102 MET HA H 102 3.864 3.864 4.161 -0.297 25342 11442 1 14 . 1 1 102 102 MET C C 102 172.820 172.820 177.525 -4.705 25342 11443 1 14 . 1 1 102 102 MET CA C 102 53.298 53.298 58.898 -5.600 25342 11444 1 14 . 1 1 102 102 MET CB C 102 31.207 31.207 31.806 -0.599 25342 11445 1 14 . 1 1 102 102 MET H H 102 7.434 7.434 8.226 -0.792 25342 11446 1 14 . 1 1 103 103 LYS N N 103 115.889 115.889 119.889 -4.000 25342 11447 1 14 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.985 -0.066 25342 11448 1 14 . 1 1 103 103 LYS C C 103 173.938 173.938 177.313 -3.375 25342 11449 1 14 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.157 -2.720 25342 11450 1 14 . 1 1 103 103 LYS CB C 103 29.263 29.263 30.929 -1.666 25342 11451 1 14 . 1 1 103 103 LYS H H 103 6.881 6.881 7.676 -0.795 25342 11452 1 14 . 1 1 104 104 ASN N N 104 114.951 114.951 115.849 -0.898 25342 11453 1 14 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.654 0.077 25342 11454 1 14 . 1 1 104 104 ASN C C 104 172.617 172.617 175.269 -2.652 25342 11455 1 14 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.489 -3.224 25342 11456 1 14 . 1 1 104 104 ASN CB C 104 35.783 35.783 39.282 -3.499 25342 11457 1 14 . 1 1 104 104 ASN H H 104 8.493 8.493 8.171 0.322 25342 11458 1 14 . 1 1 105 105 TYR N N 105 122.680 122.680 121.417 1.263 25342 11459 1 14 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.412 0.150 25342 11460 1 14 . 1 1 105 105 TYR CA C 105 55.433 55.433 58.801 -3.368 25342 11461 1 14 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.273 -3.441 25342 11462 1 14 . 1 1 105 105 TYR H H 105 8.217 8.217 8.071 0.146 25342 11463 1 14 . 1 1 106 106 ARG N N 106 128.872 128.872 124.096 4.776 25342 11464 1 14 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.217 0.048 25342 11465 1 14 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.907 -1.925 25342 11466 1 14 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.065 -3.935 25342 11467 1 14 . 1 1 106 106 ARG H H 106 8.801 8.801 8.079 0.722 25342 11468 1 14 . 1 1 107 107 GLY CA C 107 42.401 42.401 45.631 -3.230 25342 11469 1 14 . 1 1 108 108 GLU N N 108 117.000 117.000 121.737 -4.737 25342 11470 1 14 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.988 -0.362 25342 11471 1 14 . 1 1 108 108 GLU C C 108 174.125 174.125 174.993 -0.868 25342 11472 1 14 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.793 -2.005 25342 11473 1 14 . 1 1 108 108 GLU CB C 108 30.440 30.440 34.265 -3.825 25342 11474 1 14 . 1 1 108 108 GLU H H 108 7.514 7.514 8.575 -1.061 25342 11475 1 14 . 1 1 109 109 VAL N N 109 123.398 123.398 122.562 0.836 25342 11476 1 14 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.039 0.298 25342 11477 1 14 . 1 1 109 109 VAL C C 109 170.606 170.606 173.957 -3.351 25342 11478 1 14 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.788 -3.509 25342 11479 1 14 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.887 -3.230 25342 11480 1 14 . 1 1 109 109 VAL H H 109 8.942 8.942 9.043 -0.101 25342 11481 1 14 . 1 1 110 110 ALA N N 110 127.905 127.905 129.217 -1.312 25342 11482 1 14 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.010 -0.383 25342 11483 1 14 . 1 1 110 110 ALA C C 110 173.195 173.195 175.211 -2.016 25342 11484 1 14 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.181 -1.835 25342 11485 1 14 . 1 1 110 110 ALA CB C 110 18.325 18.325 21.809 -3.484 25342 11486 1 14 . 1 1 110 110 ALA H H 110 8.776 8.776 8.454 0.322 25342 11487 1 14 . 1 1 111 111 SER N N 111 110.523 110.523 117.634 -7.111 25342 11488 1 14 . 1 1 111 111 SER HA H 111 5.562 5.562 5.173 0.389 25342 11489 1 14 . 1 1 111 111 SER C C 111 170.719 170.719 173.872 -3.153 25342 11490 1 14 . 1 1 111 111 SER CA C 111 51.314 51.314 56.192 -4.878 25342 11491 1 14 . 1 1 111 111 SER CB C 111 61.907 61.907 63.342 -1.435 25342 11492 1 14 . 1 1 111 111 SER H H 111 7.480 7.480 8.166 -0.686 25342 11493 1 14 . 1 1 112 112 PHE N N 112 125.567 125.567 123.522 2.045 25342 11494 1 14 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.482 0.874 25342 11495 1 14 . 1 1 112 112 PHE C C 112 169.536 169.536 173.802 -4.266 25342 11496 1 14 . 1 1 112 112 PHE CA C 112 50.371 50.371 56.257 -5.886 25342 11497 1 14 . 1 1 112 112 PHE CB C 112 39.788 39.788 39.586 0.202 25342 11498 1 14 . 1 1 112 112 PHE H H 112 7.848 7.848 8.264 -0.416 25342 11499 1 14 . 1 1 113 113 PHE N N 113 115.065 115.065 118.309 -3.244 25342 11500 1 14 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.529 0.575 25342 11501 1 14 . 1 1 113 113 PHE C C 113 173.006 173.006 174.953 -1.947 25342 11502 1 14 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.108 -5.846 25342 11503 1 14 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.831 -5.082 25342 11504 1 14 . 1 1 113 113 PHE H H 113 7.361 7.361 8.462 -1.101 25342 11505 1 14 . 1 1 114 114 THR N N 114 108.014 108.014 110.035 -2.021 25342 11506 1 14 . 1 1 114 114 THR HA H 114 4.999 4.999 4.724 0.275 25342 11507 1 14 . 1 1 114 114 THR C C 114 169.874 169.874 172.743 -2.869 25342 11508 1 14 . 1 1 114 114 THR CA C 114 56.500 56.500 61.339 -4.839 25342 11509 1 14 . 1 1 114 114 THR CB C 114 68.809 68.809 71.248 -2.439 25342 11510 1 14 . 1 1 114 114 THR H H 114 7.867 7.867 8.280 -0.413 25342 11511 1 14 . 1 1 115 115 SER N N 115 115.049 115.049 117.885 -2.836 25342 11512 1 14 . 1 1 115 115 SER HA H 115 5.613 5.613 4.706 0.907 25342 11513 1 14 . 1 1 115 115 SER C C 115 171.247 171.247 175.268 -4.021 25342 11514 1 14 . 1 1 115 115 SER CA C 115 54.830 54.830 57.339 -2.509 25342 11515 1 14 . 1 1 115 115 SER CB C 115 63.992 63.992 65.473 -1.481 25342 11516 1 14 . 1 1 115 115 SER H H 115 8.970 8.970 8.463 0.507 25342 11517 1 14 . 1 1 116 116 ALA N N 116 122.671 122.671 125.349 -2.678 25342 11518 1 14 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.440 0.545 25342 11519 1 14 . 1 1 116 116 ALA C C 116 176.180 176.180 177.660 -1.480 25342 11520 1 14 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.932 -2.732 25342 11521 1 14 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.981 -1.986 25342 11522 1 14 . 1 1 116 116 ALA H H 116 8.963 8.963 8.775 0.188 25342 11523 1 14 . 1 1 117 117 GLY N N 117 107.387 107.387 108.679 -1.292 25342 11524 1 14 . 1 1 117 117 GLY C C 117 172.528 172.528 173.816 -1.288 25342 11525 1 14 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.227 -1.495 25342 11526 1 14 . 1 1 117 117 GLY H H 117 9.340 9.340 7.981 1.359 25342 11527 1 14 . 1 1 118 118 THR N N 118 113.481 113.481 113.224 0.257 25342 11528 1 14 . 1 1 118 118 THR HA H 118 4.651 4.651 4.496 0.155 25342 11529 1 14 . 1 1 118 118 THR C C 118 172.067 172.067 174.656 -2.589 25342 11530 1 14 . 1 1 118 118 THR CA C 118 57.357 57.357 60.707 -3.350 25342 11531 1 14 . 1 1 118 118 THR CB C 118 69.475 69.475 71.299 -1.824 25342 11532 1 14 . 1 1 118 118 THR H H 118 9.373 9.373 7.471 1.902 25342 11533 1 14 . 1 1 119 119 ASN N N 119 113.202 113.202 118.756 -5.554 25342 11534 1 14 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.364 0.254 25342 11535 1 14 . 1 1 119 119 ASN C C 119 173.114 173.114 176.462 -3.348 25342 11536 1 14 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.059 -2.375 25342 11537 1 14 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.709 -3.979 25342 11538 1 14 . 1 1 119 119 ASN H H 119 8.908 8.908 9.041 -0.133 25342 11539 1 14 . 1 1 120 120 HIS N N 120 117.315 117.315 117.067 0.248 25342 11540 1 14 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.413 -0.627 25342 11541 1 14 . 1 1 120 120 HIS C C 120 174.381 174.381 176.538 -2.157 25342 11542 1 14 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.798 -4.282 25342 11543 1 14 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.821 -3.317 25342 11544 1 14 . 1 1 120 120 HIS H H 120 8.074 8.074 8.797 -0.723 25342 11545 1 14 . 1 1 121 121 LYS N N 121 118.678 118.678 118.150 0.528 25342 11546 1 14 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.437 0.397 25342 11547 1 14 . 1 1 121 121 LYS C C 121 176.564 176.564 178.242 -1.678 25342 11548 1 14 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.867 -1.572 25342 11549 1 14 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.769 -2.827 25342 11550 1 14 . 1 1 121 121 LYS H H 121 8.336 8.336 7.762 0.574 25342 11551 1 14 . 1 1 122 122 ALA N N 122 122.146 122.146 121.550 0.596 25342 11552 1 14 . 1 1 122 122 ALA HA H 122 3.695 3.695 3.782 -0.087 25342 11553 1 14 . 1 1 122 122 ALA C C 122 175.163 175.163 179.231 -4.068 25342 11554 1 14 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.563 -2.871 25342 11555 1 14 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.968 -2.250 25342 11556 1 14 . 1 1 122 122 ALA H H 122 7.584 7.584 7.263 0.321 25342 11557 1 14 . 1 1 123 123 TYR N N 123 119.730 119.730 118.509 1.221 25342 11558 1 14 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.099 -0.946 25342 11559 1 14 . 1 1 123 123 TYR C C 123 174.340 174.340 177.590 -3.250 25342 11560 1 14 . 1 1 123 123 TYR CA C 123 60.398 60.398 59.358 1.040 25342 11561 1 14 . 1 1 123 123 TYR CB C 123 34.663 34.663 36.794 -2.131 25342 11562 1 14 . 1 1 123 123 TYR H H 123 7.317 7.317 7.934 -0.617 25342 11563 1 14 . 1 1 124 124 VAL N N 124 118.649 118.649 118.757 -0.108 25342 11564 1 14 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.279 -0.077 25342 11565 1 14 . 1 1 124 124 VAL C C 124 175.603 175.603 177.987 -2.384 25342 11566 1 14 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.339 -1.659 25342 11567 1 14 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.791 -1.502 25342 11568 1 14 . 1 1 124 124 VAL H H 124 7.799 7.799 6.695 1.104 25342 11569 1 14 . 1 1 125 125 SER N N 125 114.475 114.475 116.257 -1.782 25342 11570 1 14 . 1 1 125 125 SER HA H 125 4.032 4.032 4.136 -0.104 25342 11571 1 14 . 1 1 125 125 SER C C 125 174.849 174.849 176.771 -1.922 25342 11572 1 14 . 1 1 125 125 SER CA C 125 59.002 59.002 62.221 -3.219 25342 11573 1 14 . 1 1 125 125 SER CB C 125 59.613 59.613 63.001 -3.388 25342 11574 1 14 . 1 1 125 125 SER H H 125 7.766 7.766 7.435 0.331 25342 11575 1 14 . 1 1 126 126 HIS N N 126 119.326 119.326 119.797 -0.471 25342 11576 1 14 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.443 -0.316 25342 11577 1 14 . 1 1 126 126 HIS C C 126 172.865 172.865 176.803 -3.938 25342 11578 1 14 . 1 1 126 126 HIS CA C 126 55.706 55.706 57.913 -2.207 25342 11579 1 14 . 1 1 126 126 HIS CB C 126 25.993 25.993 29.650 -3.657 25342 11580 1 14 . 1 1 126 126 HIS H H 126 8.569 8.569 8.272 0.297 25342 11581 1 14 . 1 1 127 127 PHE N N 127 121.044 121.044 119.692 1.352 25342 11582 1 14 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.334 -1.160 25342 11583 1 14 . 1 1 127 127 PHE C C 127 173.378 173.378 176.631 -3.253 25342 11584 1 14 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.152 0.715 25342 11585 1 14 . 1 1 127 127 PHE CB C 127 36.054 36.054 40.288 -4.234 25342 11586 1 14 . 1 1 127 127 PHE H H 127 9.139 9.139 8.285 0.854 25342 11587 1 14 . 1 1 128 128 ASN N N 128 114.893 114.893 118.417 -3.524 25342 11588 1 14 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.039 0.001 25342 11589 1 14 . 1 1 128 128 ASN C C 128 175.230 175.230 177.958 -2.728 25342 11590 1 14 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.406 -2.106 25342 11591 1 14 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.294 -2.123 25342 11592 1 14 . 1 1 128 128 ASN H H 128 7.774 7.774 8.074 -0.300 25342 11593 1 14 . 1 1 129 129 GLU N N 129 119.804 119.804 118.381 1.423 25342 11594 1 14 . 1 1 129 129 GLU HA H 129 4.040 4.040 4.136 -0.096 25342 11595 1 14 . 1 1 129 129 GLU C C 129 177.052 177.052 177.263 -0.211 25342 11596 1 14 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.341 -1.611 25342 11597 1 14 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.871 -2.675 25342 11598 1 14 . 1 1 129 129 GLU H H 129 7.577 7.577 8.564 -0.987 25342 11599 1 14 . 1 1 130 130 TRP N N 130 120.979 120.979 118.694 2.285 25342 11600 1 14 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.800 -0.343 25342 11601 1 14 . 1 1 130 130 TRP C C 130 174.329 174.329 174.228 0.101 25342 11602 1 14 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.324 -1.636 25342 11603 1 14 . 1 1 130 130 TRP CB C 130 26.991 26.991 30.438 -3.447 25342 11604 1 14 . 1 1 130 130 TRP H H 130 8.225 8.225 7.769 0.456 25342 11605 1 14 . 1 1 131 131 ALA N N 131 120.450 120.450 119.307 1.143 25342 11606 1 14 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.402 -0.466 25342 11607 1 14 . 1 1 131 131 ALA C C 131 172.487 172.487 175.739 -3.252 25342 11608 1 14 . 1 1 131 131 ALA CA C 131 48.434 48.434 52.239 -3.805 25342 11609 1 14 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.194 -2.906 25342 11610 1 14 . 1 1 131 131 ALA H H 131 8.081 8.081 7.127 0.954 25342 11611 1 14 . 1 1 132 132 ASP N N 132 117.813 117.813 120.553 -2.740 25342 11612 1 14 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.638 -0.430 25342 11613 1 14 . 1 1 132 132 ASP C C 132 173.804 173.804 177.010 -3.206 25342 11614 1 14 . 1 1 132 132 ASP CA C 132 54.181 54.181 54.239 -0.058 25342 11615 1 14 . 1 1 132 132 ASP CB C 132 39.321 39.321 39.880 -0.560 25342 11616 1 14 . 1 1 132 132 ASP H H 132 6.772 6.772 8.239 -1.467 25342 11617 1 14 . 1 1 133 133 GLY N N 133 115.052 115.052 107.837 7.215 25342 11618 1 14 . 1 1 133 133 GLY C C 133 172.078 172.078 174.187 -2.109 25342 11619 1 14 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.520 -3.100 25342 11620 1 14 . 1 1 133 133 GLY H H 133 8.626 8.626 7.995 0.631 25342 11621 1 14 . 1 1 134 134 LEU N N 134 120.063 120.063 120.439 -0.376 25342 11622 1 14 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.534 -0.062 25342 11623 1 14 . 1 1 134 134 LEU C C 134 174.079 174.079 176.361 -2.282 25342 11624 1 14 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.556 -2.592 25342 11625 1 14 . 1 1 134 134 LEU CB C 134 40.370 40.370 43.598 -3.228 25342 11626 1 14 . 1 1 134 134 LEU H H 134 8.094 8.094 7.671 0.423 25342 11627 1 14 . 1 1 135 135 ASN N N 135 119.292 119.292 121.366 -2.074 25342 11628 1 14 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.576 0.047 25342 11629 1 14 . 1 1 135 135 ASN C C 135 170.527 170.527 174.951 -4.424 25342 11630 1 14 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.964 -3.962 25342 11631 1 14 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.551 -4.991 25342 11632 1 14 . 1 1 135 135 ASN H H 135 8.513 8.513 8.531 -0.018 25342 11633 1 14 . 1 1 136 136 VAL N N 136 125.412 125.412 126.134 -0.722 25342 11634 1 14 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.269 0.337 25342 11635 1 14 . 1 1 136 136 VAL C C 136 175.420 175.420 177.089 -1.669 25342 11636 1 14 . 1 1 136 136 VAL CA C 136 58.382 58.382 63.691 -5.309 25342 11637 1 14 . 1 1 136 136 VAL CB C 136 29.247 29.247 31.712 -2.465 25342 11638 1 14 . 1 1 136 136 VAL H H 136 7.648 7.648 8.468 -0.820 25342 11639 1 14 . 1 1 137 137 ILE N N 137 121.881 121.881 122.472 -0.591 25342 11640 1 14 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.556 -0.123 25342 11641 1 14 . 1 1 137 137 ILE C C 137 173.906 173.906 175.296 -1.390 25342 11642 1 14 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.623 -1.645 25342 11643 1 14 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.206 -2.010 25342 11644 1 14 . 1 1 137 137 ILE H H 137 9.139 9.139 8.821 0.318 25342 11645 1 14 . 1 1 138 138 GLY N N 138 108.226 108.226 107.548 0.678 25342 11646 1 14 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.645 -2.255 25342 11647 1 14 . 1 1 138 138 GLY H H 138 6.645 6.645 7.333 -0.688 25342 11648 1 14 . 1 1 139 139 VAL N N 139 119.408 119.408 120.332 -0.924 25342 11649 1 14 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.067 0.290 25342 11650 1 14 . 1 1 139 139 VAL C C 139 172.327 172.327 174.051 -1.724 25342 11651 1 14 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.765 -2.498 25342 11652 1 14 . 1 1 139 139 VAL CB C 139 32.743 32.743 34.146 -1.403 25342 11653 1 14 . 1 1 139 139 VAL H H 139 8.092 8.092 8.637 -0.545 25342 11654 1 14 . 1 1 140 140 ALA N N 140 127.415 127.415 130.607 -3.192 25342 11655 1 14 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.148 -0.703 25342 11656 1 14 . 1 1 140 140 ALA C C 140 170.718 170.718 176.040 -5.322 25342 11657 1 14 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.853 -1.953 25342 11658 1 14 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.357 -1.298 25342 11659 1 14 . 1 1 140 140 ALA H H 140 9.093 9.093 8.302 0.791 25342 11660 1 14 . 1 1 141 141 ARG N N 141 119.287 119.287 119.590 -0.303 25342 11661 1 14 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.452 -2.965 25342 11662 1 14 . 1 1 141 141 ARG C C 141 173.375 173.375 175.971 -2.596 25342 11663 1 14 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.821 -2.937 25342 11664 1 14 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.395 -4.711 25342 11665 1 14 . 1 1 141 141 ARG H H 141 7.620 7.620 8.582 -0.962 25342 11666 1 14 . 1 1 142 142 ASP N N 142 125.999 125.999 121.816 4.183 25342 11667 1 14 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.281 -0.557 25342 11668 1 14 . 1 1 142 142 ASP C C 142 169.292 169.292 176.028 -6.736 25342 11669 1 14 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.458 -3.120 25342 11670 1 14 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.469 -3.792 25342 11671 1 14 . 1 1 142 142 ASP H H 142 9.482 9.482 9.154 0.328 25342 11672 1 14 . 1 1 143 143 ASP N N 143 119.293 119.293 119.580 -0.287 25342 11673 1 14 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.465 -0.159 25342 11674 1 14 . 1 1 143 143 ASP C C 143 175.686 175.686 176.817 -1.131 25342 11675 1 14 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.154 -5.250 25342 11676 1 14 . 1 1 143 143 ASP CB C 143 36.312 36.312 39.912 -3.600 25342 11677 1 14 . 1 1 143 143 ASP H H 143 8.108 8.108 8.546 -0.438 25342 11678 1 14 . 1 1 144 144 SER N N 144 115.303 115.303 115.190 0.113 25342 11679 1 14 . 1 1 144 144 SER HA H 144 3.740 3.740 4.274 -0.534 25342 11680 1 14 . 1 1 144 144 SER C C 144 172.925 172.925 174.685 -1.760 25342 11681 1 14 . 1 1 144 144 SER CA C 144 59.213 59.213 60.349 -1.136 25342 11682 1 14 . 1 1 144 144 SER CB C 144 60.806 60.806 63.103 -2.297 25342 11683 1 14 . 1 1 144 144 SER H H 144 7.642 7.642 7.844 -0.202 25342 11684 1 14 . 1 1 145 145 GLU N N 145 119.523 119.523 119.933 -0.410 25342 11685 1 14 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.112 0.194 25342 11686 1 14 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.441 -3.402 25342 11687 1 14 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.405 -2.605 25342 11688 1 14 . 1 1 145 145 GLU H H 145 7.771 7.771 7.879 -0.108 25342 11689 1 14 . 1 1 146 146 VAL N N 146 118.683 118.683 120.958 -2.275 25342 11690 1 14 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.635 -0.694 25342 11691 1 14 . 1 1 146 146 VAL C C 146 174.591 174.591 176.625 -2.034 25342 11692 1 14 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.897 -2.965 25342 11693 1 14 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.097 -2.050 25342 11694 1 14 . 1 1 146 146 VAL H H 146 6.352 6.352 7.181 -0.829 25342 11695 1 14 . 1 1 147 147 ASP N N 147 119.312 119.312 115.938 3.374 25342 11696 1 14 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.322 -0.267 25342 11697 1 14 . 1 1 147 147 ASP C C 147 174.783 174.783 176.978 -2.195 25342 11698 1 14 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.496 -2.255 25342 11699 1 14 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.665 -3.432 25342 11700 1 14 . 1 1 147 147 ASP H H 147 8.370 8.370 8.614 -0.244 25342 11701 1 14 . 1 1 148 148 LYS N N 148 119.342 119.342 115.484 3.858 25342 11702 1 14 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.487 -0.550 25342 11703 1 14 . 1 1 148 148 LYS C C 148 176.384 176.384 177.840 -1.456 25342 11704 1 14 . 1 1 148 148 LYS CA C 148 55.706 55.706 56.603 -0.897 25342 11705 1 14 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.860 -3.349 25342 11706 1 14 . 1 1 148 148 LYS H H 148 7.040 7.040 7.624 -0.584 25342 11707 1 14 . 1 1 149 149 TRP N N 149 118.258 118.258 120.295 -2.037 25342 11708 1 14 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.945 -0.354 25342 11709 1 14 . 1 1 149 149 TRP C C 149 174.212 174.212 176.368 -2.156 25342 11710 1 14 . 1 1 149 149 TRP CA C 149 53.745 53.745 56.013 -2.268 25342 11711 1 14 . 1 1 149 149 TRP CB C 149 26.940 26.940 29.056 -2.116 25342 11712 1 14 . 1 1 149 149 TRP H H 149 7.811 7.811 7.455 0.356 25342 11713 1 14 . 1 1 150 150 SER N N 150 109.618 109.618 112.880 -3.262 25342 11714 1 14 . 1 1 150 150 SER HA H 150 4.234 4.234 4.670 -0.436 25342 11715 1 14 . 1 1 150 150 SER C C 150 170.189 170.189 174.319 -4.130 25342 11716 1 14 . 1 1 150 150 SER CA C 150 56.695 56.695 57.752 -1.057 25342 11717 1 14 . 1 1 150 150 SER CB C 150 61.935 61.935 63.770 -1.835 25342 11718 1 14 . 1 1 150 150 SER H H 150 7.793 7.793 7.770 0.023 25342 11719 1 15 . 1 1 3 3 ALA N N 3 125.638 125.638 125.763 -0.125 25342 11720 1 15 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.415 -0.050 25342 11721 1 15 . 1 1 3 3 ALA CA C 3 49.298 49.298 51.400 -2.102 25342 11722 1 15 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.959 -3.100 25342 11723 1 15 . 1 1 3 3 ALA H H 3 8.325 8.325 8.170 0.155 25342 11724 1 15 . 1 1 4 4 LYS N N 4 121.813 121.813 121.751 0.062 25342 11725 1 15 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.518 -0.291 25342 11726 1 15 . 1 1 4 4 LYS C C 4 174.574 174.574 174.055 0.519 25342 11727 1 15 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.776 -1.995 25342 11728 1 15 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.139 -2.649 25342 11729 1 15 . 1 1 4 4 LYS H H 4 8.486 8.486 8.025 0.461 25342 11730 1 15 . 1 1 5 5 LYS N N 5 129.722 129.722 122.518 7.204 25342 11731 1 15 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.552 -0.034 25342 11732 1 15 . 1 1 5 5 LYS C C 5 174.720 174.720 175.046 -0.326 25342 11733 1 15 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.437 -0.715 25342 11734 1 15 . 1 1 5 5 LYS CB C 5 29.785 29.785 35.743 -5.958 25342 11735 1 15 . 1 1 5 5 LYS H H 5 10.015 10.015 8.431 1.584 25342 11736 1 15 . 1 1 6 6 THR N N 6 126.254 126.254 116.772 9.482 25342 11737 1 15 . 1 1 6 6 THR HA H 6 5.654 5.654 5.349 0.305 25342 11738 1 15 . 1 1 6 6 THR C C 6 169.926 169.926 172.863 -2.937 25342 11739 1 15 . 1 1 6 6 THR CA C 6 60.598 60.598 62.117 -1.519 25342 11740 1 15 . 1 1 6 6 THR CB C 6 68.041 68.041 70.743 -2.702 25342 11741 1 15 . 1 1 6 6 THR H H 6 8.538 8.538 8.705 -0.167 25342 11742 1 15 . 1 1 7 7 LEU N N 7 130.775 130.775 127.146 3.629 25342 11743 1 15 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.702 -0.108 25342 11744 1 15 . 1 1 7 7 LEU C C 7 170.404 170.404 174.306 -3.902 25342 11745 1 15 . 1 1 7 7 LEU CA C 7 49.933 49.933 52.899 -2.966 25342 11746 1 15 . 1 1 7 7 LEU CB C 7 40.728 40.728 45.011 -4.283 25342 11747 1 15 . 1 1 7 7 LEU H H 7 8.575 8.575 8.835 -0.260 25342 11748 1 15 . 1 1 8 8 ILE N N 8 127.242 127.242 124.535 2.707 25342 11749 1 15 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.659 0.189 25342 11750 1 15 . 1 1 8 8 ILE C C 8 170.936 170.936 174.735 -3.799 25342 11751 1 15 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.602 -3.350 25342 11752 1 15 . 1 1 8 8 ILE CB C 8 36.935 36.935 38.687 -1.752 25342 11753 1 15 . 1 1 8 8 ILE H H 8 9.217 9.217 8.458 0.759 25342 11754 1 15 . 1 1 9 9 LEU N N 9 127.183 127.183 129.197 -2.014 25342 11755 1 15 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.743 0.951 25342 11756 1 15 . 1 1 9 9 LEU C C 9 173.824 173.824 175.606 -1.782 25342 11757 1 15 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.145 -4.306 25342 11758 1 15 . 1 1 9 9 LEU CB C 9 43.963 43.963 40.821 3.142 25342 11759 1 15 . 1 1 9 9 LEU H H 9 9.248 9.248 8.521 0.727 25342 11760 1 15 . 1 1 10 10 TYR N N 10 113.330 113.330 123.072 -9.742 25342 11761 1 15 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.304 0.210 25342 11762 1 15 . 1 1 10 10 TYR C C 10 167.898 167.898 173.188 -5.290 25342 11763 1 15 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.599 -0.724 25342 11764 1 15 . 1 1 10 10 TYR CB C 10 38.436 38.436 41.378 -2.942 25342 11765 1 15 . 1 1 10 10 TYR H H 10 7.306 7.306 8.346 -1.040 25342 11766 1 15 . 1 1 11 11 TYR N N 11 121.297 121.297 121.314 -0.017 25342 11767 1 15 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.615 0.147 25342 11768 1 15 . 1 1 11 11 TYR C C 11 169.698 169.698 174.079 -4.381 25342 11769 1 15 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.161 -1.114 25342 11770 1 15 . 1 1 11 11 TYR CB C 11 40.538 40.538 40.695 -0.157 25342 11771 1 15 . 1 1 11 11 TYR H H 11 7.891 7.891 7.590 0.301 25342 11772 1 15 . 1 1 12 12 SER N N 12 117.763 117.763 124.791 -7.028 25342 11773 1 15 . 1 1 12 12 SER HA H 12 4.679 4.679 4.242 0.437 25342 11774 1 15 . 1 1 12 12 SER C C 12 170.075 170.075 173.975 -3.900 25342 11775 1 15 . 1 1 12 12 SER CA C 12 53.619 53.619 56.784 -3.165 25342 11776 1 15 . 1 1 12 12 SER CB C 12 62.847 62.847 62.344 0.502 25342 11777 1 15 . 1 1 12 12 SER H H 12 7.557 7.557 8.137 -0.580 25342 11778 1 15 . 1 1 13 13 TRP N N 13 135.232 135.232 129.225 6.007 25342 11779 1 15 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.841 0.795 25342 11780 1 15 . 1 1 13 13 TRP C C 13 175.708 175.708 176.259 -0.551 25342 11781 1 15 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.687 -2.571 25342 11782 1 15 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.774 -2.139 25342 11783 1 15 . 1 1 13 13 TRP H H 13 9.755 9.755 7.763 1.992 25342 11784 1 15 . 1 1 14 14 SER N N 14 113.789 113.789 111.759 2.030 25342 11785 1 15 . 1 1 14 14 SER HA H 14 4.223 4.223 4.475 -0.252 25342 11786 1 15 . 1 1 14 14 SER C C 14 172.747 172.747 173.986 -1.239 25342 11787 1 15 . 1 1 14 14 SER CA C 14 53.828 53.828 58.789 -4.961 25342 11788 1 15 . 1 1 14 14 SER CB C 14 60.037 60.037 62.827 -2.790 25342 11789 1 15 . 1 1 14 14 SER H H 14 10.026 10.026 8.239 1.787 25342 11790 1 15 . 1 1 15 15 GLY N N 15 110.489 110.489 109.098 1.391 25342 11791 1 15 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.251 -0.592 25342 11792 1 15 . 1 1 15 15 GLY H H 15 7.391 7.391 8.212 -0.821 25342 11793 1 15 . 1 1 16 16 GLU N N 16 129.005 129.005 119.486 9.519 25342 11794 1 15 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.439 -0.376 25342 11795 1 15 . 1 1 16 16 GLU CA C 16 56.761 56.761 56.917 -0.156 25342 11796 1 15 . 1 1 16 16 GLU CB C 16 26.412 26.412 30.485 -4.073 25342 11797 1 15 . 1 1 16 16 GLU H H 16 11.550 11.550 8.364 3.186 25342 11798 1 15 . 1 1 17 17 THR N N 17 123.016 123.016 117.107 5.909 25342 11799 1 15 . 1 1 17 17 THR HA H 17 4.035 4.035 4.145 -0.110 25342 11800 1 15 . 1 1 17 17 THR C C 17 173.360 173.360 177.062 -3.702 25342 11801 1 15 . 1 1 17 17 THR CA C 17 64.303 64.303 65.791 -1.488 25342 11802 1 15 . 1 1 17 17 THR CB C 17 63.999 63.999 68.783 -4.784 25342 11803 1 15 . 1 1 17 17 THR H H 17 11.293 11.293 8.412 2.881 25342 11804 1 15 . 1 1 18 18 LYS N N 18 120.156 120.156 121.668 -1.512 25342 11805 1 15 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.390 -1.534 25342 11806 1 15 . 1 1 18 18 LYS C C 18 173.901 173.901 177.941 -4.040 25342 11807 1 15 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.061 -2.227 25342 11808 1 15 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.078 -2.597 25342 11809 1 15 . 1 1 18 18 LYS H H 18 6.940 6.940 8.546 -1.606 25342 11810 1 15 . 1 1 19 19 LYS N N 19 117.237 117.237 116.867 0.370 25342 11811 1 15 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.214 -0.291 25342 11812 1 15 . 1 1 19 19 LYS CA C 19 56.324 56.324 56.952 -0.628 25342 11813 1 15 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.684 -3.324 25342 11814 1 15 . 1 1 19 19 LYS H H 19 7.212 7.212 7.675 -0.463 25342 11815 1 15 . 1 1 20 20 MET N N 20 119.268 119.268 118.114 1.154 25342 11816 1 15 . 1 1 20 20 MET HA H 20 4.413 4.413 4.550 -0.137 25342 11817 1 15 . 1 1 20 20 MET C C 20 173.625 173.625 175.132 -1.507 25342 11818 1 15 . 1 1 20 20 MET CA C 20 52.261 52.261 53.865 -1.604 25342 11819 1 15 . 1 1 20 20 MET CB C 20 26.680 26.680 32.824 -6.144 25342 11820 1 15 . 1 1 20 20 MET H H 20 7.600 7.600 7.819 -0.219 25342 11821 1 15 . 1 1 21 21 ALA N N 21 123.669 123.669 121.432 2.237 25342 11822 1 15 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.187 -0.705 25342 11823 1 15 . 1 1 21 21 ALA C C 21 176.628 176.628 178.412 -1.784 25342 11824 1 15 . 1 1 21 21 ALA CA C 21 52.374 52.374 53.114 -0.740 25342 11825 1 15 . 1 1 21 21 ALA CB C 21 16.495 16.495 19.223 -2.728 25342 11826 1 15 . 1 1 21 21 ALA H H 21 8.738 8.738 7.365 1.373 25342 11827 1 15 . 1 1 22 22 GLU N N 22 117.242 117.242 119.159 -1.917 25342 11828 1 15 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.819 -0.146 25342 11829 1 15 . 1 1 22 22 GLU C C 22 176.698 176.698 178.665 -1.967 25342 11830 1 15 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.516 -2.976 25342 11831 1 15 . 1 1 22 22 GLU CB C 22 26.434 26.434 28.950 -2.516 25342 11832 1 15 . 1 1 22 22 GLU H H 22 7.959 7.959 7.971 -0.012 25342 11833 1 15 . 1 1 23 23 LYS N N 23 123.302 123.302 120.408 2.894 25342 11834 1 15 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.015 -0.194 25342 11835 1 15 . 1 1 23 23 LYS C C 23 177.389 177.389 178.869 -1.480 25342 11836 1 15 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.427 -2.505 25342 11837 1 15 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.158 -2.644 25342 11838 1 15 . 1 1 23 23 LYS H H 23 7.703 7.703 8.134 -0.431 25342 11839 1 15 . 1 1 24 24 ILE N N 24 122.208 122.208 117.688 4.520 25342 11840 1 15 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.616 -0.333 25342 11841 1 15 . 1 1 24 24 ILE C C 24 174.934 174.934 178.038 -3.104 25342 11842 1 15 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.299 -1.007 25342 11843 1 15 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.463 -2.725 25342 11844 1 15 . 1 1 24 24 ILE H H 24 8.535 8.535 7.449 1.086 25342 11845 1 15 . 1 1 25 25 ASN N N 25 118.640 118.640 118.699 -0.059 25342 11846 1 15 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.357 -0.130 25342 11847 1 15 . 1 1 25 25 ASN C C 25 173.530 173.530 177.791 -4.261 25342 11848 1 15 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.292 -4.081 25342 11849 1 15 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.461 -0.357 25342 11850 1 15 . 1 1 25 25 ASN H H 25 8.317 8.317 8.205 0.112 25342 11851 1 15 . 1 1 26 26 SER N N 26 111.990 111.990 114.929 -2.939 25342 11852 1 15 . 1 1 26 26 SER HA H 26 4.153 4.153 4.276 -0.123 25342 11853 1 15 . 1 1 26 26 SER C C 26 172.110 172.110 175.252 -3.142 25342 11854 1 15 . 1 1 26 26 SER CA C 26 57.905 57.905 61.068 -3.163 25342 11855 1 15 . 1 1 26 26 SER CB C 26 60.655 60.655 63.113 -2.458 25342 11856 1 15 . 1 1 26 26 SER H H 26 7.369 7.369 7.897 -0.528 25342 11857 1 15 . 1 1 27 27 GLU N N 27 120.201 120.201 118.728 1.473 25342 11858 1 15 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.339 -0.238 25342 11859 1 15 . 1 1 27 27 GLU C C 27 173.673 173.673 175.760 -2.087 25342 11860 1 15 . 1 1 27 27 GLU CA C 27 54.235 54.235 55.732 -1.497 25342 11861 1 15 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.046 -3.445 25342 11862 1 15 . 1 1 27 27 GLU H H 27 7.451 7.451 7.618 -0.167 25342 11863 1 15 . 1 1 28 28 ILE N N 28 118.762 118.762 117.957 0.805 25342 11864 1 15 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.156 0.043 25342 11865 1 15 . 1 1 28 28 ILE C C 28 172.487 172.487 175.915 -3.428 25342 11866 1 15 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.130 -2.398 25342 11867 1 15 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.015 -4.277 25342 11868 1 15 . 1 1 28 28 ILE H H 28 7.255 7.255 7.245 0.010 25342 11869 1 15 . 1 1 29 29 LYS N N 29 130.563 130.563 121.843 8.720 25342 11870 1 15 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.177 -0.175 25342 11871 1 15 . 1 1 29 29 LYS C C 29 174.386 174.386 177.290 -2.904 25342 11872 1 15 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.709 -1.174 25342 11873 1 15 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.880 -3.294 25342 11874 1 15 . 1 1 29 29 LYS H H 29 8.564 8.564 8.659 -0.095 25342 11875 1 15 . 1 1 30 30 ASP N N 30 119.357 119.357 120.069 -0.712 25342 11876 1 15 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.510 -0.108 25342 11877 1 15 . 1 1 30 30 ASP C C 30 172.570 172.570 175.913 -3.343 25342 11878 1 15 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.404 -0.968 25342 11879 1 15 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.435 -2.691 25342 11880 1 15 . 1 1 30 30 ASP H H 30 8.920 8.920 8.660 0.260 25342 11881 1 15 . 1 1 31 31 SER N N 31 114.019 114.019 116.253 -2.234 25342 11882 1 15 . 1 1 31 31 SER HA H 31 4.782 4.782 4.850 -0.068 25342 11883 1 15 . 1 1 31 31 SER C C 31 171.150 171.150 174.325 -3.175 25342 11884 1 15 . 1 1 31 31 SER CA C 31 55.551 55.551 57.746 -2.195 25342 11885 1 15 . 1 1 31 31 SER CB C 31 62.259 62.259 65.092 -2.833 25342 11886 1 15 . 1 1 31 31 SER H H 31 8.006 8.006 8.163 -0.157 25342 11887 1 15 . 1 1 32 32 GLU N N 32 121.455 121.455 118.536 2.919 25342 11888 1 15 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.584 0.156 25342 11889 1 15 . 1 1 32 32 GLU C C 32 171.185 171.185 174.280 -3.095 25342 11890 1 15 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.017 -2.936 25342 11891 1 15 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.031 -1.204 25342 11892 1 15 . 1 1 32 32 GLU H H 32 8.145 8.145 8.452 -0.307 25342 11893 1 15 . 1 1 33 33 LEU N N 33 126.176 126.176 121.106 5.070 25342 11894 1 15 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.806 0.500 25342 11895 1 15 . 1 1 33 33 LEU C C 33 173.365 173.365 175.753 -2.388 25342 11896 1 15 . 1 1 33 33 LEU CA C 33 51.440 51.440 53.755 -2.315 25342 11897 1 15 . 1 1 33 33 LEU CB C 33 43.635 43.635 45.092 -1.457 25342 11898 1 15 . 1 1 33 33 LEU H H 33 8.589 8.589 8.423 0.166 25342 11899 1 15 . 1 1 34 34 LYS N N 34 127.200 127.200 123.189 4.011 25342 11900 1 15 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.825 -0.229 25342 11901 1 15 . 1 1 34 34 LYS C C 34 169.622 169.622 174.113 -4.491 25342 11902 1 15 . 1 1 34 34 LYS CA C 34 52.329 52.329 53.687 -1.358 25342 11903 1 15 . 1 1 34 34 LYS CB C 34 34.200 34.200 35.867 -1.667 25342 11904 1 15 . 1 1 34 34 LYS H H 34 9.380 9.380 9.087 0.293 25342 11905 1 15 . 1 1 35 35 GLU N N 35 122.324 122.324 117.274 5.050 25342 11906 1 15 . 1 1 35 35 GLU HA H 35 3.333 3.333 4.742 -1.409 25342 11907 1 15 . 1 1 35 35 GLU C C 35 172.734 172.734 174.395 -1.661 25342 11908 1 15 . 1 1 35 35 GLU CA C 35 52.612 52.612 55.552 -2.940 25342 11909 1 15 . 1 1 35 35 GLU CB C 35 29.319 29.319 31.495 -2.176 25342 11910 1 15 . 1 1 35 35 GLU H H 35 8.094 8.094 8.384 -0.290 25342 11911 1 15 . 1 1 36 36 VAL N N 36 126.781 126.781 123.017 3.764 25342 11912 1 15 . 1 1 36 36 VAL HA H 36 3.839 3.839 3.970 -0.131 25342 11913 1 15 . 1 1 36 36 VAL C C 36 171.482 171.482 174.564 -3.082 25342 11914 1 15 . 1 1 36 36 VAL CA C 36 59.405 59.405 63.025 -3.620 25342 11915 1 15 . 1 1 36 36 VAL CB C 36 29.348 29.348 33.151 -3.803 25342 11916 1 15 . 1 1 36 36 VAL H H 36 8.660 8.660 8.603 0.057 25342 11917 1 15 . 1 1 37 37 LYS N N 37 126.065 126.065 119.809 6.256 25342 11918 1 15 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.597 0.368 25342 11919 1 15 . 1 1 37 37 LYS C C 37 173.187 173.187 174.790 -1.603 25342 11920 1 15 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.244 -1.964 25342 11921 1 15 . 1 1 37 37 LYS CB C 37 32.921 32.921 34.430 -1.509 25342 11922 1 15 . 1 1 37 37 LYS H H 37 7.809 7.809 7.966 -0.157 25342 11923 1 15 . 1 1 38 38 VAL N N 38 111.020 111.020 114.809 -3.789 25342 11924 1 15 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.720 0.104 25342 11925 1 15 . 1 1 38 38 VAL C C 38 173.604 173.604 175.447 -1.843 25342 11926 1 15 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.204 -2.821 25342 11927 1 15 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.099 -1.723 25342 11928 1 15 . 1 1 38 38 VAL H H 38 8.305 8.305 8.153 0.152 25342 11929 1 15 . 1 1 39 39 SER N N 39 117.887 117.887 114.739 3.148 25342 11930 1 15 . 1 1 39 39 SER HA H 39 4.183 4.183 4.644 -0.461 25342 11931 1 15 . 1 1 39 39 SER C C 39 173.538 173.538 173.988 -0.450 25342 11932 1 15 . 1 1 39 39 SER CA C 39 56.279 56.279 57.594 -1.315 25342 11933 1 15 . 1 1 39 39 SER CB C 39 60.537 60.537 64.244 -3.707 25342 11934 1 15 . 1 1 39 39 SER H H 39 8.847 8.847 8.658 0.189 25342 11935 1 15 . 1 1 40 40 GLU N N 40 126.316 126.316 120.626 5.690 25342 11936 1 15 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.285 -0.131 25342 11937 1 15 . 1 1 40 40 GLU C C 40 174.586 174.586 177.595 -3.009 25342 11938 1 15 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.580 -1.768 25342 11939 1 15 . 1 1 40 40 GLU CB C 40 26.720 26.720 30.069 -3.349 25342 11940 1 15 . 1 1 40 40 GLU H H 40 9.049 9.049 8.629 0.420 25342 11941 1 15 . 1 1 41 41 GLY N N 41 112.494 112.494 113.235 -0.741 25342 11942 1 15 . 1 1 41 41 GLY C C 41 171.994 171.994 175.448 -3.454 25342 11943 1 15 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.568 -3.106 25342 11944 1 15 . 1 1 41 41 GLY H H 41 8.780 8.780 8.829 -0.049 25342 11945 1 15 . 1 1 42 42 THR N N 42 118.631 118.631 115.328 3.303 25342 11946 1 15 . 1 1 42 42 THR HA H 42 3.582 3.582 4.003 -0.421 25342 11947 1 15 . 1 1 42 42 THR C C 42 171.225 171.225 174.186 -2.961 25342 11948 1 15 . 1 1 42 42 THR CA C 42 64.104 64.104 64.640 -0.536 25342 11949 1 15 . 1 1 42 42 THR CB C 42 65.914 65.914 69.463 -3.550 25342 11950 1 15 . 1 1 42 42 THR H H 42 7.737 7.737 8.206 -0.469 25342 11951 1 15 . 1 1 43 43 PHE N N 43 116.279 116.279 118.250 -1.971 25342 11952 1 15 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.554 0.466 25342 11953 1 15 . 1 1 43 43 PHE C C 43 170.141 170.141 173.774 -3.633 25342 11954 1 15 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.863 -4.391 25342 11955 1 15 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.480 -4.095 25342 11956 1 15 . 1 1 43 43 PHE H H 43 8.114 8.114 7.964 0.150 25342 11957 1 15 . 1 1 44 44 ASP N N 44 121.513 121.513 119.786 1.727 25342 11958 1 15 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.993 -0.142 25342 11959 1 15 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.785 -2.573 25342 11960 1 15 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.360 0.025 25342 11961 1 15 . 1 1 44 44 ASP H H 44 7.774 7.774 8.416 -0.642 25342 11962 1 15 . 1 1 45 45 ALA N N 45 125.663 125.663 122.834 2.829 25342 11963 1 15 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.765 -0.554 25342 11964 1 15 . 1 1 45 45 ALA C C 45 175.139 175.139 175.998 -0.859 25342 11965 1 15 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.105 -0.668 25342 11966 1 15 . 1 1 45 45 ALA CB C 45 16.232 16.232 18.690 -2.458 25342 11967 1 15 . 1 1 45 45 ALA H H 45 8.324 8.324 8.344 -0.020 25342 11968 1 15 . 1 1 46 46 ASP N N 46 119.288 119.288 120.022 -0.734 25342 11969 1 15 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.724 0.101 25342 11970 1 15 . 1 1 46 46 ASP C C 46 175.013 175.013 176.038 -1.025 25342 11971 1 15 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.089 -1.928 25342 11972 1 15 . 1 1 46 46 ASP CB C 46 41.233 41.233 43.373 -2.140 25342 11973 1 15 . 1 1 46 46 ASP H H 46 9.618 9.618 7.689 1.929 25342 11974 1 15 . 1 1 47 47 MET N N 47 127.347 127.347 115.846 11.501 25342 11975 1 15 . 1 1 47 47 MET HA H 47 3.456 3.456 4.647 -1.191 25342 11976 1 15 . 1 1 47 47 MET C C 47 173.605 173.605 176.383 -2.778 25342 11977 1 15 . 1 1 47 47 MET CA C 47 56.699 56.699 56.248 0.451 25342 11978 1 15 . 1 1 47 47 MET CB C 47 29.930 29.930 34.305 -4.375 25342 11979 1 15 . 1 1 47 47 MET H H 47 9.178 9.178 8.085 1.093 25342 11980 1 15 . 1 1 48 48 TYR N N 48 121.040 121.040 118.109 2.931 25342 11981 1 15 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.716 -0.844 25342 11982 1 15 . 1 1 48 48 TYR CA C 48 58.712 58.712 58.548 0.164 25342 11983 1 15 . 1 1 48 48 TYR CB C 48 33.638 33.638 37.820 -4.182 25342 11984 1 15 . 1 1 48 48 TYR H H 48 7.881 7.881 8.100 -0.219 25342 11985 1 15 . 1 1 49 49 LYS N N 49 121.754 121.754 119.959 1.795 25342 11986 1 15 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.044 0.061 25342 11987 1 15 . 1 1 49 49 LYS CA C 49 56.385 56.385 60.200 -3.815 25342 11988 1 15 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.389 -3.225 25342 11989 1 15 . 1 1 49 49 LYS H H 49 8.365 8.365 8.024 0.341 25342 11990 1 15 . 1 1 50 50 THR N N 50 117.557 117.557 109.244 8.313 25342 11991 1 15 . 1 1 50 50 THR HA H 50 3.586 3.586 4.063 -0.477 25342 11992 1 15 . 1 1 50 50 THR CA C 50 65.634 65.634 65.581 0.053 25342 11993 1 15 . 1 1 50 50 THR CB C 50 65.904 65.904 68.421 -2.517 25342 11994 1 15 . 1 1 50 50 THR H H 50 8.007 8.007 8.148 -0.141 25342 11995 1 15 . 1 1 51 51 SER N N 51 115.110 115.110 117.255 -2.145 25342 11996 1 15 . 1 1 51 51 SER HA H 51 3.974 3.974 4.196 -0.222 25342 11997 1 15 . 1 1 51 51 SER CA C 51 59.042 59.042 61.846 -2.804 25342 11998 1 15 . 1 1 51 51 SER CB C 51 59.835 59.835 63.092 -3.257 25342 11999 1 15 . 1 1 51 51 SER H H 51 7.606 7.606 7.935 -0.329 25342 12000 1 15 . 1 1 52 52 ASP N N 52 119.713 119.713 121.894 -2.181 25342 12001 1 15 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.520 -0.212 25342 12002 1 15 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.031 -2.505 25342 12003 1 15 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.950 -3.262 25342 12004 1 15 . 1 1 52 52 ASP H H 52 7.552 7.552 7.634 -0.082 25342 12005 1 15 . 1 1 53 53 ILE N N 53 121.982 121.982 120.396 1.586 25342 12006 1 15 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.878 -0.156 25342 12007 1 15 . 1 1 53 53 ILE C C 53 175.325 175.325 178.090 -2.765 25342 12008 1 15 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.019 -2.475 25342 12009 1 15 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.788 -1.089 25342 12010 1 15 . 1 1 53 53 ILE H H 53 7.815 7.815 7.268 0.547 25342 12011 1 15 . 1 1 54 54 ALA N N 54 121.552 121.552 120.790 0.762 25342 12012 1 15 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.286 0.031 25342 12013 1 15 . 1 1 54 54 ALA C C 54 177.475 177.475 178.864 -1.389 25342 12014 1 15 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.690 -2.668 25342 12015 1 15 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.752 -2.768 25342 12016 1 15 . 1 1 54 54 ALA H H 54 8.332 8.332 7.660 0.672 25342 12017 1 15 . 1 1 55 55 LEU N N 55 117.176 117.176 119.094 -1.918 25342 12018 1 15 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.050 -0.116 25342 12019 1 15 . 1 1 55 55 LEU C C 55 176.532 176.532 178.324 -1.792 25342 12020 1 15 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.267 -1.936 25342 12021 1 15 . 1 1 55 55 LEU CB C 55 38.428 38.428 42.139 -3.711 25342 12022 1 15 . 1 1 55 55 LEU H H 55 8.195 8.195 7.625 0.570 25342 12023 1 15 . 1 1 56 56 ASP N N 56 120.056 120.056 119.340 0.716 25342 12024 1 15 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.258 0.209 25342 12025 1 15 . 1 1 56 56 ASP C C 56 176.585 176.585 177.871 -1.286 25342 12026 1 15 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.230 -2.680 25342 12027 1 15 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.029 -1.724 25342 12028 1 15 . 1 1 56 56 ASP H H 56 7.806 7.806 8.452 -0.646 25342 12029 1 15 . 1 1 57 57 GLN N N 57 120.020 120.020 116.192 3.828 25342 12030 1 15 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.220 -0.097 25342 12031 1 15 . 1 1 57 57 GLN C C 57 175.689 175.689 176.641 -0.952 25342 12032 1 15 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.309 -1.904 25342 12033 1 15 . 1 1 57 57 GLN CB C 57 23.769 23.769 29.002 -5.233 25342 12034 1 15 . 1 1 57 57 GLN H H 57 7.661 7.661 7.496 0.165 25342 12035 1 15 . 1 1 58 58 ILE N N 58 120.644 120.644 118.824 1.820 25342 12036 1 15 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.170 -0.594 25342 12037 1 15 . 1 1 58 58 ILE C C 58 176.237 176.237 176.878 -0.641 25342 12038 1 15 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.293 0.213 25342 12039 1 15 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.201 -3.172 25342 12040 1 15 . 1 1 58 58 ILE H H 58 8.228 8.228 7.627 0.601 25342 12041 1 15 . 1 1 59 59 GLN N N 59 115.498 115.498 118.929 -3.431 25342 12042 1 15 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.242 -0.100 25342 12043 1 15 . 1 1 59 59 GLN C C 59 173.781 173.781 176.692 -2.911 25342 12044 1 15 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.152 -3.170 25342 12045 1 15 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.310 -2.699 25342 12046 1 15 . 1 1 59 59 GLN H H 59 8.331 8.331 8.299 0.032 25342 12047 1 15 . 1 1 60 60 GLY N N 60 106.623 106.623 105.550 1.073 25342 12048 1 15 . 1 1 60 60 GLY C C 60 172.068 172.068 174.543 -2.475 25342 12049 1 15 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.207 -2.334 25342 12050 1 15 . 1 1 60 60 GLY H H 60 7.611 7.611 8.349 -0.738 25342 12051 1 15 . 1 1 61 61 ASN N N 61 117.691 117.691 116.525 1.166 25342 12052 1 15 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.782 -0.238 25342 12053 1 15 . 1 1 61 61 ASN C C 61 171.946 171.946 175.592 -3.646 25342 12054 1 15 . 1 1 61 61 ASN CA C 61 51.569 51.569 53.628 -2.059 25342 12055 1 15 . 1 1 61 61 ASN CB C 61 36.360 36.360 40.362 -4.002 25342 12056 1 15 . 1 1 61 61 ASN H H 61 8.151 8.151 8.211 -0.060 25342 12057 1 15 . 1 1 62 62 LYS N N 62 118.289 118.289 120.505 -2.216 25342 12058 1 15 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.580 -0.252 25342 12059 1 15 . 1 1 62 62 LYS C C 62 171.773 171.773 174.981 -3.208 25342 12060 1 15 . 1 1 62 62 LYS CA C 62 51.296 51.296 55.174 -3.878 25342 12061 1 15 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.706 -1.022 25342 12062 1 15 . 1 1 62 62 LYS H H 62 7.242 7.242 7.756 -0.514 25342 12063 1 15 . 1 1 63 63 ASP N N 63 119.888 119.888 119.598 0.290 25342 12064 1 15 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.400 0.016 25342 12065 1 15 . 1 1 63 63 ASP C C 63 174.476 174.476 175.854 -1.378 25342 12066 1 15 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.074 -1.613 25342 12067 1 15 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.577 -3.062 25342 12068 1 15 . 1 1 63 63 ASP H H 63 8.230 8.230 8.194 0.036 25342 12069 1 15 . 1 1 64 64 PHE N N 64 119.789 119.789 117.221 2.568 25342 12070 1 15 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.698 -0.882 25342 12071 1 15 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.452 1.798 25342 12072 1 15 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.110 -3.076 25342 12073 1 15 . 1 1 64 64 PHE H H 64 8.428 8.428 7.055 1.373 25342 12074 1 15 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.566 -0.253 25342 12075 1 15 . 1 1 65 65 PRO C C 65 173.975 173.975 175.888 -1.913 25342 12076 1 15 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.740 -2.684 25342 12077 1 15 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.668 -3.148 25342 12078 1 15 . 1 1 66 66 GLU N N 66 121.326 121.326 122.923 -1.597 25342 12079 1 15 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.517 -0.284 25342 12080 1 15 . 1 1 66 66 GLU C C 66 173.978 173.978 176.454 -2.476 25342 12081 1 15 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.755 -2.224 25342 12082 1 15 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.637 -3.937 25342 12083 1 15 . 1 1 66 66 GLU H H 66 8.225 8.225 8.540 -0.315 25342 12084 1 15 . 1 1 67 67 ILE N N 67 113.897 113.897 115.980 -2.083 25342 12085 1 15 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.703 0.466 25342 12086 1 15 . 1 1 67 67 ILE C C 67 172.791 172.791 176.170 -3.379 25342 12087 1 15 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.654 -3.379 25342 12088 1 15 . 1 1 67 67 ILE CB C 67 39.016 39.016 40.580 -1.564 25342 12089 1 15 . 1 1 67 67 ILE H H 67 8.366 8.366 8.148 0.218 25342 12090 1 15 . 1 1 68 68 GLN N N 68 121.654 121.654 122.293 -0.639 25342 12091 1 15 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.528 -0.009 25342 12092 1 15 . 1 1 68 68 GLN C C 68 171.562 171.562 174.796 -3.234 25342 12093 1 15 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.768 -2.455 25342 12094 1 15 . 1 1 68 68 GLN CB C 68 26.785 26.785 27.574 -0.789 25342 12095 1 15 . 1 1 68 68 GLN H H 68 8.763 8.763 8.447 0.316 25342 12096 1 15 . 1 1 69 69 LEU N N 69 125.289 125.289 121.120 4.169 25342 12097 1 15 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.400 0.119 25342 12098 1 15 . 1 1 69 69 LEU C C 69 172.567 172.567 177.166 -4.599 25342 12099 1 15 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.266 -2.469 25342 12100 1 15 . 1 1 69 69 LEU CB C 69 42.742 42.742 43.026 -0.284 25342 12101 1 15 . 1 1 69 69 LEU H H 69 7.996 7.996 7.292 0.704 25342 12102 1 15 . 1 1 70 70 ASP N N 70 123.170 123.170 120.706 2.464 25342 12103 1 15 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.596 -0.191 25342 12104 1 15 . 1 1 70 70 ASP C C 70 171.978 171.978 175.261 -3.283 25342 12105 1 15 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.066 -2.384 25342 12106 1 15 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.273 -2.544 25342 12107 1 15 . 1 1 70 70 ASP H H 70 8.278 8.278 8.381 -0.103 25342 12108 1 15 . 1 1 71 71 ASN N N 71 117.524 117.524 118.559 -1.035 25342 12109 1 15 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.628 -0.301 25342 12110 1 15 . 1 1 71 71 ASN C C 71 171.825 171.825 174.233 -2.408 25342 12111 1 15 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.053 -1.396 25342 12112 1 15 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.935 -3.705 25342 12113 1 15 . 1 1 71 71 ASN H H 71 8.372 8.372 8.446 -0.074 25342 12114 1 15 . 1 1 72 72 ILE N N 72 124.515 124.515 123.585 0.930 25342 12115 1 15 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.000 -0.071 25342 12116 1 15 . 1 1 72 72 ILE C C 72 171.607 171.607 174.119 -2.512 25342 12117 1 15 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.169 -2.881 25342 12118 1 15 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.019 -2.259 25342 12119 1 15 . 1 1 72 72 ILE H H 72 7.653 7.653 8.045 -0.392 25342 12120 1 15 . 1 1 73 73 ASP N N 73 125.182 125.182 126.107 -0.925 25342 12121 1 15 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.541 0.087 25342 12122 1 15 . 1 1 73 73 ASP C C 73 173.980 173.980 176.353 -2.373 25342 12123 1 15 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.243 -5.029 25342 12124 1 15 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.716 -3.814 25342 12125 1 15 . 1 1 73 73 ASP H H 73 8.382 8.382 8.526 -0.144 25342 12126 1 15 . 1 1 74 74 TYR N N 74 123.092 123.092 124.548 -1.456 25342 12127 1 15 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.537 -0.672 25342 12128 1 15 . 1 1 74 74 TYR C C 74 173.582 173.582 176.933 -3.351 25342 12129 1 15 . 1 1 74 74 TYR CA C 74 59.486 59.486 58.281 1.205 25342 12130 1 15 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.008 -3.200 25342 12131 1 15 . 1 1 74 74 TYR H H 74 7.348 7.348 8.429 -1.081 25342 12132 1 15 . 1 1 75 75 ASN N N 75 109.447 109.447 118.954 -9.507 25342 12133 1 15 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.752 0.173 25342 12134 1 15 . 1 1 75 75 ASN C C 75 172.570 172.570 175.615 -3.045 25342 12135 1 15 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.717 -3.099 25342 12136 1 15 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.625 -3.091 25342 12137 1 15 . 1 1 75 75 ASN H H 75 8.040 8.040 8.441 -0.401 25342 12138 1 15 . 1 1 76 76 ASN N N 76 117.411 117.411 115.638 1.773 25342 12139 1 15 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.543 -0.089 25342 12140 1 15 . 1 1 76 76 ASN C C 76 171.155 171.155 175.085 -3.930 25342 12141 1 15 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.215 -2.281 25342 12142 1 15 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.087 -2.429 25342 12143 1 15 . 1 1 76 76 ASN H H 76 7.750 7.750 8.071 -0.321 25342 12144 1 15 . 1 1 77 77 TYR N N 77 116.878 116.878 118.609 -1.731 25342 12145 1 15 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.409 -0.055 25342 12146 1 15 . 1 1 77 77 TYR C C 77 172.224 172.224 175.516 -3.292 25342 12147 1 15 . 1 1 77 77 TYR CA C 77 55.240 55.240 59.136 -3.896 25342 12148 1 15 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.081 -1.968 25342 12149 1 15 . 1 1 77 77 TYR H H 77 7.789 7.789 7.115 0.674 25342 12150 1 15 . 1 1 78 78 ASP N N 78 121.352 121.352 119.588 1.764 25342 12151 1 15 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.971 -0.174 25342 12152 1 15 . 1 1 78 78 ASP C C 78 172.623 172.623 175.507 -2.884 25342 12153 1 15 . 1 1 78 78 ASP CA C 78 53.190 53.190 55.174 -1.984 25342 12154 1 15 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.765 -2.730 25342 12155 1 15 . 1 1 78 78 ASP H H 78 9.036 9.036 8.729 0.307 25342 12156 1 15 . 1 1 79 79 LEU N N 79 123.073 123.073 118.277 4.796 25342 12157 1 15 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.068 0.040 25342 12158 1 15 . 1 1 79 79 LEU C C 79 170.730 170.730 174.276 -3.546 25342 12159 1 15 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.245 -2.988 25342 12160 1 15 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.356 -4.072 25342 12161 1 15 . 1 1 79 79 LEU H H 79 7.877 7.877 8.082 -0.205 25342 12162 1 15 . 1 1 80 80 ILE N N 80 126.348 126.348 122.876 3.472 25342 12163 1 15 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.918 0.151 25342 12164 1 15 . 1 1 80 80 ILE C C 80 171.584 171.584 174.387 -2.803 25342 12165 1 15 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.076 -2.661 25342 12166 1 15 . 1 1 80 80 ILE CB C 80 37.998 37.998 41.016 -3.018 25342 12167 1 15 . 1 1 80 80 ILE H H 80 8.704 8.704 8.692 0.012 25342 12168 1 15 . 1 1 81 81 LEU N N 81 126.303 126.303 127.922 -1.619 25342 12169 1 15 . 1 1 81 81 LEU HA H 81 5.123 5.123 5.151 -0.028 25342 12170 1 15 . 1 1 81 81 LEU C C 81 172.779 172.779 175.454 -2.675 25342 12171 1 15 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.848 -4.339 25342 12172 1 15 . 1 1 81 81 LEU CB C 81 41.715 41.715 44.874 -3.159 25342 12173 1 15 . 1 1 81 81 LEU H H 81 9.202 9.202 8.780 0.422 25342 12174 1 15 . 1 1 82 82 ILE N N 82 120.931 120.931 121.202 -0.271 25342 12175 1 15 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.909 -0.062 25342 12176 1 15 . 1 1 82 82 ILE C C 82 172.796 172.796 174.782 -1.986 25342 12177 1 15 . 1 1 82 82 ILE CA C 82 56.881 56.881 60.022 -3.141 25342 12178 1 15 . 1 1 82 82 ILE CB C 82 37.797 37.797 41.368 -3.571 25342 12179 1 15 . 1 1 82 82 ILE H H 82 8.846 8.846 8.765 0.081 25342 12180 1 15 . 1 1 83 83 GLY N N 83 120.905 120.905 113.274 7.631 25342 12181 1 15 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.666 -2.108 25342 12182 1 15 . 1 1 83 83 GLY H H 83 9.558 9.558 8.096 1.462 25342 12183 1 15 . 1 1 84 84 SER N N 84 116.601 116.601 114.020 2.581 25342 12184 1 15 . 1 1 84 84 SER HA H 84 5.476 5.476 5.046 0.430 25342 12185 1 15 . 1 1 84 84 SER CA C 84 51.324 51.324 56.337 -5.013 25342 12186 1 15 . 1 1 84 84 SER CB C 84 64.271 64.271 64.129 0.142 25342 12187 1 15 . 1 1 84 84 SER H H 84 7.533 7.533 7.303 0.230 25342 12188 1 15 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.475 0.688 25342 12189 1 15 . 1 1 85 85 PRO C C 85 175.590 175.590 176.316 -0.726 25342 12190 1 15 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.670 -3.787 25342 12191 1 15 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.582 -2.108 25342 12192 1 15 . 1 1 86 86 VAL N N 86 116.295 116.295 117.916 -1.621 25342 12193 1 15 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.175 -0.354 25342 12194 1 15 . 1 1 86 86 VAL C C 86 172.692 172.692 175.500 -2.808 25342 12195 1 15 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.165 -1.353 25342 12196 1 15 . 1 1 86 86 VAL CB C 86 30.083 30.083 34.185 -4.102 25342 12197 1 15 . 1 1 86 86 VAL H H 86 7.246 7.246 7.905 -0.659 25342 12198 1 15 . 1 1 87 87 TRP N N 87 131.042 131.042 125.845 5.197 25342 12199 1 15 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.700 -0.389 25342 12200 1 15 . 1 1 87 87 TRP C C 87 173.323 173.323 176.348 -3.025 25342 12201 1 15 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.763 -4.876 25342 12202 1 15 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.397 -4.087 25342 12203 1 15 . 1 1 87 87 TRP H H 87 9.555 9.555 8.319 1.236 25342 12204 1 15 . 1 1 88 88 SER N N 88 122.660 122.660 116.874 5.786 25342 12205 1 15 . 1 1 88 88 SER HA H 88 4.582 4.582 4.252 0.330 25342 12206 1 15 . 1 1 88 88 SER C C 88 172.096 172.096 175.376 -3.280 25342 12207 1 15 . 1 1 88 88 SER CA C 88 55.391 55.391 60.136 -4.745 25342 12208 1 15 . 1 1 88 88 SER CB C 88 57.813 57.813 62.208 -4.395 25342 12209 1 15 . 1 1 88 88 SER H H 88 10.257 10.257 8.923 1.334 25342 12210 1 15 . 1 1 89 89 GLY N N 89 128.381 128.381 114.876 13.505 25342 12211 1 15 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.173 -2.544 25342 12212 1 15 . 1 1 89 89 GLY H H 89 6.372 6.372 8.469 -2.097 25342 12213 1 15 . 1 1 90 90 TYR N N 90 120.345 120.345 120.090 0.255 25342 12214 1 15 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.649 -0.460 25342 12215 1 15 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.609 -1.060 25342 12216 1 15 . 1 1 90 90 TYR CB C 90 37.195 37.195 39.688 -2.493 25342 12217 1 15 . 1 1 90 90 TYR H H 90 8.113 8.113 7.342 0.771 25342 12218 1 15 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.517 0.317 25342 12219 1 15 . 1 1 91 91 PRO C C 91 170.911 170.911 176.536 -5.625 25342 12220 1 15 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.096 -3.261 25342 12221 1 15 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.635 -6.565 25342 12222 1 15 . 1 1 92 92 ALA N N 92 120.629 120.629 122.035 -1.406 25342 12223 1 15 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.360 0.259 25342 12224 1 15 . 1 1 92 92 ALA C C 92 176.782 176.782 176.746 0.036 25342 12225 1 15 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.422 -2.005 25342 12226 1 15 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.368 -1.852 25342 12227 1 15 . 1 1 92 92 ALA H H 92 7.554 7.554 8.612 -1.058 25342 12228 1 15 . 1 1 93 93 THR N N 93 112.558 112.558 109.518 3.040 25342 12229 1 15 . 1 1 93 93 THR CB C 93 64.173 64.173 67.677 -3.504 25342 12230 1 15 . 1 1 93 93 THR H H 93 6.730 6.730 7.736 -1.006 25342 12231 1 15 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.459 -0.600 25342 12232 1 15 . 1 1 94 94 PRO C C 94 173.309 173.309 176.596 -3.287 25342 12233 1 15 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.356 -1.293 25342 12234 1 15 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.757 -2.478 25342 12235 1 15 . 1 1 95 95 ILE N N 95 111.014 111.014 116.872 -5.858 25342 12236 1 15 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.280 -0.675 25342 12237 1 15 . 1 1 95 95 ILE C C 95 174.302 174.302 177.383 -3.081 25342 12238 1 15 . 1 1 95 95 ILE CA C 95 57.181 57.181 60.039 -2.858 25342 12239 1 15 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.743 -4.960 25342 12240 1 15 . 1 1 95 95 ILE H H 95 7.995 7.995 7.984 0.011 25342 12241 1 15 . 1 1 96 96 LYS N N 96 123.208 123.208 122.412 0.796 25342 12242 1 15 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.983 -0.891 25342 12243 1 15 . 1 1 96 96 LYS C C 96 174.451 174.451 178.426 -3.975 25342 12244 1 15 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.438 -2.397 25342 12245 1 15 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.881 -3.135 25342 12246 1 15 . 1 1 96 96 LYS H H 96 6.928 6.928 7.433 -0.505 25342 12247 1 15 . 1 1 97 97 THR N N 97 113.320 113.320 114.087 -0.767 25342 12248 1 15 . 1 1 97 97 THR HA H 97 3.436 3.436 3.839 -0.403 25342 12249 1 15 . 1 1 97 97 THR C C 97 173.221 173.221 176.052 -2.831 25342 12250 1 15 . 1 1 97 97 THR CA C 97 62.710 62.710 64.978 -2.268 25342 12251 1 15 . 1 1 97 97 THR CB C 97 65.562 65.562 68.752 -3.191 25342 12252 1 15 . 1 1 97 97 THR H H 97 6.325 6.325 7.925 -1.600 25342 12253 1 15 . 1 1 98 98 LEU N N 98 120.963 120.963 123.283 -2.320 25342 12254 1 15 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.027 -0.402 25342 12255 1 15 . 1 1 98 98 LEU C C 98 174.713 174.713 178.269 -3.556 25342 12256 1 15 . 1 1 98 98 LEU CA C 98 55.514 55.514 58.026 -2.512 25342 12257 1 15 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.975 -2.247 25342 12258 1 15 . 1 1 98 98 LEU H H 98 7.536 7.536 7.590 -0.054 25342 12259 1 15 . 1 1 99 99 LEU N N 99 118.859 118.859 118.000 0.859 25342 12260 1 15 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.919 -0.247 25342 12261 1 15 . 1 1 99 99 LEU C C 99 177.458 177.458 178.816 -1.358 25342 12262 1 15 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.278 -3.133 25342 12263 1 15 . 1 1 99 99 LEU CB C 99 38.857 38.857 40.992 -2.135 25342 12264 1 15 . 1 1 99 99 LEU H H 99 8.179 8.179 8.412 -0.233 25342 12265 1 15 . 1 1 100 100 ASP N N 100 118.703 118.703 118.520 0.183 25342 12266 1 15 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.299 -0.078 25342 12267 1 15 . 1 1 100 100 ASP C C 100 176.472 176.472 178.284 -1.812 25342 12268 1 15 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.430 -3.123 25342 12269 1 15 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.516 -3.158 25342 12270 1 15 . 1 1 100 100 ASP H H 100 7.867 7.867 8.210 -0.343 25342 12271 1 15 . 1 1 101 101 GLN N N 101 117.829 117.829 117.012 0.817 25342 12272 1 15 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.222 -0.022 25342 12273 1 15 . 1 1 101 101 GLN C C 101 174.508 174.508 177.087 -2.579 25342 12274 1 15 . 1 1 101 101 GLN CA C 101 54.688 54.688 57.785 -3.097 25342 12275 1 15 . 1 1 101 101 GLN CB C 101 25.597 25.597 28.848 -3.251 25342 12276 1 15 . 1 1 101 101 GLN H H 101 7.597 7.597 7.811 -0.214 25342 12277 1 15 . 1 1 102 102 MET N N 102 118.406 118.406 114.655 3.751 25342 12278 1 15 . 1 1 102 102 MET HA H 102 3.864 3.864 4.922 -1.058 25342 12279 1 15 . 1 1 102 102 MET C C 102 172.820 172.820 176.602 -3.782 25342 12280 1 15 . 1 1 102 102 MET CA C 102 53.298 53.298 55.183 -1.885 25342 12281 1 15 . 1 1 102 102 MET CB C 102 31.207 31.207 33.191 -1.984 25342 12282 1 15 . 1 1 102 102 MET H H 102 7.434 7.434 7.629 -0.195 25342 12283 1 15 . 1 1 103 103 LYS N N 103 115.889 115.889 121.245 -5.356 25342 12284 1 15 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.076 -0.157 25342 12285 1 15 . 1 1 103 103 LYS C C 103 173.938 173.938 177.203 -3.265 25342 12286 1 15 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.881 -2.444 25342 12287 1 15 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.945 -2.682 25342 12288 1 15 . 1 1 103 103 LYS H H 103 6.881 6.881 7.740 -0.859 25342 12289 1 15 . 1 1 104 104 ASN N N 104 114.951 114.951 114.353 0.598 25342 12290 1 15 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.777 -0.046 25342 12291 1 15 . 1 1 104 104 ASN C C 104 172.617 172.617 175.159 -2.542 25342 12292 1 15 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.029 -2.763 25342 12293 1 15 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.900 -3.117 25342 12294 1 15 . 1 1 104 104 ASN H H 104 8.493 8.493 8.044 0.449 25342 12295 1 15 . 1 1 105 105 TYR N N 105 122.680 122.680 123.097 -0.417 25342 12296 1 15 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.522 0.040 25342 12297 1 15 . 1 1 105 105 TYR CA C 105 55.433 55.433 58.725 -3.292 25342 12298 1 15 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.986 -4.154 25342 12299 1 15 . 1 1 105 105 TYR H H 105 8.217 8.217 7.817 0.400 25342 12300 1 15 . 1 1 106 106 ARG N N 106 128.872 128.872 121.641 7.231 25342 12301 1 15 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.226 0.039 25342 12302 1 15 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.357 -2.375 25342 12303 1 15 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.885 -4.755 25342 12304 1 15 . 1 1 106 106 ARG H H 106 8.801 8.801 8.083 0.718 25342 12305 1 15 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.916 -2.515 25342 12306 1 15 . 1 1 108 108 GLU N N 108 117.000 117.000 122.320 -5.320 25342 12307 1 15 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.515 0.111 25342 12308 1 15 . 1 1 108 108 GLU C C 108 174.125 174.125 175.528 -1.403 25342 12309 1 15 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.496 -2.708 25342 12310 1 15 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.256 -0.816 25342 12311 1 15 . 1 1 108 108 GLU H H 108 7.514 7.514 8.204 -0.690 25342 12312 1 15 . 1 1 109 109 VAL N N 109 123.398 123.398 125.302 -1.904 25342 12313 1 15 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.111 0.226 25342 12314 1 15 . 1 1 109 109 VAL C C 109 170.606 170.606 173.862 -3.256 25342 12315 1 15 . 1 1 109 109 VAL CA C 109 57.280 57.280 61.016 -3.736 25342 12316 1 15 . 1 1 109 109 VAL CB C 109 32.657 32.657 33.716 -1.059 25342 12317 1 15 . 1 1 109 109 VAL H H 109 8.942 8.942 8.169 0.773 25342 12318 1 15 . 1 1 110 110 ALA N N 110 127.905 127.905 130.097 -2.192 25342 12319 1 15 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.889 -0.262 25342 12320 1 15 . 1 1 110 110 ALA C C 110 173.195 173.195 175.400 -2.205 25342 12321 1 15 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.467 -2.120 25342 12322 1 15 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.386 -4.061 25342 12323 1 15 . 1 1 110 110 ALA H H 110 8.776 8.776 8.783 -0.007 25342 12324 1 15 . 1 1 111 111 SER N N 111 110.523 110.523 114.120 -3.597 25342 12325 1 15 . 1 1 111 111 SER HA H 111 5.562 5.562 5.468 0.094 25342 12326 1 15 . 1 1 111 111 SER C C 111 170.719 170.719 172.919 -2.200 25342 12327 1 15 . 1 1 111 111 SER CA C 111 51.314 51.314 56.744 -5.430 25342 12328 1 15 . 1 1 111 111 SER CB C 111 61.907 61.907 66.456 -4.549 25342 12329 1 15 . 1 1 111 111 SER H H 111 7.480 7.480 8.172 -0.692 25342 12330 1 15 . 1 1 112 112 PHE N N 112 125.567 125.567 118.393 7.174 25342 12331 1 15 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.688 0.668 25342 12332 1 15 . 1 1 112 112 PHE C C 112 169.536 169.536 173.603 -4.067 25342 12333 1 15 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.667 -5.296 25342 12334 1 15 . 1 1 112 112 PHE CB C 112 39.788 39.788 41.999 -2.211 25342 12335 1 15 . 1 1 112 112 PHE H H 112 7.848 7.848 8.213 -0.365 25342 12336 1 15 . 1 1 113 113 PHE N N 113 115.065 115.065 115.937 -0.872 25342 12337 1 15 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.538 0.566 25342 12338 1 15 . 1 1 113 113 PHE C C 113 173.006 173.006 175.192 -2.186 25342 12339 1 15 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.218 -5.956 25342 12340 1 15 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.899 -5.150 25342 12341 1 15 . 1 1 113 113 PHE H H 113 7.361 7.361 8.189 -0.828 25342 12342 1 15 . 1 1 114 114 THR N N 114 108.014 108.014 113.751 -5.737 25342 12343 1 15 . 1 1 114 114 THR HA H 114 4.999 4.999 5.174 -0.175 25342 12344 1 15 . 1 1 114 114 THR C C 114 169.874 169.874 173.364 -3.490 25342 12345 1 15 . 1 1 114 114 THR CA C 114 56.500 56.500 61.188 -4.689 25342 12346 1 15 . 1 1 114 114 THR CB C 114 68.809 68.809 71.052 -2.243 25342 12347 1 15 . 1 1 114 114 THR H H 114 7.867 7.867 8.604 -0.737 25342 12348 1 15 . 1 1 115 115 SER N N 115 115.049 115.049 119.354 -4.305 25342 12349 1 15 . 1 1 115 115 SER HA H 115 5.613 5.613 4.712 0.901 25342 12350 1 15 . 1 1 115 115 SER C C 115 171.247 171.247 174.751 -3.504 25342 12351 1 15 . 1 1 115 115 SER CA C 115 54.830 54.830 56.890 -2.060 25342 12352 1 15 . 1 1 115 115 SER CB C 115 63.992 63.992 64.684 -0.692 25342 12353 1 15 . 1 1 115 115 SER H H 115 8.970 8.970 8.626 0.344 25342 12354 1 15 . 1 1 116 116 ALA N N 116 122.671 122.671 125.099 -2.428 25342 12355 1 15 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.445 0.540 25342 12356 1 15 . 1 1 116 116 ALA C C 116 176.180 176.180 177.609 -1.429 25342 12357 1 15 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.333 -2.132 25342 12358 1 15 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.613 -1.618 25342 12359 1 15 . 1 1 116 116 ALA H H 116 8.963 8.963 8.826 0.137 25342 12360 1 15 . 1 1 117 117 GLY N N 117 107.387 107.387 107.595 -0.208 25342 12361 1 15 . 1 1 117 117 GLY C C 117 172.528 172.528 173.988 -1.460 25342 12362 1 15 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.695 -1.963 25342 12363 1 15 . 1 1 117 117 GLY H H 117 9.340 9.340 8.162 1.178 25342 12364 1 15 . 1 1 118 118 THR N N 118 113.481 113.481 112.740 0.741 25342 12365 1 15 . 1 1 118 118 THR HA H 118 4.651 4.651 4.519 0.132 25342 12366 1 15 . 1 1 118 118 THR C C 118 172.067 172.067 174.389 -2.322 25342 12367 1 15 . 1 1 118 118 THR CA C 118 57.357 57.357 59.806 -2.449 25342 12368 1 15 . 1 1 118 118 THR CB C 118 69.475 69.475 70.954 -1.479 25342 12369 1 15 . 1 1 118 118 THR H H 118 9.373 9.373 7.453 1.920 25342 12370 1 15 . 1 1 119 119 ASN N N 119 113.202 113.202 117.269 -4.067 25342 12371 1 15 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.135 0.483 25342 12372 1 15 . 1 1 119 119 ASN C C 119 173.114 173.114 175.779 -2.665 25342 12373 1 15 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.199 -2.515 25342 12374 1 15 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.324 -3.594 25342 12375 1 15 . 1 1 119 119 ASN H H 119 8.908 8.908 8.705 0.203 25342 12376 1 15 . 1 1 120 120 HIS N N 120 117.315 117.315 115.881 1.434 25342 12377 1 15 . 1 1 120 120 HIS HA H 120 3.786 3.786 3.132 0.654 25342 12378 1 15 . 1 1 120 120 HIS C C 120 174.381 174.381 176.629 -2.248 25342 12379 1 15 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.091 -3.575 25342 12380 1 15 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.055 -2.551 25342 12381 1 15 . 1 1 120 120 HIS H H 120 8.074 8.074 7.972 0.102 25342 12382 1 15 . 1 1 121 121 LYS N N 121 118.678 118.678 119.850 -1.172 25342 12383 1 15 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.087 -0.253 25342 12384 1 15 . 1 1 121 121 LYS C C 121 176.564 176.564 178.573 -2.009 25342 12385 1 15 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.677 -1.382 25342 12386 1 15 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.965 -3.023 25342 12387 1 15 . 1 1 121 121 LYS H H 121 8.336 8.336 7.952 0.384 25342 12388 1 15 . 1 1 122 122 ALA N N 122 122.146 122.146 121.090 1.056 25342 12389 1 15 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.332 -0.637 25342 12390 1 15 . 1 1 122 122 ALA C C 122 175.163 175.163 179.253 -4.090 25342 12391 1 15 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.829 -3.137 25342 12392 1 15 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.658 -2.940 25342 12393 1 15 . 1 1 122 122 ALA H H 122 7.584 7.584 8.217 -0.633 25342 12394 1 15 . 1 1 123 123 TYR N N 123 119.730 119.730 114.024 5.706 25342 12395 1 15 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.369 -1.216 25342 12396 1 15 . 1 1 123 123 TYR C C 123 174.340 174.340 176.826 -2.486 25342 12397 1 15 . 1 1 123 123 TYR CA C 123 60.398 60.398 57.861 2.537 25342 12398 1 15 . 1 1 123 123 TYR CB C 123 34.663 34.663 36.977 -2.314 25342 12399 1 15 . 1 1 123 123 TYR H H 123 7.317 7.317 7.766 -0.449 25342 12400 1 15 . 1 1 124 124 VAL N N 124 118.649 118.649 116.717 1.932 25342 12401 1 15 . 1 1 124 124 VAL HA H 124 3.202 3.202 4.370 -1.168 25342 12402 1 15 . 1 1 124 124 VAL C C 124 175.603 175.603 177.657 -2.054 25342 12403 1 15 . 1 1 124 124 VAL CA C 124 64.680 64.680 63.320 1.360 25342 12404 1 15 . 1 1 124 124 VAL CB C 124 29.289 29.289 32.914 -3.625 25342 12405 1 15 . 1 1 124 124 VAL H H 124 7.799 7.799 7.382 0.417 25342 12406 1 15 . 1 1 125 125 SER N N 125 114.475 114.475 117.251 -2.776 25342 12407 1 15 . 1 1 125 125 SER HA H 125 4.032 4.032 4.146 -0.114 25342 12408 1 15 . 1 1 125 125 SER C C 125 174.849 174.849 176.491 -1.642 25342 12409 1 15 . 1 1 125 125 SER CA C 125 59.002 59.002 62.442 -3.440 25342 12410 1 15 . 1 1 125 125 SER CB C 125 59.613 59.613 63.212 -3.599 25342 12411 1 15 . 1 1 125 125 SER H H 125 7.766 7.766 7.844 -0.078 25342 12412 1 15 . 1 1 126 126 HIS N N 126 119.326 119.326 120.560 -1.234 25342 12413 1 15 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.234 -0.107 25342 12414 1 15 . 1 1 126 126 HIS C C 126 172.865 172.865 177.174 -4.309 25342 12415 1 15 . 1 1 126 126 HIS CA C 126 55.706 55.706 60.434 -4.728 25342 12416 1 15 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.419 -4.426 25342 12417 1 15 . 1 1 126 126 HIS H H 126 8.569 8.569 8.494 0.075 25342 12418 1 15 . 1 1 127 127 PHE N N 127 121.044 121.044 118.310 2.734 25342 12419 1 15 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.444 -1.270 25342 12420 1 15 . 1 1 127 127 PHE C C 127 173.378 173.378 176.409 -3.031 25342 12421 1 15 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.013 -0.145 25342 12422 1 15 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.271 -3.217 25342 12423 1 15 . 1 1 127 127 PHE H H 127 9.139 9.139 8.233 0.906 25342 12424 1 15 . 1 1 128 128 ASN N N 128 114.893 114.893 117.689 -2.796 25342 12425 1 15 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.187 -0.147 25342 12426 1 15 . 1 1 128 128 ASN C C 128 175.230 175.230 177.141 -1.911 25342 12427 1 15 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.647 -2.347 25342 12428 1 15 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.814 -2.643 25342 12429 1 15 . 1 1 128 128 ASN H H 128 7.774 7.774 7.974 -0.200 25342 12430 1 15 . 1 1 129 129 GLU N N 129 119.804 119.804 119.623 0.181 25342 12431 1 15 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.679 0.361 25342 12432 1 15 . 1 1 129 129 GLU C C 129 177.052 177.052 178.833 -1.781 25342 12433 1 15 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.947 -2.217 25342 12434 1 15 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.079 -1.883 25342 12435 1 15 . 1 1 129 129 GLU H H 129 7.577 7.577 7.580 -0.003 25342 12436 1 15 . 1 1 130 130 TRP N N 130 120.979 120.979 117.121 3.858 25342 12437 1 15 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.383 0.074 25342 12438 1 15 . 1 1 130 130 TRP C C 130 174.329 174.329 174.622 -0.293 25342 12439 1 15 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.420 -1.732 25342 12440 1 15 . 1 1 130 130 TRP CB C 130 26.991 26.991 28.272 -1.281 25342 12441 1 15 . 1 1 130 130 TRP H H 130 8.225 8.225 7.678 0.547 25342 12442 1 15 . 1 1 131 131 ALA N N 131 120.450 120.450 118.883 1.567 25342 12443 1 15 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.244 -0.308 25342 12444 1 15 . 1 1 131 131 ALA C C 131 172.487 172.487 175.339 -2.852 25342 12445 1 15 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.897 -3.463 25342 12446 1 15 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.831 -3.543 25342 12447 1 15 . 1 1 131 131 ALA H H 131 8.081 8.081 7.414 0.667 25342 12448 1 15 . 1 1 132 132 ASP N N 132 117.813 117.813 120.848 -3.035 25342 12449 1 15 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.388 -0.180 25342 12450 1 15 . 1 1 132 132 ASP C C 132 173.804 173.804 176.326 -2.522 25342 12451 1 15 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.949 -1.768 25342 12452 1 15 . 1 1 132 132 ASP CB C 132 39.321 39.321 39.885 -0.564 25342 12453 1 15 . 1 1 132 132 ASP H H 132 6.772 6.772 7.762 -0.990 25342 12454 1 15 . 1 1 133 133 GLY N N 133 115.052 115.052 111.097 3.955 25342 12455 1 15 . 1 1 133 133 GLY C C 133 172.078 172.078 173.976 -1.898 25342 12456 1 15 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.176 -2.756 25342 12457 1 15 . 1 1 133 133 GLY H H 133 8.626 8.626 7.849 0.777 25342 12458 1 15 . 1 1 134 134 LEU N N 134 120.063 120.063 123.881 -3.818 25342 12459 1 15 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.529 -0.057 25342 12460 1 15 . 1 1 134 134 LEU C C 134 174.079 174.079 176.576 -2.497 25342 12461 1 15 . 1 1 134 134 LEU CA C 134 50.964 50.964 54.247 -3.283 25342 12462 1 15 . 1 1 134 134 LEU CB C 134 40.370 40.370 42.606 -2.236 25342 12463 1 15 . 1 1 134 134 LEU H H 134 8.094 8.094 7.871 0.223 25342 12464 1 15 . 1 1 135 135 ASN N N 135 119.292 119.292 120.700 -1.408 25342 12465 1 15 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.597 0.026 25342 12466 1 15 . 1 1 135 135 ASN C C 135 170.527 170.527 174.601 -4.074 25342 12467 1 15 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.191 -4.189 25342 12468 1 15 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.386 -4.827 25342 12469 1 15 . 1 1 135 135 ASN H H 135 8.513 8.513 8.477 0.036 25342 12470 1 15 . 1 1 136 136 VAL N N 136 125.412 125.412 124.846 0.566 25342 12471 1 15 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.528 0.078 25342 12472 1 15 . 1 1 136 136 VAL C C 136 175.420 175.420 176.798 -1.378 25342 12473 1 15 . 1 1 136 136 VAL CA C 136 58.382 58.382 62.436 -4.054 25342 12474 1 15 . 1 1 136 136 VAL CB C 136 29.247 29.247 32.755 -3.508 25342 12475 1 15 . 1 1 136 136 VAL H H 136 7.648 7.648 8.228 -0.580 25342 12476 1 15 . 1 1 137 137 ILE N N 137 121.881 121.881 121.661 0.220 25342 12477 1 15 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.611 -0.178 25342 12478 1 15 . 1 1 137 137 ILE C C 137 173.906 173.906 175.138 -1.232 25342 12479 1 15 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.367 -1.389 25342 12480 1 15 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.820 -2.624 25342 12481 1 15 . 1 1 137 137 ILE H H 137 9.139 9.139 8.861 0.278 25342 12482 1 15 . 1 1 138 138 GLY N N 138 108.226 108.226 107.580 0.646 25342 12483 1 15 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.753 -2.362 25342 12484 1 15 . 1 1 138 138 GLY H H 138 6.645 6.645 7.461 -0.816 25342 12485 1 15 . 1 1 139 139 VAL N N 139 119.408 119.408 122.634 -3.226 25342 12486 1 15 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.838 0.519 25342 12487 1 15 . 1 1 139 139 VAL C C 139 172.327 172.327 174.901 -2.574 25342 12488 1 15 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.248 -1.981 25342 12489 1 15 . 1 1 139 139 VAL CB C 139 32.743 32.743 31.767 0.976 25342 12490 1 15 . 1 1 139 139 VAL H H 139 8.092 8.092 8.802 -0.710 25342 12491 1 15 . 1 1 140 140 ALA N N 140 127.415 127.415 128.301 -0.886 25342 12492 1 15 . 1 1 140 140 ALA HA H 140 4.445 4.445 4.933 -0.488 25342 12493 1 15 . 1 1 140 140 ALA C C 140 170.718 170.718 175.950 -5.232 25342 12494 1 15 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.009 -2.109 25342 12495 1 15 . 1 1 140 140 ALA CB C 140 21.059 21.059 21.942 -0.883 25342 12496 1 15 . 1 1 140 140 ALA H H 140 9.093 9.093 8.175 0.918 25342 12497 1 15 . 1 1 141 141 ARG N N 141 119.287 119.287 117.697 1.590 25342 12498 1 15 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.166 -2.679 25342 12499 1 15 . 1 1 141 141 ARG C C 141 173.375 173.375 176.065 -2.690 25342 12500 1 15 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.224 -3.340 25342 12501 1 15 . 1 1 141 141 ARG CB C 141 28.684 28.684 32.856 -4.172 25342 12502 1 15 . 1 1 141 141 ARG H H 141 7.620 7.620 8.688 -1.068 25342 12503 1 15 . 1 1 142 142 ASP N N 142 125.999 125.999 120.268 5.731 25342 12504 1 15 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.408 -0.684 25342 12505 1 15 . 1 1 142 142 ASP C C 142 169.292 169.292 176.113 -6.821 25342 12506 1 15 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.236 -2.898 25342 12507 1 15 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.483 -3.806 25342 12508 1 15 . 1 1 142 142 ASP H H 142 9.482 9.482 9.143 0.339 25342 12509 1 15 . 1 1 143 143 ASP N N 143 119.293 119.293 119.735 -0.442 25342 12510 1 15 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.514 -0.208 25342 12511 1 15 . 1 1 143 143 ASP C C 143 175.686 175.686 176.677 -0.991 25342 12512 1 15 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.577 -4.672 25342 12513 1 15 . 1 1 143 143 ASP CB C 143 36.312 36.312 39.842 -3.530 25342 12514 1 15 . 1 1 143 143 ASP H H 143 8.108 8.108 8.621 -0.513 25342 12515 1 15 . 1 1 144 144 SER N N 144 115.303 115.303 115.533 -0.230 25342 12516 1 15 . 1 1 144 144 SER HA H 144 3.740 3.740 4.324 -0.584 25342 12517 1 15 . 1 1 144 144 SER C C 144 172.925 172.925 174.753 -1.828 25342 12518 1 15 . 1 1 144 144 SER CA C 144 59.213 59.213 59.748 -0.535 25342 12519 1 15 . 1 1 144 144 SER CB C 144 60.806 60.806 63.225 -2.419 25342 12520 1 15 . 1 1 144 144 SER H H 144 7.642 7.642 7.935 -0.293 25342 12521 1 15 . 1 1 145 145 GLU N N 145 119.523 119.523 119.660 -0.137 25342 12522 1 15 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.184 0.122 25342 12523 1 15 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.406 -3.367 25342 12524 1 15 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.248 -2.448 25342 12525 1 15 . 1 1 145 145 GLU H H 145 7.771 7.771 8.088 -0.317 25342 12526 1 15 . 1 1 146 146 VAL N N 146 118.683 118.683 120.388 -1.705 25342 12527 1 15 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.518 -0.577 25342 12528 1 15 . 1 1 146 146 VAL C C 146 174.591 174.591 177.305 -2.714 25342 12529 1 15 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.495 -2.563 25342 12530 1 15 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.482 -2.435 25342 12531 1 15 . 1 1 146 146 VAL H H 146 6.352 6.352 7.148 -0.796 25342 12532 1 15 . 1 1 147 147 ASP N N 147 119.312 119.312 117.820 1.492 25342 12533 1 15 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.345 -0.290 25342 12534 1 15 . 1 1 147 147 ASP C C 147 174.783 174.783 176.980 -2.197 25342 12535 1 15 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.554 -2.313 25342 12536 1 15 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.586 -3.353 25342 12537 1 15 . 1 1 147 147 ASP H H 147 8.370 8.370 8.700 -0.330 25342 12538 1 15 . 1 1 148 148 LYS N N 148 119.342 119.342 116.631 2.711 25342 12539 1 15 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.476 -0.539 25342 12540 1 15 . 1 1 148 148 LYS C C 148 176.384 176.384 177.255 -0.871 25342 12541 1 15 . 1 1 148 148 LYS CA C 148 55.706 55.706 56.624 -0.918 25342 12542 1 15 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.617 -3.106 25342 12543 1 15 . 1 1 148 148 LYS H H 148 7.040 7.040 7.482 -0.442 25342 12544 1 15 . 1 1 149 149 TRP N N 149 118.258 118.258 119.079 -0.821 25342 12545 1 15 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.947 -0.356 25342 12546 1 15 . 1 1 149 149 TRP C C 149 174.212 174.212 176.416 -2.204 25342 12547 1 15 . 1 1 149 149 TRP CA C 149 53.745 53.745 54.663 -0.918 25342 12548 1 15 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.994 -2.054 25342 12549 1 15 . 1 1 149 149 TRP H H 149 7.811 7.811 7.583 0.228 25342 12550 1 15 . 1 1 150 150 SER N N 150 109.618 109.618 113.493 -3.875 25342 12551 1 15 . 1 1 150 150 SER HA H 150 4.234 4.234 4.656 -0.422 25342 12552 1 15 . 1 1 150 150 SER C C 150 170.189 170.189 173.830 -3.641 25342 12553 1 15 . 1 1 150 150 SER CA C 150 56.695 56.695 57.816 -1.121 25342 12554 1 15 . 1 1 150 150 SER CB C 150 61.935 61.935 63.392 -1.456 25342 12555 1 15 . 1 1 150 150 SER H H 150 7.793 7.793 7.871 -0.078 25342 12556 1 16 . 1 1 3 3 ALA N N 3 125.638 125.638 125.126 0.512 25342 12557 1 16 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.631 -0.266 25342 12558 1 16 . 1 1 3 3 ALA CA C 3 49.298 49.298 51.959 -2.662 25342 12559 1 16 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.884 -3.025 25342 12560 1 16 . 1 1 3 3 ALA H H 3 8.325 8.325 8.353 -0.028 25342 12561 1 16 . 1 1 4 4 LYS N N 4 121.813 121.813 117.653 4.160 25342 12562 1 16 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.499 -0.272 25342 12563 1 16 . 1 1 4 4 LYS C C 4 174.574 174.574 174.548 0.026 25342 12564 1 16 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.007 -1.226 25342 12565 1 16 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.124 -0.634 25342 12566 1 16 . 1 1 4 4 LYS H H 4 8.486 8.486 7.723 0.763 25342 12567 1 16 . 1 1 5 5 LYS N N 5 129.722 129.722 122.731 6.991 25342 12568 1 16 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.698 -0.180 25342 12569 1 16 . 1 1 5 5 LYS C C 5 174.720 174.720 175.000 -0.280 25342 12570 1 16 . 1 1 5 5 LYS CA C 5 54.722 54.722 54.856 -0.134 25342 12571 1 16 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.350 -6.566 25342 12572 1 16 . 1 1 5 5 LYS H H 5 10.015 10.015 8.230 1.785 25342 12573 1 16 . 1 1 6 6 THR N N 6 126.254 126.254 116.926 9.328 25342 12574 1 16 . 1 1 6 6 THR HA H 6 5.654 5.654 5.470 0.184 25342 12575 1 16 . 1 1 6 6 THR C C 6 169.926 169.926 172.928 -3.002 25342 12576 1 16 . 1 1 6 6 THR CA C 6 60.598 60.598 62.069 -1.470 25342 12577 1 16 . 1 1 6 6 THR CB C 6 68.041 68.041 71.767 -3.726 25342 12578 1 16 . 1 1 6 6 THR H H 6 8.538 8.538 8.854 -0.316 25342 12579 1 16 . 1 1 7 7 LEU N N 7 130.775 130.775 127.520 3.255 25342 12580 1 16 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.888 -0.294 25342 12581 1 16 . 1 1 7 7 LEU C C 7 170.404 170.404 174.203 -3.799 25342 12582 1 16 . 1 1 7 7 LEU CA C 7 49.933 49.933 52.707 -2.774 25342 12583 1 16 . 1 1 7 7 LEU CB C 7 40.728 40.728 46.035 -5.307 25342 12584 1 16 . 1 1 7 7 LEU H H 7 8.575 8.575 8.580 -0.005 25342 12585 1 16 . 1 1 8 8 ILE N N 8 127.242 127.242 122.127 5.115 25342 12586 1 16 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.681 0.167 25342 12587 1 16 . 1 1 8 8 ILE C C 8 170.936 170.936 174.348 -3.412 25342 12588 1 16 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.454 -3.202 25342 12589 1 16 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.339 -3.404 25342 12590 1 16 . 1 1 8 8 ILE H H 8 9.217 9.217 8.039 1.178 25342 12591 1 16 . 1 1 9 9 LEU N N 9 127.183 127.183 127.808 -0.625 25342 12592 1 16 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.633 1.061 25342 12593 1 16 . 1 1 9 9 LEU C C 9 173.824 173.824 175.438 -1.614 25342 12594 1 16 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.779 -3.940 25342 12595 1 16 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.029 1.935 25342 12596 1 16 . 1 1 9 9 LEU H H 9 9.248 9.248 8.853 0.395 25342 12597 1 16 . 1 1 10 10 TYR N N 10 113.330 113.330 120.436 -7.106 25342 12598 1 16 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.295 0.219 25342 12599 1 16 . 1 1 10 10 TYR C C 10 167.898 167.898 173.672 -5.774 25342 12600 1 16 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.514 -0.639 25342 12601 1 16 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.472 -2.036 25342 12602 1 16 . 1 1 10 10 TYR H H 10 7.306 7.306 7.364 -0.058 25342 12603 1 16 . 1 1 11 11 TYR N N 11 121.297 121.297 122.448 -1.151 25342 12604 1 16 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.484 -0.722 25342 12605 1 16 . 1 1 11 11 TYR C C 11 169.698 169.698 175.284 -5.586 25342 12606 1 16 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.497 -1.450 25342 12607 1 16 . 1 1 11 11 TYR CB C 11 40.538 40.538 40.745 -0.207 25342 12608 1 16 . 1 1 11 11 TYR H H 11 7.891 7.891 8.618 -0.727 25342 12609 1 16 . 1 1 12 12 SER N N 12 117.763 117.763 122.536 -4.773 25342 12610 1 16 . 1 1 12 12 SER HA H 12 4.679 4.679 4.228 0.451 25342 12611 1 16 . 1 1 12 12 SER C C 12 170.075 170.075 173.569 -3.494 25342 12612 1 16 . 1 1 12 12 SER CA C 12 53.619 53.619 57.229 -3.610 25342 12613 1 16 . 1 1 12 12 SER CB C 12 62.847 62.847 63.511 -0.664 25342 12614 1 16 . 1 1 12 12 SER H H 12 7.557 7.557 8.290 -0.733 25342 12615 1 16 . 1 1 13 13 TRP N N 13 135.232 135.232 129.877 5.355 25342 12616 1 16 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.958 0.678 25342 12617 1 16 . 1 1 13 13 TRP C C 13 175.708 175.708 175.668 0.040 25342 12618 1 16 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.515 -1.399 25342 12619 1 16 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.320 -1.685 25342 12620 1 16 . 1 1 13 13 TRP H H 13 9.755 9.755 7.968 1.787 25342 12621 1 16 . 1 1 14 14 SER N N 14 113.789 113.789 110.776 3.013 25342 12622 1 16 . 1 1 14 14 SER HA H 14 4.223 4.223 4.439 -0.216 25342 12623 1 16 . 1 1 14 14 SER C C 14 172.747 172.747 173.691 -0.944 25342 12624 1 16 . 1 1 14 14 SER CA C 14 53.828 53.828 58.356 -4.528 25342 12625 1 16 . 1 1 14 14 SER CB C 14 60.037 60.037 64.183 -4.146 25342 12626 1 16 . 1 1 14 14 SER H H 14 10.026 10.026 8.352 1.674 25342 12627 1 16 . 1 1 15 15 GLY N N 15 110.489 110.489 108.315 2.174 25342 12628 1 16 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.556 -0.897 25342 12629 1 16 . 1 1 15 15 GLY H H 15 7.391 7.391 8.071 -0.680 25342 12630 1 16 . 1 1 16 16 GLU N N 16 129.005 129.005 119.356 9.649 25342 12631 1 16 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.552 -0.489 25342 12632 1 16 . 1 1 16 16 GLU CA C 16 56.761 56.761 56.810 -0.049 25342 12633 1 16 . 1 1 16 16 GLU CB C 16 26.412 26.412 30.159 -3.747 25342 12634 1 16 . 1 1 16 16 GLU H H 16 11.550 11.550 8.235 3.315 25342 12635 1 16 . 1 1 17 17 THR N N 17 123.016 123.016 117.027 5.989 25342 12636 1 16 . 1 1 17 17 THR HA H 17 4.035 4.035 4.021 0.014 25342 12637 1 16 . 1 1 17 17 THR C C 17 173.360 173.360 176.326 -2.966 25342 12638 1 16 . 1 1 17 17 THR CA C 17 64.303 64.303 65.563 -1.260 25342 12639 1 16 . 1 1 17 17 THR CB C 17 63.999 63.999 68.059 -4.060 25342 12640 1 16 . 1 1 17 17 THR H H 17 11.293 11.293 8.273 3.020 25342 12641 1 16 . 1 1 18 18 LYS N N 18 120.156 120.156 121.694 -1.538 25342 12642 1 16 . 1 1 18 18 LYS HA H 18 2.856 2.856 3.735 -0.879 25342 12643 1 16 . 1 1 18 18 LYS C C 18 173.901 173.901 178.046 -4.145 25342 12644 1 16 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.190 -2.356 25342 12645 1 16 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.085 -2.604 25342 12646 1 16 . 1 1 18 18 LYS H H 18 6.940 6.940 8.254 -1.314 25342 12647 1 16 . 1 1 19 19 LYS N N 19 117.237 117.237 118.142 -0.905 25342 12648 1 16 . 1 1 19 19 LYS HA H 19 3.923 3.923 3.910 0.013 25342 12649 1 16 . 1 1 19 19 LYS CA C 19 56.324 56.324 59.353 -3.029 25342 12650 1 16 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.189 -2.828 25342 12651 1 16 . 1 1 19 19 LYS H H 19 7.212 7.212 7.694 -0.482 25342 12652 1 16 . 1 1 20 20 MET N N 20 119.268 119.268 116.550 2.718 25342 12653 1 16 . 1 1 20 20 MET HA H 20 4.413 4.413 4.180 0.233 25342 12654 1 16 . 1 1 20 20 MET C C 20 173.625 173.625 177.139 -3.514 25342 12655 1 16 . 1 1 20 20 MET CA C 20 52.261 52.261 55.615 -3.354 25342 12656 1 16 . 1 1 20 20 MET CB C 20 26.680 26.680 31.848 -5.168 25342 12657 1 16 . 1 1 20 20 MET H H 20 7.600 7.600 7.779 -0.179 25342 12658 1 16 . 1 1 21 21 ALA N N 21 123.669 123.669 122.759 0.910 25342 12659 1 16 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.055 -0.573 25342 12660 1 16 . 1 1 21 21 ALA C C 21 176.628 176.628 179.245 -2.617 25342 12661 1 16 . 1 1 21 21 ALA CA C 21 52.374 52.374 54.910 -2.536 25342 12662 1 16 . 1 1 21 21 ALA CB C 21 16.495 16.495 17.985 -1.490 25342 12663 1 16 . 1 1 21 21 ALA H H 21 8.738 8.738 7.666 1.072 25342 12664 1 16 . 1 1 22 22 GLU N N 22 117.242 117.242 118.673 -1.431 25342 12665 1 16 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.856 -0.183 25342 12666 1 16 . 1 1 22 22 GLU C C 22 176.698 176.698 179.070 -2.372 25342 12667 1 16 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.328 -2.788 25342 12668 1 16 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.407 -2.973 25342 12669 1 16 . 1 1 22 22 GLU H H 22 7.959 7.959 7.710 0.249 25342 12670 1 16 . 1 1 23 23 LYS N N 23 123.302 123.302 119.256 4.046 25342 12671 1 16 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.018 -0.197 25342 12672 1 16 . 1 1 23 23 LYS C C 23 177.389 177.389 178.974 -1.585 25342 12673 1 16 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.361 -2.439 25342 12674 1 16 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.443 -2.929 25342 12675 1 16 . 1 1 23 23 LYS H H 23 7.703 7.703 7.525 0.178 25342 12676 1 16 . 1 1 24 24 ILE N N 24 122.208 122.208 118.334 3.874 25342 12677 1 16 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.694 -0.411 25342 12678 1 16 . 1 1 24 24 ILE C C 24 174.934 174.934 177.227 -2.293 25342 12679 1 16 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.519 -1.227 25342 12680 1 16 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.591 -2.853 25342 12681 1 16 . 1 1 24 24 ILE H H 24 8.535 8.535 7.362 1.173 25342 12682 1 16 . 1 1 25 25 ASN N N 25 118.640 118.640 116.962 1.678 25342 12683 1 16 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.429 -0.202 25342 12684 1 16 . 1 1 25 25 ASN C C 25 173.530 173.530 176.146 -2.616 25342 12685 1 16 . 1 1 25 25 ASN CA C 25 52.211 52.211 55.910 -3.699 25342 12686 1 16 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.780 -0.676 25342 12687 1 16 . 1 1 25 25 ASN H H 25 8.317 8.317 8.327 -0.010 25342 12688 1 16 . 1 1 26 26 SER N N 26 111.990 111.990 114.840 -2.850 25342 12689 1 16 . 1 1 26 26 SER HA H 26 4.153 4.153 4.377 -0.224 25342 12690 1 16 . 1 1 26 26 SER C C 26 172.110 172.110 175.456 -3.346 25342 12691 1 16 . 1 1 26 26 SER CA C 26 57.905 57.905 60.342 -2.437 25342 12692 1 16 . 1 1 26 26 SER CB C 26 60.655 60.655 63.916 -3.261 25342 12693 1 16 . 1 1 26 26 SER H H 26 7.369 7.369 7.626 -0.257 25342 12694 1 16 . 1 1 27 27 GLU N N 27 120.201 120.201 119.556 0.645 25342 12695 1 16 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.227 -0.126 25342 12696 1 16 . 1 1 27 27 GLU C C 27 173.673 173.673 177.691 -4.018 25342 12697 1 16 . 1 1 27 27 GLU CA C 27 54.235 54.235 57.233 -2.998 25342 12698 1 16 . 1 1 27 27 GLU CB C 27 26.601 26.601 29.910 -3.309 25342 12699 1 16 . 1 1 27 27 GLU H H 27 7.451 7.451 7.667 -0.216 25342 12700 1 16 . 1 1 28 28 ILE N N 28 118.762 118.762 120.486 -1.724 25342 12701 1 16 . 1 1 28 28 ILE HA H 28 4.199 4.199 3.904 0.295 25342 12702 1 16 . 1 1 28 28 ILE C C 28 172.487 172.487 176.784 -4.297 25342 12703 1 16 . 1 1 28 28 ILE CA C 28 57.732 57.732 61.900 -4.168 25342 12704 1 16 . 1 1 28 28 ILE CB C 28 35.738 35.738 38.740 -3.002 25342 12705 1 16 . 1 1 28 28 ILE H H 28 7.255 7.255 7.885 -0.630 25342 12706 1 16 . 1 1 29 29 LYS N N 29 130.563 130.563 122.581 7.982 25342 12707 1 16 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.187 -0.185 25342 12708 1 16 . 1 1 29 29 LYS C C 29 174.386 174.386 177.349 -2.963 25342 12709 1 16 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.756 -1.221 25342 12710 1 16 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.838 -3.252 25342 12711 1 16 . 1 1 29 29 LYS H H 29 8.564 8.564 8.250 0.314 25342 12712 1 16 . 1 1 30 30 ASP N N 30 119.357 119.357 120.297 -0.940 25342 12713 1 16 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.581 -0.179 25342 12714 1 16 . 1 1 30 30 ASP C C 30 172.570 172.570 175.862 -3.292 25342 12715 1 16 . 1 1 30 30 ASP CA C 30 53.436 53.436 55.008 -1.571 25342 12716 1 16 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.218 -2.474 25342 12717 1 16 . 1 1 30 30 ASP H H 30 8.920 8.920 8.725 0.195 25342 12718 1 16 . 1 1 31 31 SER N N 31 114.019 114.019 115.199 -1.180 25342 12719 1 16 . 1 1 31 31 SER HA H 31 4.782 4.782 4.550 0.232 25342 12720 1 16 . 1 1 31 31 SER C C 31 171.150 171.150 174.014 -2.864 25342 12721 1 16 . 1 1 31 31 SER CA C 31 55.551 55.551 58.426 -2.876 25342 12722 1 16 . 1 1 31 31 SER CB C 31 62.259 62.259 65.207 -2.948 25342 12723 1 16 . 1 1 31 31 SER H H 31 8.006 8.006 8.073 -0.067 25342 12724 1 16 . 1 1 32 32 GLU N N 32 121.455 121.455 120.610 0.845 25342 12725 1 16 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.554 0.186 25342 12726 1 16 . 1 1 32 32 GLU C C 32 171.185 171.185 174.795 -3.610 25342 12727 1 16 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.885 -3.804 25342 12728 1 16 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.199 -1.372 25342 12729 1 16 . 1 1 32 32 GLU H H 32 8.145 8.145 8.745 -0.600 25342 12730 1 16 . 1 1 33 33 LEU N N 33 126.176 126.176 122.156 4.020 25342 12731 1 16 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.472 0.834 25342 12732 1 16 . 1 1 33 33 LEU C C 33 173.365 173.365 175.666 -2.301 25342 12733 1 16 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.600 -3.160 25342 12734 1 16 . 1 1 33 33 LEU CB C 33 43.635 43.635 42.670 0.965 25342 12735 1 16 . 1 1 33 33 LEU H H 33 8.589 8.589 8.471 0.118 25342 12736 1 16 . 1 1 34 34 LYS N N 34 127.200 127.200 125.194 2.006 25342 12737 1 16 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.698 -0.102 25342 12738 1 16 . 1 1 34 34 LYS C C 34 169.622 169.622 174.380 -4.758 25342 12739 1 16 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.396 -2.067 25342 12740 1 16 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.255 -2.055 25342 12741 1 16 . 1 1 34 34 LYS H H 34 9.380 9.380 8.766 0.614 25342 12742 1 16 . 1 1 35 35 GLU N N 35 122.324 122.324 119.044 3.280 25342 12743 1 16 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.245 -1.912 25342 12744 1 16 . 1 1 35 35 GLU C C 35 172.734 172.734 175.173 -2.439 25342 12745 1 16 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.667 -2.055 25342 12746 1 16 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.933 -3.614 25342 12747 1 16 . 1 1 35 35 GLU H H 35 8.094 8.094 8.307 -0.213 25342 12748 1 16 . 1 1 36 36 VAL N N 36 126.781 126.781 118.746 8.035 25342 12749 1 16 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.610 -0.771 25342 12750 1 16 . 1 1 36 36 VAL C C 36 171.482 171.482 174.679 -3.197 25342 12751 1 16 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.544 -1.139 25342 12752 1 16 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.691 -6.343 25342 12753 1 16 . 1 1 36 36 VAL H H 36 8.660 8.660 8.884 -0.224 25342 12754 1 16 . 1 1 37 37 LYS N N 37 126.065 126.065 121.137 4.928 25342 12755 1 16 . 1 1 37 37 LYS HA H 37 4.965 4.965 5.133 -0.168 25342 12756 1 16 . 1 1 37 37 LYS C C 37 173.187 173.187 174.466 -1.279 25342 12757 1 16 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.941 -2.661 25342 12758 1 16 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.929 -3.008 25342 12759 1 16 . 1 1 37 37 LYS H H 37 7.809 7.809 7.966 -0.157 25342 12760 1 16 . 1 1 38 38 VAL N N 38 111.020 111.020 115.336 -4.316 25342 12761 1 16 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.921 -0.097 25342 12762 1 16 . 1 1 38 38 VAL C C 38 173.604 173.604 175.319 -1.715 25342 12763 1 16 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.043 -2.660 25342 12764 1 16 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.324 -1.948 25342 12765 1 16 . 1 1 38 38 VAL H H 38 8.305 8.305 8.303 0.002 25342 12766 1 16 . 1 1 39 39 SER N N 39 117.887 117.887 115.867 2.020 25342 12767 1 16 . 1 1 39 39 SER HA H 39 4.183 4.183 4.552 -0.369 25342 12768 1 16 . 1 1 39 39 SER C C 39 173.538 173.538 173.605 -0.067 25342 12769 1 16 . 1 1 39 39 SER CA C 39 56.279 56.279 58.499 -2.220 25342 12770 1 16 . 1 1 39 39 SER CB C 39 60.537 60.537 63.914 -3.377 25342 12771 1 16 . 1 1 39 39 SER H H 39 8.847 8.847 8.613 0.234 25342 12772 1 16 . 1 1 40 40 GLU N N 40 126.316 126.316 122.112 4.204 25342 12773 1 16 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.402 -0.248 25342 12774 1 16 . 1 1 40 40 GLU C C 40 174.586 174.586 176.939 -2.353 25342 12775 1 16 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.190 -0.378 25342 12776 1 16 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.910 -3.190 25342 12777 1 16 . 1 1 40 40 GLU H H 40 9.049 9.049 8.690 0.359 25342 12778 1 16 . 1 1 41 41 GLY N N 41 112.494 112.494 113.913 -1.419 25342 12779 1 16 . 1 1 41 41 GLY C C 41 171.994 171.994 175.433 -3.439 25342 12780 1 16 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.384 -2.922 25342 12781 1 16 . 1 1 41 41 GLY H H 41 8.780 8.780 8.897 -0.117 25342 12782 1 16 . 1 1 42 42 THR N N 42 118.631 118.631 115.583 3.048 25342 12783 1 16 . 1 1 42 42 THR HA H 42 3.582 3.582 3.748 -0.166 25342 12784 1 16 . 1 1 42 42 THR C C 42 171.225 171.225 174.028 -2.803 25342 12785 1 16 . 1 1 42 42 THR CA C 42 64.104 64.104 64.996 -0.892 25342 12786 1 16 . 1 1 42 42 THR CB C 42 65.914 65.914 68.951 -3.037 25342 12787 1 16 . 1 1 42 42 THR H H 42 7.737 7.737 8.070 -0.333 25342 12788 1 16 . 1 1 43 43 PHE N N 43 116.279 116.279 117.388 -1.109 25342 12789 1 16 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.632 0.388 25342 12790 1 16 . 1 1 43 43 PHE C C 43 170.141 170.141 174.025 -3.884 25342 12791 1 16 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.279 -3.807 25342 12792 1 16 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.501 -4.115 25342 12793 1 16 . 1 1 43 43 PHE H H 43 8.114 8.114 7.683 0.431 25342 12794 1 16 . 1 1 44 44 ASP N N 44 121.513 121.513 119.981 1.532 25342 12795 1 16 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.944 -0.093 25342 12796 1 16 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.678 -2.466 25342 12797 1 16 . 1 1 44 44 ASP CB C 44 44.385 44.385 43.928 0.457 25342 12798 1 16 . 1 1 44 44 ASP H H 44 7.774 7.774 8.448 -0.674 25342 12799 1 16 . 1 1 45 45 ALA N N 45 125.663 125.663 122.805 2.858 25342 12800 1 16 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.726 -0.515 25342 12801 1 16 . 1 1 45 45 ALA C C 45 175.139 175.139 176.374 -1.235 25342 12802 1 16 . 1 1 45 45 ALA CA C 45 51.436 51.436 51.661 -0.225 25342 12803 1 16 . 1 1 45 45 ALA CB C 45 16.232 16.232 18.621 -2.389 25342 12804 1 16 . 1 1 45 45 ALA H H 45 8.324 8.324 8.590 -0.266 25342 12805 1 16 . 1 1 46 46 ASP N N 46 119.288 119.288 120.878 -1.590 25342 12806 1 16 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.616 0.209 25342 12807 1 16 . 1 1 46 46 ASP C C 46 175.013 175.013 176.425 -1.412 25342 12808 1 16 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.174 -2.013 25342 12809 1 16 . 1 1 46 46 ASP CB C 46 41.233 41.233 43.200 -1.967 25342 12810 1 16 . 1 1 46 46 ASP H H 46 9.618 9.618 7.882 1.736 25342 12811 1 16 . 1 1 47 47 MET N N 47 127.347 127.347 114.283 13.064 25342 12812 1 16 . 1 1 47 47 MET HA H 47 3.456 3.456 4.703 -1.247 25342 12813 1 16 . 1 1 47 47 MET C C 47 173.605 173.605 174.891 -1.286 25342 12814 1 16 . 1 1 47 47 MET CA C 47 56.699 56.699 55.825 0.874 25342 12815 1 16 . 1 1 47 47 MET CB C 47 29.930 29.930 35.441 -5.511 25342 12816 1 16 . 1 1 47 47 MET H H 47 9.178 9.178 7.786 1.392 25342 12817 1 16 . 1 1 48 48 TYR N N 48 121.040 121.040 115.659 5.381 25342 12818 1 16 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.882 -1.010 25342 12819 1 16 . 1 1 48 48 TYR CA C 48 58.712 58.712 57.694 1.018 25342 12820 1 16 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.431 -4.793 25342 12821 1 16 . 1 1 48 48 TYR H H 48 7.881 7.881 8.061 -0.180 25342 12822 1 16 . 1 1 49 49 LYS N N 49 121.754 121.754 120.816 0.938 25342 12823 1 16 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.135 -0.030 25342 12824 1 16 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.983 -3.598 25342 12825 1 16 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.337 -3.173 25342 12826 1 16 . 1 1 49 49 LYS H H 49 8.365 8.365 8.541 -0.176 25342 12827 1 16 . 1 1 50 50 THR N N 50 117.557 117.557 108.751 8.806 25342 12828 1 16 . 1 1 50 50 THR HA H 50 3.586 3.586 4.264 -0.678 25342 12829 1 16 . 1 1 50 50 THR CA C 50 65.634 65.634 64.754 0.880 25342 12830 1 16 . 1 1 50 50 THR CB C 50 65.904 65.904 68.081 -2.177 25342 12831 1 16 . 1 1 50 50 THR H H 50 8.007 8.007 8.193 -0.186 25342 12832 1 16 . 1 1 51 51 SER N N 51 115.110 115.110 117.947 -2.837 25342 12833 1 16 . 1 1 51 51 SER HA H 51 3.974 3.974 4.280 -0.306 25342 12834 1 16 . 1 1 51 51 SER CA C 51 59.042 59.042 61.994 -2.952 25342 12835 1 16 . 1 1 51 51 SER CB C 51 59.835 59.835 63.472 -3.637 25342 12836 1 16 . 1 1 51 51 SER H H 51 7.606 7.606 7.803 -0.197 25342 12837 1 16 . 1 1 52 52 ASP N N 52 119.713 119.713 122.618 -2.905 25342 12838 1 16 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.483 -0.175 25342 12839 1 16 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.419 -2.893 25342 12840 1 16 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.968 -3.280 25342 12841 1 16 . 1 1 52 52 ASP H H 52 7.552 7.552 7.730 -0.178 25342 12842 1 16 . 1 1 53 53 ILE N N 53 121.982 121.982 119.289 2.693 25342 12843 1 16 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.637 0.085 25342 12844 1 16 . 1 1 53 53 ILE C C 53 175.325 175.325 177.890 -2.565 25342 12845 1 16 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.897 -3.353 25342 12846 1 16 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.957 -1.258 25342 12847 1 16 . 1 1 53 53 ILE H H 53 7.815 7.815 8.279 -0.464 25342 12848 1 16 . 1 1 54 54 ALA N N 54 121.552 121.552 121.144 0.408 25342 12849 1 16 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.194 0.123 25342 12850 1 16 . 1 1 54 54 ALA C C 54 177.475 177.475 179.733 -2.258 25342 12851 1 16 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.911 -2.889 25342 12852 1 16 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.564 -2.580 25342 12853 1 16 . 1 1 54 54 ALA H H 54 8.332 8.332 7.667 0.665 25342 12854 1 16 . 1 1 55 55 LEU N N 55 117.176 117.176 120.242 -3.066 25342 12855 1 16 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.963 -0.029 25342 12856 1 16 . 1 1 55 55 LEU C C 55 176.532 176.532 178.261 -1.729 25342 12857 1 16 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.952 -2.621 25342 12858 1 16 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.160 -2.732 25342 12859 1 16 . 1 1 55 55 LEU H H 55 8.195 8.195 8.089 0.106 25342 12860 1 16 . 1 1 56 56 ASP N N 56 120.056 120.056 119.782 0.274 25342 12861 1 16 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.280 0.187 25342 12862 1 16 . 1 1 56 56 ASP C C 56 176.585 176.585 178.618 -2.033 25342 12863 1 16 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.467 -2.917 25342 12864 1 16 . 1 1 56 56 ASP CB C 56 38.305 38.305 41.024 -2.719 25342 12865 1 16 . 1 1 56 56 ASP H H 56 7.806 7.806 8.558 -0.752 25342 12866 1 16 . 1 1 57 57 GLN N N 57 120.020 120.020 117.628 2.392 25342 12867 1 16 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.138 -0.015 25342 12868 1 16 . 1 1 57 57 GLN C C 57 175.689 175.689 178.158 -2.469 25342 12869 1 16 . 1 1 57 57 GLN CA C 57 54.405 54.405 57.737 -3.332 25342 12870 1 16 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.938 -5.169 25342 12871 1 16 . 1 1 57 57 GLN H H 57 7.661 7.661 7.840 -0.179 25342 12872 1 16 . 1 1 58 58 ILE N N 58 120.644 120.644 119.793 0.851 25342 12873 1 16 . 1 1 58 58 ILE HA H 58 3.576 3.576 3.826 -0.250 25342 12874 1 16 . 1 1 58 58 ILE C C 58 176.237 176.237 177.402 -1.165 25342 12875 1 16 . 1 1 58 58 ILE CA C 58 62.506 62.506 63.975 -1.470 25342 12876 1 16 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.446 -2.417 25342 12877 1 16 . 1 1 58 58 ILE H H 58 8.228 8.228 7.854 0.374 25342 12878 1 16 . 1 1 59 59 GLN N N 59 115.498 115.498 117.033 -1.535 25342 12879 1 16 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.119 0.023 25342 12880 1 16 . 1 1 59 59 GLN C C 59 173.781 173.781 177.342 -3.561 25342 12881 1 16 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.422 -3.439 25342 12882 1 16 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.393 -2.782 25342 12883 1 16 . 1 1 59 59 GLN H H 59 8.331 8.331 8.107 0.224 25342 12884 1 16 . 1 1 60 60 GLY N N 60 106.623 106.623 105.852 0.771 25342 12885 1 16 . 1 1 60 60 GLY C C 60 172.068 172.068 175.445 -3.377 25342 12886 1 16 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.539 -2.666 25342 12887 1 16 . 1 1 60 60 GLY H H 60 7.611 7.611 8.060 -0.449 25342 12888 1 16 . 1 1 61 61 ASN N N 61 117.691 117.691 118.113 -0.422 25342 12889 1 16 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.534 0.010 25342 12890 1 16 . 1 1 61 61 ASN C C 61 171.946 171.946 175.771 -3.825 25342 12891 1 16 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.802 -3.233 25342 12892 1 16 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.749 -2.389 25342 12893 1 16 . 1 1 61 61 ASN H H 61 8.151 8.151 8.278 -0.127 25342 12894 1 16 . 1 1 62 62 LYS N N 62 118.289 118.289 117.993 0.296 25342 12895 1 16 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.608 -0.280 25342 12896 1 16 . 1 1 62 62 LYS C C 62 171.773 171.773 174.708 -2.935 25342 12897 1 16 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.462 -3.166 25342 12898 1 16 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.344 -0.661 25342 12899 1 16 . 1 1 62 62 LYS H H 62 7.242 7.242 7.596 -0.354 25342 12900 1 16 . 1 1 63 63 ASP N N 63 119.888 119.888 118.918 0.970 25342 12901 1 16 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.452 -0.036 25342 12902 1 16 . 1 1 63 63 ASP C C 63 174.476 174.476 175.137 -0.661 25342 12903 1 16 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.907 -2.446 25342 12904 1 16 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.572 -3.057 25342 12905 1 16 . 1 1 63 63 ASP H H 63 8.230 8.230 8.340 -0.110 25342 12906 1 16 . 1 1 64 64 PHE N N 64 119.789 119.789 114.189 5.600 25342 12907 1 16 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.767 -0.951 25342 12908 1 16 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.370 1.880 25342 12909 1 16 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.944 -3.910 25342 12910 1 16 . 1 1 64 64 PHE H H 64 8.428 8.428 7.557 0.871 25342 12911 1 16 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.436 -0.123 25342 12912 1 16 . 1 1 65 65 PRO C C 65 173.975 173.975 175.559 -1.584 25342 12913 1 16 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.781 -2.725 25342 12914 1 16 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.687 -3.167 25342 12915 1 16 . 1 1 66 66 GLU N N 66 121.326 121.326 117.972 3.354 25342 12916 1 16 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.662 -0.429 25342 12917 1 16 . 1 1 66 66 GLU C C 66 173.978 173.978 176.276 -2.298 25342 12918 1 16 . 1 1 66 66 GLU CA C 66 53.531 53.531 54.487 -0.957 25342 12919 1 16 . 1 1 66 66 GLU CB C 66 27.700 27.700 32.007 -4.307 25342 12920 1 16 . 1 1 66 66 GLU H H 66 8.225 8.225 8.282 -0.057 25342 12921 1 16 . 1 1 67 67 ILE N N 67 113.897 113.897 114.592 -0.695 25342 12922 1 16 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.873 0.296 25342 12923 1 16 . 1 1 67 67 ILE C C 67 172.791 172.791 175.605 -2.814 25342 12924 1 16 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.271 -2.996 25342 12925 1 16 . 1 1 67 67 ILE CB C 67 39.016 39.016 40.251 -1.235 25342 12926 1 16 . 1 1 67 67 ILE H H 67 8.366 8.366 8.134 0.232 25342 12927 1 16 . 1 1 68 68 GLN N N 68 121.654 121.654 121.608 0.046 25342 12928 1 16 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.666 -0.147 25342 12929 1 16 . 1 1 68 68 GLN C C 68 171.562 171.562 174.325 -2.763 25342 12930 1 16 . 1 1 68 68 GLN CA C 68 52.313 52.313 55.045 -2.732 25342 12931 1 16 . 1 1 68 68 GLN CB C 68 26.785 26.785 30.236 -3.451 25342 12932 1 16 . 1 1 68 68 GLN H H 68 8.763 8.763 8.364 0.399 25342 12933 1 16 . 1 1 69 69 LEU N N 69 125.289 125.289 123.681 1.608 25342 12934 1 16 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.675 -0.156 25342 12935 1 16 . 1 1 69 69 LEU C C 69 172.567 172.567 174.941 -2.374 25342 12936 1 16 . 1 1 69 69 LEU CA C 69 51.797 51.797 55.075 -3.278 25342 12937 1 16 . 1 1 69 69 LEU CB C 69 42.742 42.742 45.093 -2.351 25342 12938 1 16 . 1 1 69 69 LEU H H 69 7.996 7.996 8.366 -0.370 25342 12939 1 16 . 1 1 70 70 ASP N N 70 123.170 123.170 121.815 1.355 25342 12940 1 16 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.828 -0.422 25342 12941 1 16 . 1 1 70 70 ASP C C 70 171.978 171.978 174.794 -2.816 25342 12942 1 16 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.085 -2.403 25342 12943 1 16 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.833 -3.104 25342 12944 1 16 . 1 1 70 70 ASP H H 70 8.278 8.278 8.382 -0.104 25342 12945 1 16 . 1 1 71 71 ASN N N 71 117.524 117.524 118.597 -1.073 25342 12946 1 16 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.695 -0.368 25342 12947 1 16 . 1 1 71 71 ASN C C 71 171.825 171.825 174.793 -2.968 25342 12948 1 16 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.512 -1.855 25342 12949 1 16 . 1 1 71 71 ASN CB C 71 35.230 35.230 39.421 -4.191 25342 12950 1 16 . 1 1 71 71 ASN H H 71 8.372 8.372 8.388 -0.016 25342 12951 1 16 . 1 1 72 72 ILE N N 72 124.515 124.515 122.508 2.007 25342 12952 1 16 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.096 -0.167 25342 12953 1 16 . 1 1 72 72 ILE C C 72 171.607 171.607 174.069 -2.462 25342 12954 1 16 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.702 -2.413 25342 12955 1 16 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.524 -2.764 25342 12956 1 16 . 1 1 72 72 ILE H H 72 7.653 7.653 7.835 -0.182 25342 12957 1 16 . 1 1 73 73 ASP N N 73 125.182 125.182 125.179 0.003 25342 12958 1 16 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.612 0.016 25342 12959 1 16 . 1 1 73 73 ASP C C 73 173.980 173.980 176.488 -2.508 25342 12960 1 16 . 1 1 73 73 ASP CA C 73 49.214 49.214 53.873 -4.659 25342 12961 1 16 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.232 -3.330 25342 12962 1 16 . 1 1 73 73 ASP H H 73 8.382 8.382 8.519 -0.137 25342 12963 1 16 . 1 1 74 74 TYR N N 74 123.092 123.092 124.252 -1.160 25342 12964 1 16 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.613 -0.748 25342 12965 1 16 . 1 1 74 74 TYR C C 74 173.582 173.582 177.194 -3.612 25342 12966 1 16 . 1 1 74 74 TYR CA C 74 59.486 59.486 59.017 0.469 25342 12967 1 16 . 1 1 74 74 TYR CB C 74 34.808 34.808 37.836 -3.028 25342 12968 1 16 . 1 1 74 74 TYR H H 74 7.348 7.348 8.039 -0.691 25342 12969 1 16 . 1 1 75 75 ASN N N 75 109.447 109.447 117.538 -8.091 25342 12970 1 16 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.712 0.213 25342 12971 1 16 . 1 1 75 75 ASN C C 75 172.570 172.570 176.177 -3.607 25342 12972 1 16 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.176 -2.558 25342 12973 1 16 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.245 -2.711 25342 12974 1 16 . 1 1 75 75 ASN H H 75 8.040 8.040 8.447 -0.407 25342 12975 1 16 . 1 1 76 76 ASN N N 76 117.411 117.411 116.039 1.372 25342 12976 1 16 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.607 -0.153 25342 12977 1 16 . 1 1 76 76 ASN C C 76 171.155 171.155 174.809 -3.654 25342 12978 1 16 . 1 1 76 76 ASN CA C 76 50.934 50.934 54.313 -3.379 25342 12979 1 16 . 1 1 76 76 ASN CB C 76 35.658 35.658 39.020 -3.362 25342 12980 1 16 . 1 1 76 76 ASN H H 76 7.750 7.750 7.813 -0.063 25342 12981 1 16 . 1 1 77 77 TYR N N 77 116.878 116.878 119.355 -2.477 25342 12982 1 16 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.642 -0.288 25342 12983 1 16 . 1 1 77 77 TYR C C 77 172.224 172.224 175.237 -3.013 25342 12984 1 16 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.709 -3.469 25342 12985 1 16 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.066 -1.952 25342 12986 1 16 . 1 1 77 77 TYR H H 77 7.789 7.789 7.492 0.297 25342 12987 1 16 . 1 1 78 78 ASP N N 78 121.352 121.352 122.880 -1.528 25342 12988 1 16 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.519 0.278 25342 12989 1 16 . 1 1 78 78 ASP C C 78 172.623 172.623 175.446 -2.823 25342 12990 1 16 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.821 -3.631 25342 12991 1 16 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.263 -1.228 25342 12992 1 16 . 1 1 78 78 ASP H H 78 9.036 9.036 9.014 0.022 25342 12993 1 16 . 1 1 79 79 LEU N N 79 123.073 123.073 116.731 6.342 25342 12994 1 16 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.510 -0.402 25342 12995 1 16 . 1 1 79 79 LEU C C 79 170.730 170.730 174.420 -3.690 25342 12996 1 16 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.367 -3.110 25342 12997 1 16 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.293 -4.009 25342 12998 1 16 . 1 1 79 79 LEU H H 79 7.877 7.877 7.724 0.153 25342 12999 1 16 . 1 1 80 80 ILE N N 80 126.348 126.348 124.124 2.224 25342 13000 1 16 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.864 0.205 25342 13001 1 16 . 1 1 80 80 ILE C C 80 171.584 171.584 174.333 -2.749 25342 13002 1 16 . 1 1 80 80 ILE CA C 80 57.415 57.415 59.929 -2.514 25342 13003 1 16 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.408 -2.410 25342 13004 1 16 . 1 1 80 80 ILE H H 80 8.704 8.704 8.451 0.253 25342 13005 1 16 . 1 1 81 81 LEU N N 81 126.303 126.303 127.569 -1.266 25342 13006 1 16 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.961 0.162 25342 13007 1 16 . 1 1 81 81 LEU C C 81 172.779 172.779 175.751 -2.972 25342 13008 1 16 . 1 1 81 81 LEU CA C 81 49.509 49.509 53.997 -4.488 25342 13009 1 16 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.779 -2.064 25342 13010 1 16 . 1 1 81 81 LEU H H 81 9.202 9.202 8.482 0.720 25342 13011 1 16 . 1 1 82 82 ILE N N 82 120.931 120.931 120.003 0.928 25342 13012 1 16 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.748 0.099 25342 13013 1 16 . 1 1 82 82 ILE C C 82 172.796 172.796 174.003 -1.207 25342 13014 1 16 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.573 -2.692 25342 13015 1 16 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.185 -4.388 25342 13016 1 16 . 1 1 82 82 ILE H H 82 8.846 8.846 8.603 0.243 25342 13017 1 16 . 1 1 83 83 GLY N N 83 120.905 120.905 111.372 9.533 25342 13018 1 16 . 1 1 83 83 GLY CA C 83 40.557 40.557 42.728 -2.171 25342 13019 1 16 . 1 1 83 83 GLY H H 83 9.558 9.558 7.929 1.629 25342 13020 1 16 . 1 1 84 84 SER N N 84 116.601 116.601 116.101 0.500 25342 13021 1 16 . 1 1 84 84 SER HA H 84 5.476 5.476 5.131 0.345 25342 13022 1 16 . 1 1 84 84 SER CA C 84 51.324 51.324 55.454 -4.130 25342 13023 1 16 . 1 1 84 84 SER CB C 84 64.271 64.271 65.688 -1.417 25342 13024 1 16 . 1 1 84 84 SER H H 84 7.533 7.533 7.220 0.313 25342 13025 1 16 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.363 0.800 25342 13026 1 16 . 1 1 85 85 PRO C C 85 175.590 175.590 176.110 -0.520 25342 13027 1 16 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.548 -3.665 25342 13028 1 16 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.154 -1.680 25342 13029 1 16 . 1 1 86 86 VAL N N 86 116.295 116.295 120.023 -3.728 25342 13030 1 16 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.260 -0.439 25342 13031 1 16 . 1 1 86 86 VAL C C 86 172.692 172.692 176.232 -3.540 25342 13032 1 16 . 1 1 86 86 VAL CA C 86 59.812 59.812 62.239 -2.427 25342 13033 1 16 . 1 1 86 86 VAL CB C 86 30.083 30.083 31.340 -1.257 25342 13034 1 16 . 1 1 86 86 VAL H H 86 7.246 7.246 7.647 -0.401 25342 13035 1 16 . 1 1 87 87 TRP N N 87 131.042 131.042 129.078 1.964 25342 13036 1 16 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.513 -0.202 25342 13037 1 16 . 1 1 87 87 TRP C C 87 173.323 173.323 177.670 -4.347 25342 13038 1 16 . 1 1 87 87 TRP CA C 87 50.887 50.887 57.240 -6.353 25342 13039 1 16 . 1 1 87 87 TRP CB C 87 27.310 27.310 30.895 -3.585 25342 13040 1 16 . 1 1 87 87 TRP H H 87 9.555 9.555 8.094 1.461 25342 13041 1 16 . 1 1 88 88 SER N N 88 122.660 122.660 116.189 6.471 25342 13042 1 16 . 1 1 88 88 SER HA H 88 4.582 4.582 4.228 0.354 25342 13043 1 16 . 1 1 88 88 SER C C 88 172.096 172.096 174.644 -2.548 25342 13044 1 16 . 1 1 88 88 SER CA C 88 55.391 55.391 60.155 -4.764 25342 13045 1 16 . 1 1 88 88 SER CB C 88 57.813 57.813 62.461 -4.648 25342 13046 1 16 . 1 1 88 88 SER H H 88 10.257 10.257 9.053 1.204 25342 13047 1 16 . 1 1 89 89 GLY N N 89 128.381 128.381 106.625 21.756 25342 13048 1 16 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.178 -2.549 25342 13049 1 16 . 1 1 89 89 GLY H H 89 6.372 6.372 7.962 -1.590 25342 13050 1 16 . 1 1 90 90 TYR N N 90 120.345 120.345 117.865 2.480 25342 13051 1 16 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.488 -0.299 25342 13052 1 16 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.229 0.320 25342 13053 1 16 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.909 -1.714 25342 13054 1 16 . 1 1 90 90 TYR H H 90 8.113 8.113 7.444 0.669 25342 13055 1 16 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.559 0.275 25342 13056 1 16 . 1 1 91 91 PRO C C 91 170.911 170.911 176.962 -6.051 25342 13057 1 16 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.478 -3.643 25342 13058 1 16 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.077 -6.007 25342 13059 1 16 . 1 1 92 92 ALA N N 92 120.629 120.629 125.730 -5.101 25342 13060 1 16 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.393 0.226 25342 13061 1 16 . 1 1 92 92 ALA C C 92 176.782 176.782 176.711 0.071 25342 13062 1 16 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.757 -1.340 25342 13063 1 16 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.388 -1.872 25342 13064 1 16 . 1 1 92 92 ALA H H 92 7.554 7.554 8.770 -1.216 25342 13065 1 16 . 1 1 93 93 THR N N 93 112.558 112.558 110.172 2.386 25342 13066 1 16 . 1 1 93 93 THR CB C 93 64.173 64.173 67.361 -3.188 25342 13067 1 16 . 1 1 93 93 THR H H 93 6.730 6.730 7.588 -0.858 25342 13068 1 16 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.465 -0.606 25342 13069 1 16 . 1 1 94 94 PRO C C 94 173.309 173.309 176.796 -3.487 25342 13070 1 16 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.494 -1.431 25342 13071 1 16 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.237 -2.958 25342 13072 1 16 . 1 1 95 95 ILE N N 95 111.014 111.014 116.952 -5.938 25342 13073 1 16 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.395 -0.790 25342 13074 1 16 . 1 1 95 95 ILE C C 95 174.302 174.302 177.094 -2.792 25342 13075 1 16 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.538 -2.357 25342 13076 1 16 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.960 -5.177 25342 13077 1 16 . 1 1 95 95 ILE H H 95 7.995 7.995 8.007 -0.012 25342 13078 1 16 . 1 1 96 96 LYS N N 96 123.208 123.208 121.991 1.217 25342 13079 1 16 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.973 -0.881 25342 13080 1 16 . 1 1 96 96 LYS C C 96 174.451 174.451 178.364 -3.913 25342 13081 1 16 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.692 -2.651 25342 13082 1 16 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.744 -2.997 25342 13083 1 16 . 1 1 96 96 LYS H H 96 6.928 6.928 7.333 -0.405 25342 13084 1 16 . 1 1 97 97 THR N N 97 113.320 113.320 113.667 -0.347 25342 13085 1 16 . 1 1 97 97 THR HA H 97 3.436 3.436 4.279 -0.843 25342 13086 1 16 . 1 1 97 97 THR C C 97 173.221 173.221 176.248 -3.027 25342 13087 1 16 . 1 1 97 97 THR CA C 97 62.710 62.710 65.577 -2.867 25342 13088 1 16 . 1 1 97 97 THR CB C 97 65.562 65.562 68.615 -3.054 25342 13089 1 16 . 1 1 97 97 THR H H 97 6.325 6.325 8.106 -1.781 25342 13090 1 16 . 1 1 98 98 LEU N N 98 120.963 120.963 123.194 -2.231 25342 13091 1 16 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.112 -0.487 25342 13092 1 16 . 1 1 98 98 LEU C C 98 174.713 174.713 178.414 -3.701 25342 13093 1 16 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.748 -2.234 25342 13094 1 16 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.788 -2.060 25342 13095 1 16 . 1 1 98 98 LEU H H 98 7.536 7.536 7.653 -0.117 25342 13096 1 16 . 1 1 99 99 LEU N N 99 118.859 118.859 118.656 0.203 25342 13097 1 16 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.875 -0.203 25342 13098 1 16 . 1 1 99 99 LEU C C 99 177.458 177.458 178.779 -1.321 25342 13099 1 16 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.589 -3.444 25342 13100 1 16 . 1 1 99 99 LEU CB C 99 38.857 38.857 40.918 -2.061 25342 13101 1 16 . 1 1 99 99 LEU H H 99 8.179 8.179 8.499 -0.320 25342 13102 1 16 . 1 1 100 100 ASP N N 100 118.703 118.703 118.104 0.599 25342 13103 1 16 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.422 -0.201 25342 13104 1 16 . 1 1 100 100 ASP C C 100 176.472 176.472 178.327 -1.855 25342 13105 1 16 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.127 -2.821 25342 13106 1 16 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.431 -3.073 25342 13107 1 16 . 1 1 100 100 ASP H H 100 7.867 7.867 8.116 -0.249 25342 13108 1 16 . 1 1 101 101 GLN N N 101 117.829 117.829 116.684 1.145 25342 13109 1 16 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.277 -0.077 25342 13110 1 16 . 1 1 101 101 GLN C C 101 174.508 174.508 176.895 -2.387 25342 13111 1 16 . 1 1 101 101 GLN CA C 101 54.688 54.688 56.818 -2.130 25342 13112 1 16 . 1 1 101 101 GLN CB C 101 25.597 25.597 28.595 -2.998 25342 13113 1 16 . 1 1 101 101 GLN H H 101 7.597 7.597 7.887 -0.290 25342 13114 1 16 . 1 1 102 102 MET N N 102 118.406 118.406 114.109 4.297 25342 13115 1 16 . 1 1 102 102 MET HA H 102 3.864 3.864 5.204 -1.340 25342 13116 1 16 . 1 1 102 102 MET C C 102 172.820 172.820 176.703 -3.883 25342 13117 1 16 . 1 1 102 102 MET CA C 102 53.298 53.298 54.470 -1.172 25342 13118 1 16 . 1 1 102 102 MET CB C 102 31.207 31.207 33.982 -2.775 25342 13119 1 16 . 1 1 102 102 MET H H 102 7.434 7.434 7.655 -0.221 25342 13120 1 16 . 1 1 103 103 LYS N N 103 115.889 115.889 121.941 -6.052 25342 13121 1 16 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.168 -0.249 25342 13122 1 16 . 1 1 103 103 LYS C C 103 173.938 173.938 177.346 -3.408 25342 13123 1 16 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.353 -1.916 25342 13124 1 16 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.926 -2.663 25342 13125 1 16 . 1 1 103 103 LYS H H 103 6.881 6.881 7.851 -0.970 25342 13126 1 16 . 1 1 104 104 ASN N N 104 114.951 114.951 114.515 0.436 25342 13127 1 16 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.658 0.073 25342 13128 1 16 . 1 1 104 104 ASN C C 104 172.617 172.617 174.965 -2.348 25342 13129 1 16 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.004 -2.738 25342 13130 1 16 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.222 -2.439 25342 13131 1 16 . 1 1 104 104 ASN H H 104 8.493 8.493 8.235 0.258 25342 13132 1 16 . 1 1 105 105 TYR N N 105 122.680 122.680 122.928 -0.248 25342 13133 1 16 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.412 0.150 25342 13134 1 16 . 1 1 105 105 TYR CA C 105 55.433 55.433 59.700 -4.267 25342 13135 1 16 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.203 -3.371 25342 13136 1 16 . 1 1 105 105 TYR H H 105 8.217 8.217 7.793 0.424 25342 13137 1 16 . 1 1 106 106 ARG N N 106 128.872 128.872 123.772 5.100 25342 13138 1 16 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.433 -0.168 25342 13139 1 16 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.478 -2.496 25342 13140 1 16 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.047 -2.917 25342 13141 1 16 . 1 1 106 106 ARG H H 106 8.801 8.801 8.265 0.536 25342 13142 1 16 . 1 1 107 107 GLY CA C 107 42.401 42.401 43.321 -0.920 25342 13143 1 16 . 1 1 108 108 GLU N N 108 117.000 117.000 118.614 -1.614 25342 13144 1 16 . 1 1 108 108 GLU HA H 108 4.626 4.626 5.233 -0.607 25342 13145 1 16 . 1 1 108 108 GLU C C 108 174.125 174.125 176.481 -2.356 25342 13146 1 16 . 1 1 108 108 GLU CA C 108 53.788 53.788 54.926 -1.138 25342 13147 1 16 . 1 1 108 108 GLU CB C 108 30.440 30.440 32.459 -2.019 25342 13148 1 16 . 1 1 108 108 GLU H H 108 7.514 7.514 8.448 -0.934 25342 13149 1 16 . 1 1 109 109 VAL N N 109 123.398 123.398 120.349 3.049 25342 13150 1 16 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.102 0.235 25342 13151 1 16 . 1 1 109 109 VAL C C 109 170.606 170.606 173.693 -3.087 25342 13152 1 16 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.638 -3.358 25342 13153 1 16 . 1 1 109 109 VAL CB C 109 32.657 32.657 36.406 -3.749 25342 13154 1 16 . 1 1 109 109 VAL H H 109 8.942 8.942 8.374 0.568 25342 13155 1 16 . 1 1 110 110 ALA N N 110 127.905 127.905 126.432 1.473 25342 13156 1 16 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.153 -0.526 25342 13157 1 16 . 1 1 110 110 ALA C C 110 173.195 173.195 174.607 -1.412 25342 13158 1 16 . 1 1 110 110 ALA CA C 110 47.346 47.346 50.156 -2.810 25342 13159 1 16 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.299 -3.974 25342 13160 1 16 . 1 1 110 110 ALA H H 110 8.776 8.776 8.377 0.399 25342 13161 1 16 . 1 1 111 111 SER N N 111 110.523 110.523 117.001 -6.478 25342 13162 1 16 . 1 1 111 111 SER HA H 111 5.562 5.562 4.981 0.581 25342 13163 1 16 . 1 1 111 111 SER C C 111 170.719 170.719 173.253 -2.534 25342 13164 1 16 . 1 1 111 111 SER CA C 111 51.314 51.314 55.492 -4.178 25342 13165 1 16 . 1 1 111 111 SER CB C 111 61.907 61.907 63.290 -1.383 25342 13166 1 16 . 1 1 111 111 SER H H 111 7.480 7.480 8.212 -0.732 25342 13167 1 16 . 1 1 112 112 PHE N N 112 125.567 125.567 124.410 1.157 25342 13168 1 16 . 1 1 112 112 PHE HA H 112 6.356 6.356 4.940 1.416 25342 13169 1 16 . 1 1 112 112 PHE C C 112 169.536 169.536 173.281 -3.745 25342 13170 1 16 . 1 1 112 112 PHE CA C 112 50.371 50.371 56.148 -5.777 25342 13171 1 16 . 1 1 112 112 PHE CB C 112 39.788 39.788 40.088 -0.300 25342 13172 1 16 . 1 1 112 112 PHE H H 112 7.848 7.848 7.810 0.038 25342 13173 1 16 . 1 1 113 113 PHE N N 113 115.065 115.065 117.248 -2.183 25342 13174 1 16 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.265 0.839 25342 13175 1 16 . 1 1 113 113 PHE C C 113 173.006 173.006 174.890 -1.884 25342 13176 1 16 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.597 -6.335 25342 13177 1 16 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.828 -5.079 25342 13178 1 16 . 1 1 113 113 PHE H H 113 7.361 7.361 8.762 -1.401 25342 13179 1 16 . 1 1 114 114 THR N N 114 108.014 108.014 114.332 -6.318 25342 13180 1 16 . 1 1 114 114 THR HA H 114 4.999 4.999 4.727 0.272 25342 13181 1 16 . 1 1 114 114 THR C C 114 169.874 169.874 172.234 -2.360 25342 13182 1 16 . 1 1 114 114 THR CA C 114 56.500 56.500 61.044 -4.544 25342 13183 1 16 . 1 1 114 114 THR CB C 114 68.809 68.809 69.783 -0.974 25342 13184 1 16 . 1 1 114 114 THR H H 114 7.867 7.867 8.684 -0.817 25342 13185 1 16 . 1 1 115 115 SER N N 115 115.049 115.049 122.234 -7.185 25342 13186 1 16 . 1 1 115 115 SER HA H 115 5.613 5.613 4.706 0.907 25342 13187 1 16 . 1 1 115 115 SER C C 115 171.247 171.247 174.568 -3.321 25342 13188 1 16 . 1 1 115 115 SER CA C 115 54.830 54.830 57.503 -2.673 25342 13189 1 16 . 1 1 115 115 SER CB C 115 63.992 63.992 65.621 -1.629 25342 13190 1 16 . 1 1 115 115 SER H H 115 8.970 8.970 8.411 0.559 25342 13191 1 16 . 1 1 116 116 ALA N N 116 122.671 122.671 123.383 -0.712 25342 13192 1 16 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.402 0.583 25342 13193 1 16 . 1 1 116 116 ALA C C 116 176.180 176.180 177.830 -1.650 25342 13194 1 16 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.978 -2.779 25342 13195 1 16 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.984 -1.989 25342 13196 1 16 . 1 1 116 116 ALA H H 116 8.963 8.963 8.884 0.079 25342 13197 1 16 . 1 1 117 117 GLY N N 117 107.387 107.387 107.980 -0.593 25342 13198 1 16 . 1 1 117 117 GLY C C 117 172.528 172.528 173.948 -1.420 25342 13199 1 16 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.421 -1.689 25342 13200 1 16 . 1 1 117 117 GLY H H 117 9.340 9.340 7.908 1.432 25342 13201 1 16 . 1 1 118 118 THR N N 118 113.481 113.481 110.310 3.171 25342 13202 1 16 . 1 1 118 118 THR HA H 118 4.651 4.651 4.590 0.061 25342 13203 1 16 . 1 1 118 118 THR C C 118 172.067 172.067 173.904 -1.837 25342 13204 1 16 . 1 1 118 118 THR CA C 118 57.357 57.357 60.245 -2.888 25342 13205 1 16 . 1 1 118 118 THR CB C 118 69.475 69.475 70.982 -1.507 25342 13206 1 16 . 1 1 118 118 THR H H 118 9.373 9.373 7.461 1.912 25342 13207 1 16 . 1 1 119 119 ASN N N 119 113.202 113.202 115.103 -1.901 25342 13208 1 16 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.368 0.250 25342 13209 1 16 . 1 1 119 119 ASN C C 119 173.114 173.114 176.159 -3.045 25342 13210 1 16 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.608 -2.924 25342 13211 1 16 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.300 -3.570 25342 13212 1 16 . 1 1 119 119 ASN H H 119 8.908 8.908 8.851 0.057 25342 13213 1 16 . 1 1 120 120 HIS N N 120 117.315 117.315 117.406 -0.091 25342 13214 1 16 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.221 -0.435 25342 13215 1 16 . 1 1 120 120 HIS C C 120 174.381 174.381 176.996 -2.615 25342 13216 1 16 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.972 -4.457 25342 13217 1 16 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.611 -3.107 25342 13218 1 16 . 1 1 120 120 HIS H H 120 8.074 8.074 8.689 -0.615 25342 13219 1 16 . 1 1 121 121 LYS N N 121 118.678 118.678 119.035 -0.357 25342 13220 1 16 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.950 -0.116 25342 13221 1 16 . 1 1 121 121 LYS C C 121 176.564 176.564 178.682 -2.118 25342 13222 1 16 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.623 -1.329 25342 13223 1 16 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.792 -2.850 25342 13224 1 16 . 1 1 121 121 LYS H H 121 8.336 8.336 7.620 0.716 25342 13225 1 16 . 1 1 122 122 ALA N N 122 122.146 122.146 123.176 -1.030 25342 13226 1 16 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.032 -0.337 25342 13227 1 16 . 1 1 122 122 ALA C C 122 175.163 175.163 179.442 -4.279 25342 13228 1 16 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.931 -3.239 25342 13229 1 16 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.107 -2.389 25342 13230 1 16 . 1 1 122 122 ALA H H 122 7.584 7.584 7.431 0.153 25342 13231 1 16 . 1 1 123 123 TYR N N 123 119.730 119.730 119.121 0.609 25342 13232 1 16 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.028 -0.875 25342 13233 1 16 . 1 1 123 123 TYR C C 123 174.340 174.340 177.903 -3.563 25342 13234 1 16 . 1 1 123 123 TYR CA C 123 60.398 60.398 61.960 -1.562 25342 13235 1 16 . 1 1 123 123 TYR CB C 123 34.663 34.663 38.342 -3.679 25342 13236 1 16 . 1 1 123 123 TYR H H 123 7.317 7.317 8.154 -0.837 25342 13237 1 16 . 1 1 124 124 VAL N N 124 118.649 118.649 117.828 0.821 25342 13238 1 16 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.661 -0.459 25342 13239 1 16 . 1 1 124 124 VAL C C 124 175.603 175.603 178.321 -2.718 25342 13240 1 16 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.977 -2.297 25342 13241 1 16 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.677 -1.388 25342 13242 1 16 . 1 1 124 124 VAL H H 124 7.799 7.799 7.708 0.091 25342 13243 1 16 . 1 1 125 125 SER N N 125 114.475 114.475 115.457 -0.982 25342 13244 1 16 . 1 1 125 125 SER HA H 125 4.032 4.032 4.147 -0.115 25342 13245 1 16 . 1 1 125 125 SER C C 125 174.849 174.849 176.852 -2.003 25342 13246 1 16 . 1 1 125 125 SER CA C 125 59.002 59.002 62.609 -3.607 25342 13247 1 16 . 1 1 125 125 SER CB C 125 59.613 59.613 63.169 -3.556 25342 13248 1 16 . 1 1 125 125 SER H H 125 7.766 7.766 7.711 0.055 25342 13249 1 16 . 1 1 126 126 HIS N N 126 119.326 119.326 120.750 -1.424 25342 13250 1 16 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.077 0.050 25342 13251 1 16 . 1 1 126 126 HIS C C 126 172.865 172.865 177.828 -4.963 25342 13252 1 16 . 1 1 126 126 HIS CA C 126 55.706 55.706 58.932 -3.226 25342 13253 1 16 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.032 -4.039 25342 13254 1 16 . 1 1 126 126 HIS H H 126 8.569 8.569 8.153 0.416 25342 13255 1 16 . 1 1 127 127 PHE N N 127 121.044 121.044 120.025 1.019 25342 13256 1 16 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.339 -1.165 25342 13257 1 16 . 1 1 127 127 PHE C C 127 173.378 173.378 175.781 -2.403 25342 13258 1 16 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.901 -0.034 25342 13259 1 16 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.212 -3.158 25342 13260 1 16 . 1 1 127 127 PHE H H 127 9.139 9.139 8.701 0.438 25342 13261 1 16 . 1 1 128 128 ASN N N 128 114.893 114.893 117.204 -2.311 25342 13262 1 16 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.148 -0.108 25342 13263 1 16 . 1 1 128 128 ASN C C 128 175.230 175.230 177.335 -2.105 25342 13264 1 16 . 1 1 128 128 ASN CA C 128 54.300 54.300 55.817 -1.517 25342 13265 1 16 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.841 -2.670 25342 13266 1 16 . 1 1 128 128 ASN H H 128 7.774 7.774 7.542 0.232 25342 13267 1 16 . 1 1 129 129 GLU N N 129 119.804 119.804 120.358 -0.554 25342 13268 1 16 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.670 0.370 25342 13269 1 16 . 1 1 129 129 GLU C C 129 177.052 177.052 177.656 -0.604 25342 13270 1 16 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.908 -2.178 25342 13271 1 16 . 1 1 129 129 GLU CB C 129 27.196 27.196 28.889 -1.693 25342 13272 1 16 . 1 1 129 129 GLU H H 129 7.577 7.577 8.031 -0.454 25342 13273 1 16 . 1 1 130 130 TRP N N 130 120.979 120.979 117.871 3.108 25342 13274 1 16 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.612 -0.155 25342 13275 1 16 . 1 1 130 130 TRP C C 130 174.329 174.329 174.992 -0.663 25342 13276 1 16 . 1 1 130 130 TRP CA C 130 54.688 54.688 55.990 -1.302 25342 13277 1 16 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.288 -2.297 25342 13278 1 16 . 1 1 130 130 TRP H H 130 8.225 8.225 7.125 1.100 25342 13279 1 16 . 1 1 131 131 ALA N N 131 120.450 120.450 119.330 1.120 25342 13280 1 16 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.309 -0.373 25342 13281 1 16 . 1 1 131 131 ALA C C 131 172.487 172.487 176.693 -4.206 25342 13282 1 16 . 1 1 131 131 ALA CA C 131 48.434 48.434 52.386 -3.952 25342 13283 1 16 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.619 -3.332 25342 13284 1 16 . 1 1 131 131 ALA H H 131 8.081 8.081 7.990 0.091 25342 13285 1 16 . 1 1 132 132 ASP N N 132 117.813 117.813 121.465 -3.652 25342 13286 1 16 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.483 -0.275 25342 13287 1 16 . 1 1 132 132 ASP C C 132 173.804 173.804 176.941 -3.137 25342 13288 1 16 . 1 1 132 132 ASP CA C 132 54.181 54.181 54.208 -0.027 25342 13289 1 16 . 1 1 132 132 ASP CB C 132 39.321 39.321 39.596 -0.275 25342 13290 1 16 . 1 1 132 132 ASP H H 132 6.772 6.772 8.298 -1.526 25342 13291 1 16 . 1 1 133 133 GLY N N 133 115.052 115.052 107.525 7.527 25342 13292 1 16 . 1 1 133 133 GLY C C 133 172.078 172.078 174.263 -2.185 25342 13293 1 16 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.260 -2.840 25342 13294 1 16 . 1 1 133 133 GLY H H 133 8.626 8.626 7.898 0.728 25342 13295 1 16 . 1 1 134 134 LEU N N 134 120.063 120.063 119.072 0.991 25342 13296 1 16 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.777 -0.305 25342 13297 1 16 . 1 1 134 134 LEU C C 134 174.079 174.079 175.452 -1.373 25342 13298 1 16 . 1 1 134 134 LEU CA C 134 50.964 50.964 52.846 -1.882 25342 13299 1 16 . 1 1 134 134 LEU CB C 134 40.370 40.370 44.396 -4.026 25342 13300 1 16 . 1 1 134 134 LEU H H 134 8.094 8.094 7.367 0.727 25342 13301 1 16 . 1 1 135 135 ASN N N 135 119.292 119.292 120.882 -1.590 25342 13302 1 16 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.694 -0.071 25342 13303 1 16 . 1 1 135 135 ASN C C 135 170.527 170.527 174.550 -4.023 25342 13304 1 16 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.900 -3.898 25342 13305 1 16 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.731 -5.171 25342 13306 1 16 . 1 1 135 135 ASN H H 135 8.513 8.513 8.918 -0.405 25342 13307 1 16 . 1 1 136 136 VAL N N 136 125.412 125.412 125.797 -0.385 25342 13308 1 16 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.422 0.184 25342 13309 1 16 . 1 1 136 136 VAL C C 136 175.420 175.420 176.666 -1.246 25342 13310 1 16 . 1 1 136 136 VAL CA C 136 58.382 58.382 62.245 -3.863 25342 13311 1 16 . 1 1 136 136 VAL CB C 136 29.247 29.247 33.410 -4.163 25342 13312 1 16 . 1 1 136 136 VAL H H 136 7.648 7.648 8.083 -0.435 25342 13313 1 16 . 1 1 137 137 ILE N N 137 121.881 121.881 124.154 -2.273 25342 13314 1 16 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.611 -0.178 25342 13315 1 16 . 1 1 137 137 ILE C C 137 173.906 173.906 175.971 -2.065 25342 13316 1 16 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.422 -2.444 25342 13317 1 16 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.750 -2.554 25342 13318 1 16 . 1 1 137 137 ILE H H 137 9.139 9.139 8.976 0.163 25342 13319 1 16 . 1 1 138 138 GLY N N 138 108.226 108.226 107.757 0.469 25342 13320 1 16 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.423 -2.033 25342 13321 1 16 . 1 1 138 138 GLY H H 138 6.645 6.645 7.397 -0.752 25342 13322 1 16 . 1 1 139 139 VAL N N 139 119.408 119.408 118.648 0.760 25342 13323 1 16 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.258 0.099 25342 13324 1 16 . 1 1 139 139 VAL C C 139 172.327 172.327 173.655 -1.328 25342 13325 1 16 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.425 -2.159 25342 13326 1 16 . 1 1 139 139 VAL CB C 139 32.743 32.743 34.682 -1.939 25342 13327 1 16 . 1 1 139 139 VAL H H 139 8.092 8.092 8.747 -0.655 25342 13328 1 16 . 1 1 140 140 ALA N N 140 127.415 127.415 130.051 -2.636 25342 13329 1 16 . 1 1 140 140 ALA HA H 140 4.445 4.445 4.938 -0.493 25342 13330 1 16 . 1 1 140 140 ALA C C 140 170.718 170.718 175.354 -4.636 25342 13331 1 16 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.716 -2.816 25342 13332 1 16 . 1 1 140 140 ALA CB C 140 21.059 21.059 21.600 -0.541 25342 13333 1 16 . 1 1 140 140 ALA H H 140 9.093 9.093 8.928 0.165 25342 13334 1 16 . 1 1 141 141 ARG N N 141 119.287 119.287 119.101 0.186 25342 13335 1 16 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.127 -2.640 25342 13336 1 16 . 1 1 141 141 ARG C C 141 173.375 173.375 176.009 -2.634 25342 13337 1 16 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.592 -2.708 25342 13338 1 16 . 1 1 141 141 ARG CB C 141 28.684 28.684 32.783 -4.099 25342 13339 1 16 . 1 1 141 141 ARG H H 141 7.620 7.620 8.564 -0.944 25342 13340 1 16 . 1 1 142 142 ASP N N 142 125.999 125.999 120.449 5.550 25342 13341 1 16 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.255 -0.531 25342 13342 1 16 . 1 1 142 142 ASP C C 142 169.292 169.292 176.806 -7.514 25342 13343 1 16 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.534 -3.196 25342 13344 1 16 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.816 -4.139 25342 13345 1 16 . 1 1 142 142 ASP H H 142 9.482 9.482 9.090 0.392 25342 13346 1 16 . 1 1 143 143 ASP N N 143 119.293 119.293 118.334 0.959 25342 13347 1 16 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.405 -0.099 25342 13348 1 16 . 1 1 143 143 ASP C C 143 175.686 175.686 176.975 -1.289 25342 13349 1 16 . 1 1 143 143 ASP CA C 143 48.905 48.905 55.017 -6.112 25342 13350 1 16 . 1 1 143 143 ASP CB C 143 36.312 36.312 39.973 -3.661 25342 13351 1 16 . 1 1 143 143 ASP H H 143 8.108 8.108 8.574 -0.466 25342 13352 1 16 . 1 1 144 144 SER N N 144 115.303 115.303 115.273 0.030 25342 13353 1 16 . 1 1 144 144 SER HA H 144 3.740 3.740 4.286 -0.546 25342 13354 1 16 . 1 1 144 144 SER C C 144 172.925 172.925 174.867 -1.942 25342 13355 1 16 . 1 1 144 144 SER CA C 144 59.213 59.213 60.020 -0.807 25342 13356 1 16 . 1 1 144 144 SER CB C 144 60.806 60.806 63.022 -2.216 25342 13357 1 16 . 1 1 144 144 SER H H 144 7.642 7.642 8.083 -0.441 25342 13358 1 16 . 1 1 145 145 GLU N N 145 119.523 119.523 119.412 0.111 25342 13359 1 16 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.119 0.187 25342 13360 1 16 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.474 -3.435 25342 13361 1 16 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.202 -2.402 25342 13362 1 16 . 1 1 145 145 GLU H H 145 7.771 7.771 7.939 -0.168 25342 13363 1 16 . 1 1 146 146 VAL N N 146 118.683 118.683 120.435 -1.752 25342 13364 1 16 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.758 -0.817 25342 13365 1 16 . 1 1 146 146 VAL C C 146 174.591 174.591 177.779 -3.188 25342 13366 1 16 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.380 -2.449 25342 13367 1 16 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.015 -1.968 25342 13368 1 16 . 1 1 146 146 VAL H H 146 6.352 6.352 7.318 -0.966 25342 13369 1 16 . 1 1 147 147 ASP N N 147 119.312 119.312 119.012 0.300 25342 13370 1 16 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.320 -0.265 25342 13371 1 16 . 1 1 147 147 ASP C C 147 174.783 174.783 177.117 -2.334 25342 13372 1 16 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.896 -2.655 25342 13373 1 16 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.678 -3.445 25342 13374 1 16 . 1 1 147 147 ASP H H 147 8.370 8.370 8.818 -0.448 25342 13375 1 16 . 1 1 148 148 LYS N N 148 119.342 119.342 115.989 3.353 25342 13376 1 16 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.510 -0.573 25342 13377 1 16 . 1 1 148 148 LYS C C 148 176.384 176.384 177.994 -1.610 25342 13378 1 16 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.082 -1.376 25342 13379 1 16 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.767 -3.256 25342 13380 1 16 . 1 1 148 148 LYS H H 148 7.040 7.040 7.702 -0.662 25342 13381 1 16 . 1 1 149 149 TRP N N 149 118.258 118.258 120.262 -2.004 25342 13382 1 16 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.947 -0.356 25342 13383 1 16 . 1 1 149 149 TRP C C 149 174.212 174.212 176.366 -2.154 25342 13384 1 16 . 1 1 149 149 TRP CA C 149 53.745 53.745 56.017 -2.272 25342 13385 1 16 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.779 -1.839 25342 13386 1 16 . 1 1 149 149 TRP H H 149 7.811 7.811 7.562 0.249 25342 13387 1 16 . 1 1 150 150 SER N N 150 109.618 109.618 110.865 -1.247 25342 13388 1 16 . 1 1 150 150 SER HA H 150 4.234 4.234 4.702 -0.468 25342 13389 1 16 . 1 1 150 150 SER C C 150 170.189 170.189 174.224 -4.035 25342 13390 1 16 . 1 1 150 150 SER CA C 150 56.695 56.695 57.673 -0.978 25342 13391 1 16 . 1 1 150 150 SER CB C 150 61.935 61.935 63.841 -1.906 25342 13392 1 16 . 1 1 150 150 SER H H 150 7.793 7.793 7.903 -0.110 25342 13393 1 17 . 1 1 3 3 ALA N N 3 125.638 125.638 125.653 -0.015 25342 13394 1 17 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.688 -0.323 25342 13395 1 17 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.321 -3.023 25342 13396 1 17 . 1 1 3 3 ALA CB C 3 16.859 16.859 20.031 -3.172 25342 13397 1 17 . 1 1 3 3 ALA H H 3 8.325 8.325 8.427 -0.102 25342 13398 1 17 . 1 1 4 4 LYS N N 4 121.813 121.813 119.132 2.681 25342 13399 1 17 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.522 -0.295 25342 13400 1 17 . 1 1 4 4 LYS C C 4 174.574 174.574 175.430 -0.856 25342 13401 1 17 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.964 -2.183 25342 13402 1 17 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.704 -1.214 25342 13403 1 17 . 1 1 4 4 LYS H H 4 8.486 8.486 8.225 0.261 25342 13404 1 17 . 1 1 5 5 LYS N N 5 129.722 129.722 121.431 8.291 25342 13405 1 17 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.392 0.126 25342 13406 1 17 . 1 1 5 5 LYS C C 5 174.720 174.720 175.582 -0.862 25342 13407 1 17 . 1 1 5 5 LYS CA C 5 54.722 54.722 57.196 -2.474 25342 13408 1 17 . 1 1 5 5 LYS CB C 5 29.785 29.785 33.594 -3.809 25342 13409 1 17 . 1 1 5 5 LYS H H 5 10.015 10.015 8.324 1.691 25342 13410 1 17 . 1 1 6 6 THR N N 6 126.254 126.254 114.797 11.457 25342 13411 1 17 . 1 1 6 6 THR HA H 6 5.654 5.654 5.324 0.330 25342 13412 1 17 . 1 1 6 6 THR C C 6 169.926 169.926 173.100 -3.174 25342 13413 1 17 . 1 1 6 6 THR CA C 6 60.598 60.598 62.154 -1.556 25342 13414 1 17 . 1 1 6 6 THR CB C 6 68.041 68.041 71.730 -3.688 25342 13415 1 17 . 1 1 6 6 THR H H 6 8.538 8.538 8.544 -0.006 25342 13416 1 17 . 1 1 7 7 LEU N N 7 130.775 130.775 125.890 4.885 25342 13417 1 17 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.596 -0.002 25342 13418 1 17 . 1 1 7 7 LEU C C 7 170.404 170.404 174.303 -3.899 25342 13419 1 17 . 1 1 7 7 LEU CA C 7 49.933 49.933 52.950 -3.017 25342 13420 1 17 . 1 1 7 7 LEU CB C 7 40.728 40.728 45.647 -4.919 25342 13421 1 17 . 1 1 7 7 LEU H H 7 8.575 8.575 8.786 -0.211 25342 13422 1 17 . 1 1 8 8 ILE N N 8 127.242 127.242 123.021 4.221 25342 13423 1 17 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.463 0.385 25342 13424 1 17 . 1 1 8 8 ILE C C 8 170.936 170.936 173.943 -3.007 25342 13425 1 17 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.687 -3.435 25342 13426 1 17 . 1 1 8 8 ILE CB C 8 36.935 36.935 39.255 -2.320 25342 13427 1 17 . 1 1 8 8 ILE H H 8 9.217 9.217 8.106 1.111 25342 13428 1 17 . 1 1 9 9 LEU N N 9 127.183 127.183 128.137 -0.954 25342 13429 1 17 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.786 0.908 25342 13430 1 17 . 1 1 9 9 LEU C C 9 173.824 173.824 175.403 -1.579 25342 13431 1 17 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.928 -4.090 25342 13432 1 17 . 1 1 9 9 LEU CB C 9 43.963 43.963 42.775 1.188 25342 13433 1 17 . 1 1 9 9 LEU H H 9 9.248 9.248 8.728 0.520 25342 13434 1 17 . 1 1 10 10 TYR N N 10 113.330 113.330 121.174 -7.844 25342 13435 1 17 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.074 0.440 25342 13436 1 17 . 1 1 10 10 TYR C C 10 167.898 167.898 175.797 -7.899 25342 13437 1 17 . 1 1 10 10 TYR CA C 10 52.875 52.875 54.195 -1.320 25342 13438 1 17 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.306 -1.870 25342 13439 1 17 . 1 1 10 10 TYR H H 10 7.306 7.306 8.052 -0.746 25342 13440 1 17 . 1 1 11 11 TYR N N 11 121.297 121.297 126.995 -5.698 25342 13441 1 17 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.959 -0.197 25342 13442 1 17 . 1 1 11 11 TYR C C 11 169.698 169.698 175.109 -5.411 25342 13443 1 17 . 1 1 11 11 TYR CA C 11 54.047 54.047 54.930 -0.883 25342 13444 1 17 . 1 1 11 11 TYR CB C 11 40.538 40.538 38.033 2.505 25342 13445 1 17 . 1 1 11 11 TYR H H 11 7.891 7.891 9.041 -1.150 25342 13446 1 17 . 1 1 12 12 SER N N 12 117.763 117.763 124.652 -6.889 25342 13447 1 17 . 1 1 12 12 SER HA H 12 4.679 4.679 4.125 0.554 25342 13448 1 17 . 1 1 12 12 SER C C 12 170.075 170.075 173.968 -3.893 25342 13449 1 17 . 1 1 12 12 SER CA C 12 53.619 53.619 57.978 -4.359 25342 13450 1 17 . 1 1 12 12 SER CB C 12 62.847 62.847 62.054 0.793 25342 13451 1 17 . 1 1 12 12 SER H H 12 7.557 7.557 8.361 -0.804 25342 13452 1 17 . 1 1 13 13 TRP N N 13 135.232 135.232 130.453 4.779 25342 13453 1 17 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.715 0.921 25342 13454 1 17 . 1 1 13 13 TRP C C 13 175.708 175.708 175.573 0.135 25342 13455 1 17 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.739 -1.623 25342 13456 1 17 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.484 -1.849 25342 13457 1 17 . 1 1 13 13 TRP H H 13 9.755 9.755 7.934 1.821 25342 13458 1 17 . 1 1 14 14 SER N N 14 113.789 113.789 113.556 0.233 25342 13459 1 17 . 1 1 14 14 SER HA H 14 4.223 4.223 4.426 -0.203 25342 13460 1 17 . 1 1 14 14 SER C C 14 172.747 172.747 173.953 -1.206 25342 13461 1 17 . 1 1 14 14 SER CA C 14 53.828 53.828 58.235 -4.407 25342 13462 1 17 . 1 1 14 14 SER CB C 14 60.037 60.037 62.614 -2.578 25342 13463 1 17 . 1 1 14 14 SER H H 14 10.026 10.026 8.585 1.441 25342 13464 1 17 . 1 1 15 15 GLY N N 15 110.489 110.489 109.286 1.203 25342 13465 1 17 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.388 -0.729 25342 13466 1 17 . 1 1 15 15 GLY H H 15 7.391 7.391 8.207 -0.816 25342 13467 1 17 . 1 1 16 16 GLU N N 16 129.005 129.005 120.880 8.125 25342 13468 1 17 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.209 -0.146 25342 13469 1 17 . 1 1 16 16 GLU CA C 16 56.761 56.761 58.911 -2.151 25342 13470 1 17 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.869 -3.457 25342 13471 1 17 . 1 1 16 16 GLU H H 16 11.550 11.550 8.625 2.925 25342 13472 1 17 . 1 1 17 17 THR N N 17 123.016 123.016 113.408 9.608 25342 13473 1 17 . 1 1 17 17 THR HA H 17 4.035 4.035 4.172 -0.137 25342 13474 1 17 . 1 1 17 17 THR C C 17 173.360 173.360 176.313 -2.953 25342 13475 1 17 . 1 1 17 17 THR CA C 17 64.303 64.303 64.898 -0.595 25342 13476 1 17 . 1 1 17 17 THR CB C 17 63.999 63.999 68.495 -4.496 25342 13477 1 17 . 1 1 17 17 THR H H 17 11.293 11.293 8.549 2.744 25342 13478 1 17 . 1 1 18 18 LYS N N 18 120.156 120.156 121.784 -1.628 25342 13479 1 17 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.030 -1.174 25342 13480 1 17 . 1 1 18 18 LYS C C 18 173.901 173.901 178.202 -4.301 25342 13481 1 17 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.346 -2.512 25342 13482 1 17 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.185 -2.704 25342 13483 1 17 . 1 1 18 18 LYS H H 18 6.940 6.940 8.101 -1.161 25342 13484 1 17 . 1 1 19 19 LYS N N 19 117.237 117.237 117.834 -0.597 25342 13485 1 17 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.120 -0.197 25342 13486 1 17 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.377 -2.053 25342 13487 1 17 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.461 -3.100 25342 13488 1 17 . 1 1 19 19 LYS H H 19 7.212 7.212 7.874 -0.662 25342 13489 1 17 . 1 1 20 20 MET N N 20 119.268 119.268 115.315 3.953 25342 13490 1 17 . 1 1 20 20 MET HA H 20 4.413 4.413 4.276 0.137 25342 13491 1 17 . 1 1 20 20 MET C C 20 173.625 173.625 175.038 -1.413 25342 13492 1 17 . 1 1 20 20 MET CA C 20 52.261 52.261 54.147 -1.885 25342 13493 1 17 . 1 1 20 20 MET CB C 20 26.680 26.680 30.654 -3.974 25342 13494 1 17 . 1 1 20 20 MET H H 20 7.600 7.600 7.508 0.092 25342 13495 1 17 . 1 1 21 21 ALA N N 21 123.669 123.669 120.532 3.137 25342 13496 1 17 . 1 1 21 21 ALA HA H 21 3.482 3.482 5.028 -1.546 25342 13497 1 17 . 1 1 21 21 ALA C C 21 176.628 176.628 178.457 -1.829 25342 13498 1 17 . 1 1 21 21 ALA CA C 21 52.374 52.374 53.370 -0.996 25342 13499 1 17 . 1 1 21 21 ALA CB C 21 16.495 16.495 20.319 -3.824 25342 13500 1 17 . 1 1 21 21 ALA H H 21 8.738 8.738 7.717 1.021 25342 13501 1 17 . 1 1 22 22 GLU N N 22 117.242 117.242 120.611 -3.369 25342 13502 1 17 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.823 -0.150 25342 13503 1 17 . 1 1 22 22 GLU C C 22 176.698 176.698 178.627 -1.929 25342 13504 1 17 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.434 -2.894 25342 13505 1 17 . 1 1 22 22 GLU CB C 22 26.434 26.434 28.879 -2.445 25342 13506 1 17 . 1 1 22 22 GLU H H 22 7.959 7.959 8.179 -0.220 25342 13507 1 17 . 1 1 23 23 LYS N N 23 123.302 123.302 120.039 3.263 25342 13508 1 17 . 1 1 23 23 LYS HA H 23 3.821 3.821 3.970 -0.149 25342 13509 1 17 . 1 1 23 23 LYS C C 23 177.389 177.389 179.103 -1.714 25342 13510 1 17 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.675 -2.753 25342 13511 1 17 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.280 -2.766 25342 13512 1 17 . 1 1 23 23 LYS H H 23 7.703 7.703 7.441 0.262 25342 13513 1 17 . 1 1 24 24 ILE N N 24 122.208 122.208 116.606 5.602 25342 13514 1 17 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.701 -0.418 25342 13515 1 17 . 1 1 24 24 ILE C C 24 174.934 174.934 177.843 -2.909 25342 13516 1 17 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.360 -1.068 25342 13517 1 17 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.507 -2.769 25342 13518 1 17 . 1 1 24 24 ILE H H 24 8.535 8.535 7.867 0.668 25342 13519 1 17 . 1 1 25 25 ASN N N 25 118.640 118.640 118.239 0.401 25342 13520 1 17 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.344 -0.117 25342 13521 1 17 . 1 1 25 25 ASN C C 25 173.530 173.530 177.233 -3.703 25342 13522 1 17 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.358 -4.146 25342 13523 1 17 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.688 -0.584 25342 13524 1 17 . 1 1 25 25 ASN H H 25 8.317 8.317 8.429 -0.112 25342 13525 1 17 . 1 1 26 26 SER N N 26 111.990 111.990 113.930 -1.940 25342 13526 1 17 . 1 1 26 26 SER HA H 26 4.153 4.153 4.301 -0.148 25342 13527 1 17 . 1 1 26 26 SER C C 26 172.110 172.110 175.509 -3.399 25342 13528 1 17 . 1 1 26 26 SER CA C 26 57.905 57.905 60.893 -2.988 25342 13529 1 17 . 1 1 26 26 SER CB C 26 60.655 60.655 63.134 -2.479 25342 13530 1 17 . 1 1 26 26 SER H H 26 7.369 7.369 7.897 -0.528 25342 13531 1 17 . 1 1 27 27 GLU N N 27 120.201 120.201 119.502 0.699 25342 13532 1 17 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.221 -0.120 25342 13533 1 17 . 1 1 27 27 GLU C C 27 173.673 173.673 177.264 -3.591 25342 13534 1 17 . 1 1 27 27 GLU CA C 27 54.235 54.235 57.103 -2.868 25342 13535 1 17 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.255 -3.654 25342 13536 1 17 . 1 1 27 27 GLU H H 27 7.451 7.451 7.639 -0.188 25342 13537 1 17 . 1 1 28 28 ILE N N 28 118.762 118.762 118.746 0.016 25342 13538 1 17 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.064 0.135 25342 13539 1 17 . 1 1 28 28 ILE C C 28 172.487 172.487 175.891 -3.404 25342 13540 1 17 . 1 1 28 28 ILE CA C 28 57.732 57.732 61.001 -3.269 25342 13541 1 17 . 1 1 28 28 ILE CB C 28 35.738 35.738 39.163 -3.425 25342 13542 1 17 . 1 1 28 28 ILE H H 28 7.255 7.255 7.367 -0.112 25342 13543 1 17 . 1 1 29 29 LYS N N 29 130.563 130.563 122.245 8.318 25342 13544 1 17 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.132 -0.130 25342 13545 1 17 . 1 1 29 29 LYS C C 29 174.386 174.386 176.650 -2.264 25342 13546 1 17 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.271 -1.736 25342 13547 1 17 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.169 -3.583 25342 13548 1 17 . 1 1 29 29 LYS H H 29 8.564 8.564 8.493 0.071 25342 13549 1 17 . 1 1 30 30 ASP N N 30 119.357 119.357 119.157 0.200 25342 13550 1 17 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.571 -0.169 25342 13551 1 17 . 1 1 30 30 ASP C C 30 172.570 172.570 176.456 -3.886 25342 13552 1 17 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.204 -0.768 25342 13553 1 17 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.351 -2.607 25342 13554 1 17 . 1 1 30 30 ASP H H 30 8.920 8.920 8.614 0.306 25342 13555 1 17 . 1 1 31 31 SER N N 31 114.019 114.019 115.861 -1.842 25342 13556 1 17 . 1 1 31 31 SER HA H 31 4.782 4.782 4.536 0.246 25342 13557 1 17 . 1 1 31 31 SER C C 31 171.150 171.150 174.624 -3.474 25342 13558 1 17 . 1 1 31 31 SER CA C 31 55.551 55.551 58.878 -3.327 25342 13559 1 17 . 1 1 31 31 SER CB C 31 62.259 62.259 64.489 -2.230 25342 13560 1 17 . 1 1 31 31 SER H H 31 8.006 8.006 8.204 -0.198 25342 13561 1 17 . 1 1 32 32 GLU N N 32 121.455 121.455 119.061 2.394 25342 13562 1 17 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.569 0.171 25342 13563 1 17 . 1 1 32 32 GLU C C 32 171.185 171.185 175.084 -3.899 25342 13564 1 17 . 1 1 32 32 GLU CA C 32 52.081 52.081 54.493 -2.412 25342 13565 1 17 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.531 -1.704 25342 13566 1 17 . 1 1 32 32 GLU H H 32 8.145 8.145 8.423 -0.278 25342 13567 1 17 . 1 1 33 33 LEU N N 33 126.176 126.176 121.120 5.056 25342 13568 1 17 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.423 0.883 25342 13569 1 17 . 1 1 33 33 LEU C C 33 173.365 173.365 175.552 -2.187 25342 13570 1 17 . 1 1 33 33 LEU CA C 33 51.440 51.440 53.953 -2.513 25342 13571 1 17 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.840 -0.205 25342 13572 1 17 . 1 1 33 33 LEU H H 33 8.589 8.589 8.396 0.193 25342 13573 1 17 . 1 1 34 34 LYS N N 34 127.200 127.200 124.633 2.567 25342 13574 1 17 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.735 -0.139 25342 13575 1 17 . 1 1 34 34 LYS C C 34 169.622 169.622 174.259 -4.637 25342 13576 1 17 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.903 -2.574 25342 13577 1 17 . 1 1 34 34 LYS CB C 34 34.200 34.200 37.168 -2.968 25342 13578 1 17 . 1 1 34 34 LYS H H 34 9.380 9.380 8.819 0.561 25342 13579 1 17 . 1 1 35 35 GLU N N 35 122.324 122.324 118.845 3.479 25342 13580 1 17 . 1 1 35 35 GLU HA H 35 3.333 3.333 4.991 -1.658 25342 13581 1 17 . 1 1 35 35 GLU C C 35 172.734 172.734 175.192 -2.458 25342 13582 1 17 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.459 -1.847 25342 13583 1 17 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.535 -4.216 25342 13584 1 17 . 1 1 35 35 GLU H H 35 8.094 8.094 8.367 -0.273 25342 13585 1 17 . 1 1 36 36 VAL N N 36 126.781 126.781 121.741 5.040 25342 13586 1 17 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.354 -0.515 25342 13587 1 17 . 1 1 36 36 VAL C C 36 171.482 171.482 175.115 -3.633 25342 13588 1 17 . 1 1 36 36 VAL CA C 36 59.405 59.405 61.316 -1.911 25342 13589 1 17 . 1 1 36 36 VAL CB C 36 29.348 29.348 32.474 -3.126 25342 13590 1 17 . 1 1 36 36 VAL H H 36 8.660 8.660 8.279 0.381 25342 13591 1 17 . 1 1 37 37 LYS N N 37 126.065 126.065 125.243 0.822 25342 13592 1 17 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.566 0.399 25342 13593 1 17 . 1 1 37 37 LYS C C 37 173.187 173.187 175.260 -2.073 25342 13594 1 17 . 1 1 37 37 LYS CA C 37 52.280 52.280 55.746 -3.466 25342 13595 1 17 . 1 1 37 37 LYS CB C 37 32.921 32.921 33.390 -0.469 25342 13596 1 17 . 1 1 37 37 LYS H H 37 7.809 7.809 8.433 -0.624 25342 13597 1 17 . 1 1 38 38 VAL N N 38 111.020 111.020 116.117 -5.097 25342 13598 1 17 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.548 0.276 25342 13599 1 17 . 1 1 38 38 VAL C C 38 173.604 173.604 175.989 -2.385 25342 13600 1 17 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.380 -2.997 25342 13601 1 17 . 1 1 38 38 VAL CB C 38 32.376 32.376 33.067 -0.691 25342 13602 1 17 . 1 1 38 38 VAL H H 38 8.305 8.305 8.223 0.082 25342 13603 1 17 . 1 1 39 39 SER N N 39 117.887 117.887 115.862 2.025 25342 13604 1 17 . 1 1 39 39 SER HA H 39 4.183 4.183 4.433 -0.250 25342 13605 1 17 . 1 1 39 39 SER C C 39 173.538 173.538 174.580 -1.042 25342 13606 1 17 . 1 1 39 39 SER CA C 39 56.279 56.279 59.297 -3.018 25342 13607 1 17 . 1 1 39 39 SER CB C 39 60.537 60.537 63.845 -3.308 25342 13608 1 17 . 1 1 39 39 SER H H 39 8.847 8.847 8.503 0.344 25342 13609 1 17 . 1 1 40 40 GLU N N 40 126.316 126.316 120.223 6.093 25342 13610 1 17 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.297 -0.143 25342 13611 1 17 . 1 1 40 40 GLU C C 40 174.586 174.586 177.541 -2.955 25342 13612 1 17 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.211 -1.399 25342 13613 1 17 . 1 1 40 40 GLU CB C 40 26.720 26.720 30.203 -3.483 25342 13614 1 17 . 1 1 40 40 GLU H H 40 9.049 9.049 8.406 0.643 25342 13615 1 17 . 1 1 41 41 GLY N N 41 112.494 112.494 112.045 0.449 25342 13616 1 17 . 1 1 41 41 GLY C C 41 171.994 171.994 175.431 -3.437 25342 13617 1 17 . 1 1 41 41 GLY CA C 41 42.462 42.462 46.172 -3.710 25342 13618 1 17 . 1 1 41 41 GLY H H 41 8.780 8.780 8.951 -0.171 25342 13619 1 17 . 1 1 42 42 THR N N 42 118.631 118.631 115.248 3.383 25342 13620 1 17 . 1 1 42 42 THR HA H 42 3.582 3.582 3.858 -0.276 25342 13621 1 17 . 1 1 42 42 THR C C 42 171.225 171.225 173.655 -2.430 25342 13622 1 17 . 1 1 42 42 THR CA C 42 64.104 64.104 64.772 -0.668 25342 13623 1 17 . 1 1 42 42 THR CB C 42 65.914 65.914 69.539 -3.625 25342 13624 1 17 . 1 1 42 42 THR H H 42 7.737 7.737 8.068 -0.331 25342 13625 1 17 . 1 1 43 43 PHE N N 43 116.279 116.279 115.300 0.979 25342 13626 1 17 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.540 0.480 25342 13627 1 17 . 1 1 43 43 PHE C C 43 170.141 170.141 173.553 -3.412 25342 13628 1 17 . 1 1 43 43 PHE CA C 43 52.472 52.472 57.662 -5.190 25342 13629 1 17 . 1 1 43 43 PHE CB C 43 37.385 37.385 42.305 -4.920 25342 13630 1 17 . 1 1 43 43 PHE H H 43 8.114 8.114 7.720 0.394 25342 13631 1 17 . 1 1 44 44 ASP N N 44 121.513 121.513 119.550 1.963 25342 13632 1 17 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.758 0.093 25342 13633 1 17 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.660 -3.448 25342 13634 1 17 . 1 1 44 44 ASP CB C 44 44.385 44.385 41.402 2.983 25342 13635 1 17 . 1 1 44 44 ASP H H 44 7.774 7.774 8.636 -0.862 25342 13636 1 17 . 1 1 45 45 ALA N N 45 125.663 125.663 121.118 4.545 25342 13637 1 17 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.413 -0.202 25342 13638 1 17 . 1 1 45 45 ALA C C 45 175.139 175.139 176.921 -1.782 25342 13639 1 17 . 1 1 45 45 ALA CA C 45 51.436 51.436 53.081 -1.645 25342 13640 1 17 . 1 1 45 45 ALA CB C 45 16.232 16.232 17.574 -1.342 25342 13641 1 17 . 1 1 45 45 ALA H H 45 8.324 8.324 8.257 0.067 25342 13642 1 17 . 1 1 46 46 ASP N N 46 119.288 119.288 117.092 2.196 25342 13643 1 17 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.602 0.223 25342 13644 1 17 . 1 1 46 46 ASP C C 46 175.013 175.013 176.719 -1.706 25342 13645 1 17 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.658 -2.497 25342 13646 1 17 . 1 1 46 46 ASP CB C 46 41.233 41.233 41.947 -0.714 25342 13647 1 17 . 1 1 46 46 ASP H H 46 9.618 9.618 8.131 1.487 25342 13648 1 17 . 1 1 47 47 MET N N 47 127.347 127.347 116.865 10.482 25342 13649 1 17 . 1 1 47 47 MET HA H 47 3.456 3.456 4.706 -1.250 25342 13650 1 17 . 1 1 47 47 MET C C 47 173.605 173.605 177.409 -3.804 25342 13651 1 17 . 1 1 47 47 MET CA C 47 56.699 56.699 56.357 0.342 25342 13652 1 17 . 1 1 47 47 MET CB C 47 29.930 29.930 34.727 -4.797 25342 13653 1 17 . 1 1 47 47 MET H H 47 9.178 9.178 7.994 1.184 25342 13654 1 17 . 1 1 48 48 TYR N N 48 121.040 121.040 117.226 3.814 25342 13655 1 17 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.624 -0.752 25342 13656 1 17 . 1 1 48 48 TYR CA C 48 58.712 58.712 58.865 -0.153 25342 13657 1 17 . 1 1 48 48 TYR CB C 48 33.638 33.638 37.639 -4.001 25342 13658 1 17 . 1 1 48 48 TYR H H 48 7.881 7.881 8.255 -0.374 25342 13659 1 17 . 1 1 49 49 LYS N N 49 121.754 121.754 120.768 0.986 25342 13660 1 17 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.113 -0.008 25342 13661 1 17 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.426 -3.041 25342 13662 1 17 . 1 1 49 49 LYS CB C 49 29.164 29.164 31.793 -2.629 25342 13663 1 17 . 1 1 49 49 LYS H H 49 8.365 8.365 8.423 -0.058 25342 13664 1 17 . 1 1 50 50 THR N N 50 117.557 117.557 108.572 8.985 25342 13665 1 17 . 1 1 50 50 THR HA H 50 3.586 3.586 4.199 -0.613 25342 13666 1 17 . 1 1 50 50 THR CA C 50 65.634 65.634 65.216 0.418 25342 13667 1 17 . 1 1 50 50 THR CB C 50 65.904 65.904 68.247 -2.343 25342 13668 1 17 . 1 1 50 50 THR H H 50 8.007 8.007 8.166 -0.159 25342 13669 1 17 . 1 1 51 51 SER N N 51 115.110 115.110 118.727 -3.617 25342 13670 1 17 . 1 1 51 51 SER HA H 51 3.974 3.974 4.183 -0.209 25342 13671 1 17 . 1 1 51 51 SER CA C 51 59.042 59.042 62.825 -3.784 25342 13672 1 17 . 1 1 51 51 SER CB C 51 59.835 59.835 62.862 -3.027 25342 13673 1 17 . 1 1 51 51 SER H H 51 7.606 7.606 7.530 0.076 25342 13674 1 17 . 1 1 52 52 ASP N N 52 119.713 119.713 121.950 -2.237 25342 13675 1 17 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.465 -0.157 25342 13676 1 17 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.247 -2.721 25342 13677 1 17 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.925 -3.237 25342 13678 1 17 . 1 1 52 52 ASP H H 52 7.552 7.552 7.663 -0.111 25342 13679 1 17 . 1 1 53 53 ILE N N 53 121.982 121.982 119.811 2.171 25342 13680 1 17 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.558 0.164 25342 13681 1 17 . 1 1 53 53 ILE C C 53 175.325 175.325 177.978 -2.653 25342 13682 1 17 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.630 -3.086 25342 13683 1 17 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.888 -1.188 25342 13684 1 17 . 1 1 53 53 ILE H H 53 7.815 7.815 7.787 0.028 25342 13685 1 17 . 1 1 54 54 ALA N N 54 121.552 121.552 121.004 0.548 25342 13686 1 17 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.104 0.213 25342 13687 1 17 . 1 1 54 54 ALA C C 54 177.475 177.475 179.614 -2.139 25342 13688 1 17 . 1 1 54 54 ALA CA C 54 52.022 52.022 55.032 -3.010 25342 13689 1 17 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.623 -2.639 25342 13690 1 17 . 1 1 54 54 ALA H H 54 8.332 8.332 7.849 0.483 25342 13691 1 17 . 1 1 55 55 LEU N N 55 117.176 117.176 119.640 -2.464 25342 13692 1 17 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.000 -0.066 25342 13693 1 17 . 1 1 55 55 LEU C C 55 176.532 176.532 178.285 -1.753 25342 13694 1 17 . 1 1 55 55 LEU CA C 55 55.331 55.331 58.027 -2.696 25342 13695 1 17 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.031 -2.603 25342 13696 1 17 . 1 1 55 55 LEU H H 55 8.195 8.195 7.921 0.274 25342 13697 1 17 . 1 1 56 56 ASP N N 56 120.056 120.056 118.767 1.289 25342 13698 1 17 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.296 0.171 25342 13699 1 17 . 1 1 56 56 ASP C C 56 176.585 176.585 178.283 -1.698 25342 13700 1 17 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.328 -2.778 25342 13701 1 17 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.945 -2.640 25342 13702 1 17 . 1 1 56 56 ASP H H 56 7.806 7.806 7.968 -0.162 25342 13703 1 17 . 1 1 57 57 GLN N N 57 120.020 120.020 114.879 5.141 25342 13704 1 17 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.238 -0.115 25342 13705 1 17 . 1 1 57 57 GLN C C 57 175.689 175.689 177.388 -1.699 25342 13706 1 17 . 1 1 57 57 GLN CA C 57 54.405 54.405 57.291 -2.886 25342 13707 1 17 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.930 -5.161 25342 13708 1 17 . 1 1 57 57 GLN H H 57 7.661 7.661 7.790 -0.129 25342 13709 1 17 . 1 1 58 58 ILE N N 58 120.644 120.644 118.821 1.823 25342 13710 1 17 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.519 -0.943 25342 13711 1 17 . 1 1 58 58 ILE C C 58 176.237 176.237 177.438 -1.201 25342 13712 1 17 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.464 0.042 25342 13713 1 17 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.100 -3.071 25342 13714 1 17 . 1 1 58 58 ILE H H 58 8.228 8.228 7.607 0.621 25342 13715 1 17 . 1 1 59 59 GLN N N 59 115.498 115.498 118.724 -3.226 25342 13716 1 17 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.240 -0.098 25342 13717 1 17 . 1 1 59 59 GLN C C 59 173.781 173.781 176.876 -3.095 25342 13718 1 17 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.125 -3.143 25342 13719 1 17 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.052 -2.441 25342 13720 1 17 . 1 1 59 59 GLN H H 59 8.331 8.331 8.295 0.036 25342 13721 1 17 . 1 1 60 60 GLY N N 60 106.623 106.623 105.874 0.749 25342 13722 1 17 . 1 1 60 60 GLY C C 60 172.068 172.068 175.131 -3.063 25342 13723 1 17 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.315 -2.442 25342 13724 1 17 . 1 1 60 60 GLY H H 60 7.611 7.611 8.459 -0.848 25342 13725 1 17 . 1 1 61 61 ASN N N 61 117.691 117.691 117.856 -0.165 25342 13726 1 17 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.745 -0.201 25342 13727 1 17 . 1 1 61 61 ASN C C 61 171.946 171.946 175.429 -3.483 25342 13728 1 17 . 1 1 61 61 ASN CA C 61 51.569 51.569 53.972 -2.403 25342 13729 1 17 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.005 -2.645 25342 13730 1 17 . 1 1 61 61 ASN H H 61 8.151 8.151 8.324 -0.173 25342 13731 1 17 . 1 1 62 62 LYS N N 62 118.289 118.289 118.683 -0.394 25342 13732 1 17 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.739 -0.411 25342 13733 1 17 . 1 1 62 62 LYS C C 62 171.773 171.773 174.936 -3.163 25342 13734 1 17 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.636 -3.340 25342 13735 1 17 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.661 -0.978 25342 13736 1 17 . 1 1 62 62 LYS H H 62 7.242 7.242 7.587 -0.345 25342 13737 1 17 . 1 1 63 63 ASP N N 63 119.888 119.888 119.783 0.105 25342 13738 1 17 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.651 -0.235 25342 13739 1 17 . 1 1 63 63 ASP C C 63 174.476 174.476 175.361 -0.885 25342 13740 1 17 . 1 1 63 63 ASP CA C 63 51.461 51.461 54.085 -2.624 25342 13741 1 17 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.968 -3.454 25342 13742 1 17 . 1 1 63 63 ASP H H 63 8.230 8.230 8.448 -0.218 25342 13743 1 17 . 1 1 64 64 PHE N N 64 119.789 119.789 115.228 4.561 25342 13744 1 17 . 1 1 64 64 PHE HA H 64 3.816 3.816 5.038 -1.222 25342 13745 1 17 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.429 1.821 25342 13746 1 17 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.602 -3.568 25342 13747 1 17 . 1 1 64 64 PHE H H 64 8.428 8.428 7.381 1.047 25342 13748 1 17 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.683 -0.370 25342 13749 1 17 . 1 1 65 65 PRO C C 65 173.975 173.975 176.120 -2.145 25342 13750 1 17 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.769 -2.713 25342 13751 1 17 . 1 1 65 65 PRO CB C 65 29.520 29.520 33.743 -4.223 25342 13752 1 17 . 1 1 66 66 GLU N N 66 121.326 121.326 118.757 2.569 25342 13753 1 17 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.774 -0.540 25342 13754 1 17 . 1 1 66 66 GLU C C 66 173.978 173.978 175.343 -1.365 25342 13755 1 17 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.327 -1.796 25342 13756 1 17 . 1 1 66 66 GLU CB C 66 27.700 27.700 32.611 -4.912 25342 13757 1 17 . 1 1 66 66 GLU H H 66 8.225 8.225 8.716 -0.491 25342 13758 1 17 . 1 1 67 67 ILE N N 67 113.897 113.897 115.543 -1.646 25342 13759 1 17 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.770 0.399 25342 13760 1 17 . 1 1 67 67 ILE C C 67 172.791 172.791 175.354 -2.563 25342 13761 1 17 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.166 -2.891 25342 13762 1 17 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.553 -2.537 25342 13763 1 17 . 1 1 67 67 ILE H H 67 8.366 8.366 8.279 0.087 25342 13764 1 17 . 1 1 68 68 GLN N N 68 121.654 121.654 121.520 0.134 25342 13765 1 17 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.424 0.095 25342 13766 1 17 . 1 1 68 68 GLN C C 68 171.562 171.562 175.444 -3.882 25342 13767 1 17 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.984 -2.671 25342 13768 1 17 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.558 -1.773 25342 13769 1 17 . 1 1 68 68 GLN H H 68 8.763 8.763 8.491 0.272 25342 13770 1 17 . 1 1 69 69 LEU N N 69 125.289 125.289 120.146 5.143 25342 13771 1 17 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.383 0.136 25342 13772 1 17 . 1 1 69 69 LEU C C 69 172.567 172.567 176.702 -4.135 25342 13773 1 17 . 1 1 69 69 LEU CA C 69 51.797 51.797 55.120 -3.323 25342 13774 1 17 . 1 1 69 69 LEU CB C 69 42.742 42.742 42.895 -0.153 25342 13775 1 17 . 1 1 69 69 LEU H H 69 7.996 7.996 7.666 0.330 25342 13776 1 17 . 1 1 70 70 ASP N N 70 123.170 123.170 121.841 1.329 25342 13777 1 17 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.757 -0.351 25342 13778 1 17 . 1 1 70 70 ASP C C 70 171.978 171.978 175.225 -3.247 25342 13779 1 17 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.623 -1.940 25342 13780 1 17 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.931 -3.203 25342 13781 1 17 . 1 1 70 70 ASP H H 70 8.278 8.278 8.375 -0.097 25342 13782 1 17 . 1 1 71 71 ASN N N 71 117.524 117.524 118.433 -0.909 25342 13783 1 17 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.753 -0.426 25342 13784 1 17 . 1 1 71 71 ASN C C 71 171.825 171.825 174.565 -2.740 25342 13785 1 17 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.219 -1.562 25342 13786 1 17 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.590 -3.360 25342 13787 1 17 . 1 1 71 71 ASN H H 71 8.372 8.372 8.429 -0.057 25342 13788 1 17 . 1 1 72 72 ILE N N 72 124.515 124.515 124.989 -0.474 25342 13789 1 17 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.195 -0.266 25342 13790 1 17 . 1 1 72 72 ILE C C 72 171.607 171.607 174.372 -2.765 25342 13791 1 17 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.329 -3.040 25342 13792 1 17 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.260 -2.500 25342 13793 1 17 . 1 1 72 72 ILE H H 72 7.653 7.653 8.130 -0.477 25342 13794 1 17 . 1 1 73 73 ASP N N 73 125.182 125.182 127.959 -2.777 25342 13795 1 17 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.460 0.168 25342 13796 1 17 . 1 1 73 73 ASP C C 73 173.980 173.980 176.305 -2.325 25342 13797 1 17 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.695 -5.481 25342 13798 1 17 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.668 -3.766 25342 13799 1 17 . 1 1 73 73 ASP H H 73 8.382 8.382 8.618 -0.236 25342 13800 1 17 . 1 1 74 74 TYR N N 74 123.092 123.092 123.857 -0.765 25342 13801 1 17 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.687 -0.822 25342 13802 1 17 . 1 1 74 74 TYR C C 74 173.582 173.582 177.261 -3.679 25342 13803 1 17 . 1 1 74 74 TYR CA C 74 59.486 59.486 59.704 -0.218 25342 13804 1 17 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.596 -3.788 25342 13805 1 17 . 1 1 74 74 TYR H H 74 7.348 7.348 7.914 -0.566 25342 13806 1 17 . 1 1 75 75 ASN N N 75 109.447 109.447 116.158 -6.711 25342 13807 1 17 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.754 0.171 25342 13808 1 17 . 1 1 75 75 ASN C C 75 172.570 172.570 175.516 -2.946 25342 13809 1 17 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.650 -2.032 25342 13810 1 17 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.325 -2.791 25342 13811 1 17 . 1 1 75 75 ASN H H 75 8.040 8.040 8.788 -0.748 25342 13812 1 17 . 1 1 76 76 ASN N N 76 117.411 117.411 115.950 1.461 25342 13813 1 17 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.641 -0.187 25342 13814 1 17 . 1 1 76 76 ASN C C 76 171.155 171.155 174.633 -3.478 25342 13815 1 17 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.115 -2.181 25342 13816 1 17 . 1 1 76 76 ASN CB C 76 35.658 35.658 39.098 -3.440 25342 13817 1 17 . 1 1 76 76 ASN H H 76 7.750 7.750 7.864 -0.114 25342 13818 1 17 . 1 1 77 77 TYR N N 77 116.878 116.878 118.386 -1.508 25342 13819 1 17 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.619 -0.265 25342 13820 1 17 . 1 1 77 77 TYR C C 77 172.224 172.224 176.716 -4.492 25342 13821 1 17 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.074 -2.834 25342 13822 1 17 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.377 -2.264 25342 13823 1 17 . 1 1 77 77 TYR H H 77 7.789 7.789 7.552 0.237 25342 13824 1 17 . 1 1 78 78 ASP N N 78 121.352 121.352 123.308 -1.956 25342 13825 1 17 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.756 0.041 25342 13826 1 17 . 1 1 78 78 ASP C C 78 172.623 172.623 175.365 -2.742 25342 13827 1 17 . 1 1 78 78 ASP CA C 78 53.190 53.190 55.750 -2.560 25342 13828 1 17 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.429 -1.395 25342 13829 1 17 . 1 1 78 78 ASP H H 78 9.036 9.036 8.924 0.112 25342 13830 1 17 . 1 1 79 79 LEU N N 79 123.073 123.073 117.688 5.385 25342 13831 1 17 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.332 -0.224 25342 13832 1 17 . 1 1 79 79 LEU C C 79 170.730 170.730 174.305 -3.575 25342 13833 1 17 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.968 -2.711 25342 13834 1 17 . 1 1 79 79 LEU CB C 79 42.284 42.284 45.945 -3.661 25342 13835 1 17 . 1 1 79 79 LEU H H 79 7.877 7.877 7.891 -0.014 25342 13836 1 17 . 1 1 80 80 ILE N N 80 126.348 126.348 124.137 2.211 25342 13837 1 17 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.696 0.373 25342 13838 1 17 . 1 1 80 80 ILE C C 80 171.584 171.584 174.945 -3.361 25342 13839 1 17 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.115 -2.700 25342 13840 1 17 . 1 1 80 80 ILE CB C 80 37.998 37.998 39.493 -1.496 25342 13841 1 17 . 1 1 80 80 ILE H H 80 8.704 8.704 8.974 -0.270 25342 13842 1 17 . 1 1 81 81 LEU N N 81 126.303 126.303 128.751 -2.448 25342 13843 1 17 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.827 0.296 25342 13844 1 17 . 1 1 81 81 LEU C C 81 172.779 172.779 176.006 -3.227 25342 13845 1 17 . 1 1 81 81 LEU CA C 81 49.509 49.509 55.084 -5.575 25342 13846 1 17 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.729 -2.014 25342 13847 1 17 . 1 1 81 81 LEU H H 81 9.202 9.202 8.747 0.455 25342 13848 1 17 . 1 1 82 82 ILE N N 82 120.931 120.931 119.351 1.580 25342 13849 1 17 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.342 -0.495 25342 13850 1 17 . 1 1 82 82 ILE C C 82 172.796 172.796 174.714 -1.918 25342 13851 1 17 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.305 -2.424 25342 13852 1 17 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.826 -5.029 25342 13853 1 17 . 1 1 82 82 ILE H H 82 8.846 8.846 8.652 0.194 25342 13854 1 17 . 1 1 83 83 GLY N N 83 120.905 120.905 108.614 12.291 25342 13855 1 17 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.517 -2.960 25342 13856 1 17 . 1 1 83 83 GLY H H 83 9.558 9.558 7.961 1.597 25342 13857 1 17 . 1 1 84 84 SER N N 84 116.601 116.601 114.461 2.140 25342 13858 1 17 . 1 1 84 84 SER HA H 84 5.476 5.476 4.906 0.570 25342 13859 1 17 . 1 1 84 84 SER CA C 84 51.324 51.324 55.290 -3.966 25342 13860 1 17 . 1 1 84 84 SER CB C 84 64.271 64.271 64.846 -0.575 25342 13861 1 17 . 1 1 84 84 SER H H 84 7.533 7.533 7.008 0.525 25342 13862 1 17 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.382 0.781 25342 13863 1 17 . 1 1 85 85 PRO C C 85 175.590 175.590 176.244 -0.654 25342 13864 1 17 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.402 -3.519 25342 13865 1 17 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.332 -1.858 25342 13866 1 17 . 1 1 86 86 VAL N N 86 116.295 116.295 117.614 -1.319 25342 13867 1 17 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.279 -0.458 25342 13868 1 17 . 1 1 86 86 VAL C C 86 172.692 172.692 175.839 -3.147 25342 13869 1 17 . 1 1 86 86 VAL CA C 86 59.812 59.812 60.903 -1.091 25342 13870 1 17 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.874 -2.791 25342 13871 1 17 . 1 1 86 86 VAL H H 86 7.246 7.246 7.523 -0.277 25342 13872 1 17 . 1 1 87 87 TRP N N 87 131.042 131.042 127.579 3.463 25342 13873 1 17 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.319 -0.008 25342 13874 1 17 . 1 1 87 87 TRP C C 87 173.323 173.323 176.702 -3.379 25342 13875 1 17 . 1 1 87 87 TRP CA C 87 50.887 50.887 57.975 -7.088 25342 13876 1 17 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.284 -3.974 25342 13877 1 17 . 1 1 87 87 TRP H H 87 9.555 9.555 8.791 0.764 25342 13878 1 17 . 1 1 88 88 SER N N 88 122.660 122.660 116.403 6.257 25342 13879 1 17 . 1 1 88 88 SER HA H 88 4.582 4.582 4.094 0.488 25342 13880 1 17 . 1 1 88 88 SER C C 88 172.096 172.096 175.411 -3.315 25342 13881 1 17 . 1 1 88 88 SER CA C 88 55.391 55.391 60.763 -5.372 25342 13882 1 17 . 1 1 88 88 SER CB C 88 57.813 57.813 62.525 -4.712 25342 13883 1 17 . 1 1 88 88 SER H H 88 10.257 10.257 8.851 1.406 25342 13884 1 17 . 1 1 89 89 GLY N N 89 128.381 128.381 114.254 14.127 25342 13885 1 17 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.863 -2.234 25342 13886 1 17 . 1 1 89 89 GLY H H 89 6.372 6.372 8.216 -1.844 25342 13887 1 17 . 1 1 90 90 TYR N N 90 120.345 120.345 118.586 1.759 25342 13888 1 17 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.880 -0.691 25342 13889 1 17 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.188 -0.639 25342 13890 1 17 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.699 -1.504 25342 13891 1 17 . 1 1 90 90 TYR H H 90 8.113 8.113 7.092 1.021 25342 13892 1 17 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.522 0.312 25342 13893 1 17 . 1 1 91 91 PRO C C 91 170.911 170.911 176.522 -5.611 25342 13894 1 17 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.660 -3.825 25342 13895 1 17 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.607 -6.537 25342 13896 1 17 . 1 1 92 92 ALA N N 92 120.629 120.629 121.057 -0.428 25342 13897 1 17 . 1 1 92 92 ALA HA H 92 3.619 3.619 4.060 -0.441 25342 13898 1 17 . 1 1 92 92 ALA C C 92 176.782 176.782 176.961 -0.179 25342 13899 1 17 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.951 -1.534 25342 13900 1 17 . 1 1 92 92 ALA CB C 92 15.516 15.516 18.354 -2.838 25342 13901 1 17 . 1 1 92 92 ALA H H 92 7.554 7.554 8.427 -0.873 25342 13902 1 17 . 1 1 93 93 THR N N 93 112.558 112.558 113.090 -0.532 25342 13903 1 17 . 1 1 93 93 THR CB C 93 64.173 64.173 68.421 -4.248 25342 13904 1 17 . 1 1 93 93 THR H H 93 6.730 6.730 7.739 -1.009 25342 13905 1 17 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.404 -0.545 25342 13906 1 17 . 1 1 94 94 PRO C C 94 173.309 173.309 177.693 -4.384 25342 13907 1 17 . 1 1 94 94 PRO CA C 94 63.063 63.063 65.133 -2.070 25342 13908 1 17 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.934 -2.655 25342 13909 1 17 . 1 1 95 95 ILE N N 95 111.014 111.014 118.222 -7.208 25342 13910 1 17 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.016 -0.411 25342 13911 1 17 . 1 1 95 95 ILE C C 95 174.302 174.302 178.129 -3.827 25342 13912 1 17 . 1 1 95 95 ILE CA C 95 57.181 57.181 62.037 -4.856 25342 13913 1 17 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.579 -4.796 25342 13914 1 17 . 1 1 95 95 ILE H H 95 7.995 7.995 8.148 -0.153 25342 13915 1 17 . 1 1 96 96 LYS N N 96 123.208 123.208 121.620 1.588 25342 13916 1 17 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.060 -0.968 25342 13917 1 17 . 1 1 96 96 LYS C C 96 174.451 174.451 178.500 -4.049 25342 13918 1 17 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.932 -2.891 25342 13919 1 17 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.919 -3.172 25342 13920 1 17 . 1 1 96 96 LYS H H 96 6.928 6.928 8.493 -1.565 25342 13921 1 17 . 1 1 97 97 THR N N 97 113.320 113.320 113.922 -0.602 25342 13922 1 17 . 1 1 97 97 THR HA H 97 3.436 3.436 3.664 -0.228 25342 13923 1 17 . 1 1 97 97 THR C C 97 173.221 173.221 176.377 -3.156 25342 13924 1 17 . 1 1 97 97 THR CA C 97 62.710 62.710 65.461 -2.751 25342 13925 1 17 . 1 1 97 97 THR CB C 97 65.562 65.562 68.325 -2.763 25342 13926 1 17 . 1 1 97 97 THR H H 97 6.325 6.325 7.860 -1.535 25342 13927 1 17 . 1 1 98 98 LEU N N 98 120.963 120.963 123.463 -2.500 25342 13928 1 17 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.187 -0.562 25342 13929 1 17 . 1 1 98 98 LEU C C 98 174.713 174.713 177.123 -2.410 25342 13930 1 17 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.471 -1.958 25342 13931 1 17 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.570 -1.842 25342 13932 1 17 . 1 1 98 98 LEU H H 98 7.536 7.536 7.433 0.103 25342 13933 1 17 . 1 1 99 99 LEU N N 99 118.859 118.859 118.513 0.346 25342 13934 1 17 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.885 -0.213 25342 13935 1 17 . 1 1 99 99 LEU C C 99 177.458 177.458 178.673 -1.215 25342 13936 1 17 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.084 -2.939 25342 13937 1 17 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.089 -2.232 25342 13938 1 17 . 1 1 99 99 LEU H H 99 8.179 8.179 8.232 -0.053 25342 13939 1 17 . 1 1 100 100 ASP N N 100 118.703 118.703 118.101 0.602 25342 13940 1 17 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.336 -0.115 25342 13941 1 17 . 1 1 100 100 ASP C C 100 176.472 176.472 179.198 -2.726 25342 13942 1 17 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.937 -2.630 25342 13943 1 17 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.864 -3.506 25342 13944 1 17 . 1 1 100 100 ASP H H 100 7.867 7.867 7.812 0.055 25342 13945 1 17 . 1 1 101 101 GLN N N 101 117.829 117.829 118.765 -0.936 25342 13946 1 17 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.108 0.092 25342 13947 1 17 . 1 1 101 101 GLN C C 101 174.508 174.508 178.113 -3.605 25342 13948 1 17 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.523 -3.835 25342 13949 1 17 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.101 -3.504 25342 13950 1 17 . 1 1 101 101 GLN H H 101 7.597 7.597 7.712 -0.115 25342 13951 1 17 . 1 1 102 102 MET N N 102 118.406 118.406 113.814 4.592 25342 13952 1 17 . 1 1 102 102 MET HA H 102 3.864 3.864 4.895 -1.031 25342 13953 1 17 . 1 1 102 102 MET C C 102 172.820 172.820 177.053 -4.233 25342 13954 1 17 . 1 1 102 102 MET CA C 102 53.298 53.298 55.069 -1.771 25342 13955 1 17 . 1 1 102 102 MET CB C 102 31.207 31.207 31.991 -0.784 25342 13956 1 17 . 1 1 102 102 MET H H 102 7.434 7.434 7.991 -0.557 25342 13957 1 17 . 1 1 103 103 LYS N N 103 115.889 115.889 122.293 -6.404 25342 13958 1 17 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.912 0.007 25342 13959 1 17 . 1 1 103 103 LYS C C 103 173.938 173.938 177.213 -3.275 25342 13960 1 17 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.351 -2.914 25342 13961 1 17 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.906 -2.643 25342 13962 1 17 . 1 1 103 103 LYS H H 103 6.881 6.881 7.845 -0.964 25342 13963 1 17 . 1 1 104 104 ASN N N 104 114.951 114.951 115.063 -0.112 25342 13964 1 17 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.533 0.198 25342 13965 1 17 . 1 1 104 104 ASN C C 104 172.617 172.617 176.285 -3.668 25342 13966 1 17 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.946 -3.679 25342 13967 1 17 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.163 -2.380 25342 13968 1 17 . 1 1 104 104 ASN H H 104 8.493 8.493 8.121 0.372 25342 13969 1 17 . 1 1 105 105 TYR N N 105 122.680 122.680 122.490 0.190 25342 13970 1 17 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.255 0.307 25342 13971 1 17 . 1 1 105 105 TYR CA C 105 55.433 55.433 59.609 -4.176 25342 13972 1 17 . 1 1 105 105 TYR CB C 105 35.832 35.832 38.859 -3.027 25342 13973 1 17 . 1 1 105 105 TYR H H 105 8.217 8.217 8.017 0.200 25342 13974 1 17 . 1 1 106 106 ARG N N 106 128.872 128.872 127.267 1.605 25342 13975 1 17 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.408 -0.143 25342 13976 1 17 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.778 -1.796 25342 13977 1 17 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.871 -3.741 25342 13978 1 17 . 1 1 106 106 ARG H H 106 8.801 8.801 7.985 0.816 25342 13979 1 17 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.406 -2.005 25342 13980 1 17 . 1 1 108 108 GLU N N 108 117.000 117.000 121.446 -4.446 25342 13981 1 17 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.522 0.104 25342 13982 1 17 . 1 1 108 108 GLU C C 108 174.125 174.125 175.678 -1.553 25342 13983 1 17 . 1 1 108 108 GLU CA C 108 53.788 53.788 56.648 -2.860 25342 13984 1 17 . 1 1 108 108 GLU CB C 108 30.440 30.440 31.747 -1.306 25342 13985 1 17 . 1 1 108 108 GLU H H 108 7.514 7.514 8.603 -1.089 25342 13986 1 17 . 1 1 109 109 VAL N N 109 123.398 123.398 121.354 2.044 25342 13987 1 17 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.942 0.395 25342 13988 1 17 . 1 1 109 109 VAL C C 109 170.606 170.606 173.942 -3.336 25342 13989 1 17 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.881 -3.601 25342 13990 1 17 . 1 1 109 109 VAL CB C 109 32.657 32.657 34.672 -2.015 25342 13991 1 17 . 1 1 109 109 VAL H H 109 8.942 8.942 8.018 0.924 25342 13992 1 17 . 1 1 110 110 ALA N N 110 127.905 127.905 129.174 -1.269 25342 13993 1 17 . 1 1 110 110 ALA HA H 110 4.627 4.627 5.011 -0.384 25342 13994 1 17 . 1 1 110 110 ALA C C 110 173.195 173.195 175.704 -2.509 25342 13995 1 17 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.541 -2.195 25342 13996 1 17 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.313 -3.988 25342 13997 1 17 . 1 1 110 110 ALA H H 110 8.776 8.776 8.168 0.608 25342 13998 1 17 . 1 1 111 111 SER N N 111 110.523 110.523 114.983 -4.460 25342 13999 1 17 . 1 1 111 111 SER HA H 111 5.562 5.562 5.124 0.438 25342 14000 1 17 . 1 1 111 111 SER C C 111 170.719 170.719 173.747 -3.028 25342 14001 1 17 . 1 1 111 111 SER CA C 111 51.314 51.314 56.984 -5.670 25342 14002 1 17 . 1 1 111 111 SER CB C 111 61.907 61.907 63.876 -1.969 25342 14003 1 17 . 1 1 111 111 SER H H 111 7.480 7.480 7.978 -0.498 25342 14004 1 17 . 1 1 112 112 PHE N N 112 125.567 125.567 122.016 3.551 25342 14005 1 17 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.507 0.849 25342 14006 1 17 . 1 1 112 112 PHE C C 112 169.536 169.536 173.632 -4.096 25342 14007 1 17 . 1 1 112 112 PHE CA C 112 50.371 50.371 56.116 -5.745 25342 14008 1 17 . 1 1 112 112 PHE CB C 112 39.788 39.788 40.357 -0.569 25342 14009 1 17 . 1 1 112 112 PHE H H 112 7.848 7.848 8.080 -0.232 25342 14010 1 17 . 1 1 113 113 PHE N N 113 115.065 115.065 116.711 -1.646 25342 14011 1 17 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.121 0.983 25342 14012 1 17 . 1 1 113 113 PHE C C 113 173.006 173.006 174.938 -1.932 25342 14013 1 17 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.904 -5.642 25342 14014 1 17 . 1 1 113 113 PHE CB C 113 38.749 38.749 43.660 -4.911 25342 14015 1 17 . 1 1 113 113 PHE H H 113 7.361 7.361 8.137 -0.776 25342 14016 1 17 . 1 1 114 114 THR N N 114 108.014 108.014 113.370 -5.356 25342 14017 1 17 . 1 1 114 114 THR HA H 114 4.999 4.999 4.683 0.316 25342 14018 1 17 . 1 1 114 114 THR C C 114 169.874 169.874 172.997 -3.123 25342 14019 1 17 . 1 1 114 114 THR CA C 114 56.500 56.500 60.808 -4.308 25342 14020 1 17 . 1 1 114 114 THR CB C 114 68.809 68.809 70.482 -1.673 25342 14021 1 17 . 1 1 114 114 THR H H 114 7.867 7.867 8.144 -0.277 25342 14022 1 17 . 1 1 115 115 SER N N 115 115.049 115.049 120.757 -5.708 25342 14023 1 17 . 1 1 115 115 SER HA H 115 5.613 5.613 4.548 1.065 25342 14024 1 17 . 1 1 115 115 SER C C 115 171.247 171.247 174.268 -3.021 25342 14025 1 17 . 1 1 115 115 SER CA C 115 54.830 54.830 57.518 -2.688 25342 14026 1 17 . 1 1 115 115 SER CB C 115 63.992 63.992 65.405 -1.413 25342 14027 1 17 . 1 1 115 115 SER H H 115 8.970 8.970 8.516 0.454 25342 14028 1 17 . 1 1 116 116 ALA N N 116 122.671 122.671 122.317 0.354 25342 14029 1 17 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.393 0.592 25342 14030 1 17 . 1 1 116 116 ALA C C 116 176.180 176.180 178.092 -1.912 25342 14031 1 17 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.257 -3.057 25342 14032 1 17 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.378 -2.383 25342 14033 1 17 . 1 1 116 116 ALA H H 116 8.963 8.963 8.643 0.320 25342 14034 1 17 . 1 1 117 117 GLY N N 117 107.387 107.387 106.995 0.392 25342 14035 1 17 . 1 1 117 117 GLY C C 117 172.528 172.528 174.105 -1.577 25342 14036 1 17 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.155 -1.423 25342 14037 1 17 . 1 1 117 117 GLY H H 117 9.340 9.340 8.272 1.068 25342 14038 1 17 . 1 1 118 118 THR N N 118 113.481 113.481 109.484 3.997 25342 14039 1 17 . 1 1 118 118 THR HA H 118 4.651 4.651 4.550 0.101 25342 14040 1 17 . 1 1 118 118 THR C C 118 172.067 172.067 174.082 -2.015 25342 14041 1 17 . 1 1 118 118 THR CA C 118 57.357 57.357 59.743 -2.386 25342 14042 1 17 . 1 1 118 118 THR CB C 118 69.475 69.475 70.429 -0.954 25342 14043 1 17 . 1 1 118 118 THR H H 118 9.373 9.373 7.411 1.962 25342 14044 1 17 . 1 1 119 119 ASN N N 119 113.202 113.202 118.543 -5.341 25342 14045 1 17 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.312 0.306 25342 14046 1 17 . 1 1 119 119 ASN C C 119 173.114 173.114 176.014 -2.900 25342 14047 1 17 . 1 1 119 119 ASN CA C 119 51.684 51.684 53.983 -2.299 25342 14048 1 17 . 1 1 119 119 ASN CB C 119 33.730 33.730 36.593 -2.863 25342 14049 1 17 . 1 1 119 119 ASN H H 119 8.908 8.908 8.864 0.044 25342 14050 1 17 . 1 1 120 120 HIS N N 120 117.315 117.315 115.746 1.569 25342 14051 1 17 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.516 -0.730 25342 14052 1 17 . 1 1 120 120 HIS C C 120 174.381 174.381 176.533 -2.152 25342 14053 1 17 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.566 -4.050 25342 14054 1 17 . 1 1 120 120 HIS CB C 120 26.504 26.504 30.012 -3.508 25342 14055 1 17 . 1 1 120 120 HIS H H 120 8.074 8.074 8.558 -0.484 25342 14056 1 17 . 1 1 121 121 LYS N N 121 118.678 118.678 119.317 -0.639 25342 14057 1 17 . 1 1 121 121 LYS HA H 121 3.834 3.834 4.112 -0.278 25342 14058 1 17 . 1 1 121 121 LYS C C 121 176.564 176.564 178.595 -2.031 25342 14059 1 17 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.321 -1.026 25342 14060 1 17 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.599 -2.657 25342 14061 1 17 . 1 1 121 121 LYS H H 121 8.336 8.336 8.101 0.235 25342 14062 1 17 . 1 1 122 122 ALA N N 122 122.146 122.146 122.831 -0.685 25342 14063 1 17 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.212 -0.517 25342 14064 1 17 . 1 1 122 122 ALA C C 122 175.163 175.163 179.518 -4.355 25342 14065 1 17 . 1 1 122 122 ALA CA C 122 51.692 51.692 55.160 -3.468 25342 14066 1 17 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.144 -2.426 25342 14067 1 17 . 1 1 122 122 ALA H H 122 7.584 7.584 7.610 -0.026 25342 14068 1 17 . 1 1 123 123 TYR N N 123 119.730 119.730 117.379 2.351 25342 14069 1 17 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.040 -0.887 25342 14070 1 17 . 1 1 123 123 TYR C C 123 174.340 174.340 177.541 -3.201 25342 14071 1 17 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.707 -0.309 25342 14072 1 17 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.359 -2.696 25342 14073 1 17 . 1 1 123 123 TYR H H 123 7.317 7.317 7.856 -0.539 25342 14074 1 17 . 1 1 124 124 VAL N N 124 118.649 118.649 119.852 -1.203 25342 14075 1 17 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.173 0.029 25342 14076 1 17 . 1 1 124 124 VAL C C 124 175.603 175.603 178.126 -2.523 25342 14077 1 17 . 1 1 124 124 VAL CA C 124 64.680 64.680 65.724 -1.044 25342 14078 1 17 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.420 -1.131 25342 14079 1 17 . 1 1 124 124 VAL H H 124 7.799 7.799 6.839 0.960 25342 14080 1 17 . 1 1 125 125 SER N N 125 114.475 114.475 116.575 -2.100 25342 14081 1 17 . 1 1 125 125 SER HA H 125 4.032 4.032 4.143 -0.111 25342 14082 1 17 . 1 1 125 125 SER C C 125 174.849 174.849 176.989 -2.140 25342 14083 1 17 . 1 1 125 125 SER CA C 125 59.002 59.002 61.972 -2.970 25342 14084 1 17 . 1 1 125 125 SER CB C 125 59.613 59.613 63.210 -3.597 25342 14085 1 17 . 1 1 125 125 SER H H 125 7.766 7.766 7.881 -0.115 25342 14086 1 17 . 1 1 126 126 HIS N N 126 119.326 119.326 121.632 -2.306 25342 14087 1 17 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.426 -0.299 25342 14088 1 17 . 1 1 126 126 HIS C C 126 172.865 172.865 177.657 -4.792 25342 14089 1 17 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.654 -3.947 25342 14090 1 17 . 1 1 126 126 HIS CB C 126 25.993 25.993 29.641 -3.648 25342 14091 1 17 . 1 1 126 126 HIS H H 126 8.569 8.569 8.843 -0.274 25342 14092 1 17 . 1 1 127 127 PHE N N 127 121.044 121.044 120.491 0.553 25342 14093 1 17 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.160 -0.986 25342 14094 1 17 . 1 1 127 127 PHE C C 127 173.378 173.378 176.969 -3.591 25342 14095 1 17 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.121 -0.254 25342 14096 1 17 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.298 -3.244 25342 14097 1 17 . 1 1 127 127 PHE H H 127 9.139 9.139 8.604 0.535 25342 14098 1 17 . 1 1 128 128 ASN N N 128 114.893 114.893 116.926 -2.033 25342 14099 1 17 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.104 -0.064 25342 14100 1 17 . 1 1 128 128 ASN C C 128 175.230 175.230 178.062 -2.832 25342 14101 1 17 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.616 -2.316 25342 14102 1 17 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.273 -2.102 25342 14103 1 17 . 1 1 128 128 ASN H H 128 7.774 7.774 8.207 -0.433 25342 14104 1 17 . 1 1 129 129 GLU N N 129 119.804 119.804 119.655 0.149 25342 14105 1 17 . 1 1 129 129 GLU HA H 129 4.040 4.040 4.064 -0.024 25342 14106 1 17 . 1 1 129 129 GLU C C 129 177.052 177.052 178.159 -1.107 25342 14107 1 17 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.957 -2.227 25342 14108 1 17 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.611 -2.415 25342 14109 1 17 . 1 1 129 129 GLU H H 129 7.577 7.577 7.877 -0.300 25342 14110 1 17 . 1 1 130 130 TRP N N 130 120.979 120.979 117.775 3.204 25342 14111 1 17 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.709 -0.252 25342 14112 1 17 . 1 1 130 130 TRP C C 130 174.329 174.329 175.558 -1.229 25342 14113 1 17 . 1 1 130 130 TRP CA C 130 54.688 54.688 57.643 -2.955 25342 14114 1 17 . 1 1 130 130 TRP CB C 130 26.991 26.991 30.568 -3.577 25342 14115 1 17 . 1 1 130 130 TRP H H 130 8.225 8.225 7.620 0.605 25342 14116 1 17 . 1 1 131 131 ALA N N 131 120.450 120.450 118.940 1.510 25342 14117 1 17 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.382 -0.446 25342 14118 1 17 . 1 1 131 131 ALA C C 131 172.487 172.487 175.813 -3.326 25342 14119 1 17 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.046 -2.612 25342 14120 1 17 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.276 -2.988 25342 14121 1 17 . 1 1 131 131 ALA H H 131 8.081 8.081 7.105 0.976 25342 14122 1 17 . 1 1 132 132 ASP N N 132 117.813 117.813 120.506 -2.693 25342 14123 1 17 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.407 -0.199 25342 14124 1 17 . 1 1 132 132 ASP C C 132 173.804 173.804 176.807 -3.003 25342 14125 1 17 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.202 -1.021 25342 14126 1 17 . 1 1 132 132 ASP CB C 132 39.321 39.321 41.732 -2.411 25342 14127 1 17 . 1 1 132 132 ASP H H 132 6.772 6.772 7.481 -0.709 25342 14128 1 17 . 1 1 133 133 GLY N N 133 115.052 115.052 111.953 3.099 25342 14129 1 17 . 1 1 133 133 GLY C C 133 172.078 172.078 173.192 -1.114 25342 14130 1 17 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.746 -2.326 25342 14131 1 17 . 1 1 133 133 GLY H H 133 8.626 8.626 8.646 -0.020 25342 14132 1 17 . 1 1 134 134 LEU N N 134 120.063 120.063 118.446 1.617 25342 14133 1 17 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.644 -0.172 25342 14134 1 17 . 1 1 134 134 LEU C C 134 174.079 174.079 175.612 -1.533 25342 14135 1 17 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.377 -2.413 25342 14136 1 17 . 1 1 134 134 LEU CB C 134 40.370 40.370 45.338 -4.968 25342 14137 1 17 . 1 1 134 134 LEU H H 134 8.094 8.094 7.629 0.465 25342 14138 1 17 . 1 1 135 135 ASN N N 135 119.292 119.292 121.618 -2.326 25342 14139 1 17 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.697 -0.074 25342 14140 1 17 . 1 1 135 135 ASN C C 135 170.527 170.527 174.314 -3.787 25342 14141 1 17 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.127 -4.125 25342 14142 1 17 . 1 1 135 135 ASN CB C 135 33.560 33.560 37.992 -4.432 25342 14143 1 17 . 1 1 135 135 ASN H H 135 8.513 8.513 8.799 -0.286 25342 14144 1 17 . 1 1 136 136 VAL N N 136 125.412 125.412 124.832 0.580 25342 14145 1 17 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.405 0.201 25342 14146 1 17 . 1 1 136 136 VAL C C 136 175.420 175.420 177.145 -1.725 25342 14147 1 17 . 1 1 136 136 VAL CA C 136 58.382 58.382 62.379 -3.997 25342 14148 1 17 . 1 1 136 136 VAL CB C 136 29.247 29.247 31.875 -2.628 25342 14149 1 17 . 1 1 136 136 VAL H H 136 7.648 7.648 8.043 -0.395 25342 14150 1 17 . 1 1 137 137 ILE N N 137 121.881 121.881 122.816 -0.935 25342 14151 1 17 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.454 -0.021 25342 14152 1 17 . 1 1 137 137 ILE C C 137 173.906 173.906 175.423 -1.517 25342 14153 1 17 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.305 -2.327 25342 14154 1 17 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.266 -2.070 25342 14155 1 17 . 1 1 137 137 ILE H H 137 9.139 9.139 8.518 0.621 25342 14156 1 17 . 1 1 138 138 GLY N N 138 108.226 108.226 106.871 1.355 25342 14157 1 17 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.034 -1.643 25342 14158 1 17 . 1 1 138 138 GLY H H 138 6.645 6.645 7.251 -0.606 25342 14159 1 17 . 1 1 139 139 VAL N N 139 119.408 119.408 120.882 -1.474 25342 14160 1 17 . 1 1 139 139 VAL HA H 139 5.357 5.357 4.803 0.554 25342 14161 1 17 . 1 1 139 139 VAL C C 139 172.327 172.327 175.498 -3.171 25342 14162 1 17 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.332 -3.065 25342 14163 1 17 . 1 1 139 139 VAL CB C 139 32.743 32.743 32.439 0.304 25342 14164 1 17 . 1 1 139 139 VAL H H 139 8.092 8.092 8.533 -0.441 25342 14165 1 17 . 1 1 140 140 ALA N N 140 127.415 127.415 130.853 -3.438 25342 14166 1 17 . 1 1 140 140 ALA HA H 140 4.445 4.445 4.932 -0.487 25342 14167 1 17 . 1 1 140 140 ALA C C 140 170.718 170.718 176.370 -5.652 25342 14168 1 17 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.925 -2.025 25342 14169 1 17 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.200 -1.141 25342 14170 1 17 . 1 1 140 140 ALA H H 140 9.093 9.093 8.718 0.375 25342 14171 1 17 . 1 1 141 141 ARG N N 141 119.287 119.287 118.632 0.655 25342 14172 1 17 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.424 -2.937 25342 14173 1 17 . 1 1 141 141 ARG C C 141 173.375 173.375 175.710 -2.335 25342 14174 1 17 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.790 -2.906 25342 14175 1 17 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.883 -5.199 25342 14176 1 17 . 1 1 141 141 ARG H H 141 7.620 7.620 8.473 -0.853 25342 14177 1 17 . 1 1 142 142 ASP N N 142 125.999 125.999 120.277 5.722 25342 14178 1 17 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.121 -0.397 25342 14179 1 17 . 1 1 142 142 ASP C C 142 169.292 169.292 175.425 -6.133 25342 14180 1 17 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.759 -3.421 25342 14181 1 17 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.815 -4.138 25342 14182 1 17 . 1 1 142 142 ASP H H 142 9.482 9.482 8.982 0.500 25342 14183 1 17 . 1 1 143 143 ASP N N 143 119.293 119.293 121.604 -2.311 25342 14184 1 17 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.461 -0.155 25342 14185 1 17 . 1 1 143 143 ASP C C 143 175.686 175.686 175.622 0.064 25342 14186 1 17 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.858 -4.953 25342 14187 1 17 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.367 -4.055 25342 14188 1 17 . 1 1 143 143 ASP H H 143 8.108 8.108 8.370 -0.262 25342 14189 1 17 . 1 1 144 144 SER N N 144 115.303 115.303 118.719 -3.416 25342 14190 1 17 . 1 1 144 144 SER HA H 144 3.740 3.740 4.457 -0.717 25342 14191 1 17 . 1 1 144 144 SER C C 144 172.925 172.925 174.572 -1.647 25342 14192 1 17 . 1 1 144 144 SER CA C 144 59.213 59.213 59.141 0.072 25342 14193 1 17 . 1 1 144 144 SER CB C 144 60.806 60.806 63.655 -2.849 25342 14194 1 17 . 1 1 144 144 SER H H 144 7.642 7.642 7.910 -0.268 25342 14195 1 17 . 1 1 145 145 GLU N N 145 119.523 119.523 120.902 -1.379 25342 14196 1 17 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.116 0.190 25342 14197 1 17 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.702 -3.663 25342 14198 1 17 . 1 1 145 145 GLU CB C 145 26.800 26.800 30.122 -3.322 25342 14199 1 17 . 1 1 145 145 GLU H H 145 7.771 7.771 7.812 -0.041 25342 14200 1 17 . 1 1 146 146 VAL N N 146 118.683 118.683 122.755 -4.072 25342 14201 1 17 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.432 -0.491 25342 14202 1 17 . 1 1 146 146 VAL C C 146 174.591 174.591 176.412 -1.821 25342 14203 1 17 . 1 1 146 146 VAL CA C 146 63.932 63.932 65.412 -1.480 25342 14204 1 17 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.642 -2.595 25342 14205 1 17 . 1 1 146 146 VAL H H 146 6.352 6.352 7.669 -1.317 25342 14206 1 17 . 1 1 147 147 ASP N N 147 119.312 119.312 115.600 3.712 25342 14207 1 17 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.366 -0.311 25342 14208 1 17 . 1 1 147 147 ASP C C 147 174.783 174.783 176.619 -1.836 25342 14209 1 17 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.215 -1.974 25342 14210 1 17 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.652 -3.419 25342 14211 1 17 . 1 1 147 147 ASP H H 147 8.370 8.370 8.477 -0.107 25342 14212 1 17 . 1 1 148 148 LYS N N 148 119.342 119.342 115.049 4.293 25342 14213 1 17 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.488 -0.551 25342 14214 1 17 . 1 1 148 148 LYS C C 148 176.384 176.384 178.509 -2.125 25342 14215 1 17 . 1 1 148 148 LYS CA C 148 55.706 55.706 56.599 -0.893 25342 14216 1 17 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.653 -3.142 25342 14217 1 17 . 1 1 148 148 LYS H H 148 7.040 7.040 7.408 -0.368 25342 14218 1 17 . 1 1 149 149 TRP N N 149 118.258 118.258 121.247 -2.989 25342 14219 1 17 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.798 -0.207 25342 14220 1 17 . 1 1 149 149 TRP C C 149 174.212 174.212 177.091 -2.879 25342 14221 1 17 . 1 1 149 149 TRP CA C 149 53.745 53.745 56.440 -2.695 25342 14222 1 17 . 1 1 149 149 TRP CB C 149 26.940 26.940 29.796 -2.856 25342 14223 1 17 . 1 1 149 149 TRP H H 149 7.811 7.811 7.824 -0.013 25342 14224 1 17 . 1 1 150 150 SER N N 150 109.618 109.618 113.026 -3.408 25342 14225 1 17 . 1 1 150 150 SER HA H 150 4.234 4.234 4.836 -0.602 25342 14226 1 17 . 1 1 150 150 SER C C 150 170.189 170.189 173.218 -3.029 25342 14227 1 17 . 1 1 150 150 SER CA C 150 56.695 56.695 57.454 -0.759 25342 14228 1 17 . 1 1 150 150 SER CB C 150 61.935 61.935 63.455 -1.520 25342 14229 1 17 . 1 1 150 150 SER H H 150 7.793 7.793 7.667 0.126 25342 14230 1 18 . 1 1 3 3 ALA N N 3 125.638 125.638 124.440 1.198 25342 14231 1 18 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.466 -0.101 25342 14232 1 18 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.866 -3.568 25342 14233 1 18 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.474 -2.615 25342 14234 1 18 . 1 1 3 3 ALA H H 3 8.325 8.325 8.364 -0.039 25342 14235 1 18 . 1 1 4 4 LYS N N 4 121.813 121.813 122.871 -1.058 25342 14236 1 18 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.640 -0.413 25342 14237 1 18 . 1 1 4 4 LYS C C 4 174.574 174.574 174.275 0.299 25342 14238 1 18 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.300 -1.518 25342 14239 1 18 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.676 -3.186 25342 14240 1 18 . 1 1 4 4 LYS H H 4 8.486 8.486 8.067 0.419 25342 14241 1 18 . 1 1 5 5 LYS N N 5 129.722 129.722 122.512 7.210 25342 14242 1 18 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.578 -0.060 25342 14243 1 18 . 1 1 5 5 LYS C C 5 174.720 174.720 174.558 0.162 25342 14244 1 18 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.977 -1.255 25342 14245 1 18 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.213 -6.428 25342 14246 1 18 . 1 1 5 5 LYS H H 5 10.015 10.015 8.485 1.530 25342 14247 1 18 . 1 1 6 6 THR N N 6 126.254 126.254 116.715 9.539 25342 14248 1 18 . 1 1 6 6 THR HA H 6 5.654 5.654 5.165 0.489 25342 14249 1 18 . 1 1 6 6 THR C C 6 169.926 169.926 173.350 -3.424 25342 14250 1 18 . 1 1 6 6 THR CA C 6 60.598 60.598 61.981 -1.383 25342 14251 1 18 . 1 1 6 6 THR CB C 6 68.041 68.041 70.139 -2.098 25342 14252 1 18 . 1 1 6 6 THR H H 6 8.538 8.538 8.611 -0.073 25342 14253 1 18 . 1 1 7 7 LEU N N 7 130.775 130.775 128.410 2.365 25342 14254 1 18 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.654 -0.060 25342 14255 1 18 . 1 1 7 7 LEU C C 7 170.404 170.404 174.206 -3.802 25342 14256 1 18 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.282 -3.349 25342 14257 1 18 . 1 1 7 7 LEU CB C 7 40.728 40.728 43.926 -3.198 25342 14258 1 18 . 1 1 7 7 LEU H H 7 8.575 8.575 8.090 0.485 25342 14259 1 18 . 1 1 8 8 ILE N N 8 127.242 127.242 123.212 4.030 25342 14260 1 18 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.398 0.450 25342 14261 1 18 . 1 1 8 8 ILE C C 8 170.936 170.936 174.127 -3.191 25342 14262 1 18 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.175 -2.923 25342 14263 1 18 . 1 1 8 8 ILE CB C 8 36.935 36.935 39.752 -2.817 25342 14264 1 18 . 1 1 8 8 ILE H H 8 9.217 9.217 8.269 0.948 25342 14265 1 18 . 1 1 9 9 LEU N N 9 127.183 127.183 127.684 -0.501 25342 14266 1 18 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.738 0.956 25342 14267 1 18 . 1 1 9 9 LEU C C 9 173.824 173.824 175.027 -1.203 25342 14268 1 18 . 1 1 9 9 LEU CA C 9 49.839 49.839 54.137 -4.298 25342 14269 1 18 . 1 1 9 9 LEU CB C 9 43.963 43.963 43.708 0.256 25342 14270 1 18 . 1 1 9 9 LEU H H 9 9.248 9.248 8.434 0.814 25342 14271 1 18 . 1 1 10 10 TYR N N 10 113.330 113.330 120.194 -6.864 25342 14272 1 18 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.603 -0.089 25342 14273 1 18 . 1 1 10 10 TYR C C 10 167.898 167.898 173.946 -6.048 25342 14274 1 18 . 1 1 10 10 TYR CA C 10 52.875 52.875 53.195 -0.320 25342 14275 1 18 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.484 -2.048 25342 14276 1 18 . 1 1 10 10 TYR H H 10 7.306 7.306 8.020 -0.714 25342 14277 1 18 . 1 1 11 11 TYR N N 11 121.297 121.297 121.418 -0.121 25342 14278 1 18 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.061 -0.299 25342 14279 1 18 . 1 1 11 11 TYR C C 11 169.698 169.698 175.103 -5.405 25342 14280 1 18 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.699 -1.652 25342 14281 1 18 . 1 1 11 11 TYR CB C 11 40.538 40.538 42.051 -1.513 25342 14282 1 18 . 1 1 11 11 TYR H H 11 7.891 7.891 8.595 -0.704 25342 14283 1 18 . 1 1 12 12 SER N N 12 117.763 117.763 119.556 -1.793 25342 14284 1 18 . 1 1 12 12 SER HA H 12 4.679 4.679 4.464 0.215 25342 14285 1 18 . 1 1 12 12 SER C C 12 170.075 170.075 172.943 -2.868 25342 14286 1 18 . 1 1 12 12 SER CA C 12 53.619 53.619 56.180 -2.561 25342 14287 1 18 . 1 1 12 12 SER CB C 12 62.847 62.847 65.103 -2.256 25342 14288 1 18 . 1 1 12 12 SER H H 12 7.557 7.557 7.944 -0.387 25342 14289 1 18 . 1 1 13 13 TRP N N 13 135.232 135.232 128.000 7.232 25342 14290 1 18 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.098 0.538 25342 14291 1 18 . 1 1 13 13 TRP C C 13 175.708 175.708 176.124 -0.416 25342 14292 1 18 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.246 -2.130 25342 14293 1 18 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.952 -2.317 25342 14294 1 18 . 1 1 13 13 TRP H H 13 9.755 9.755 8.610 1.145 25342 14295 1 18 . 1 1 14 14 SER N N 14 113.789 113.789 111.842 1.947 25342 14296 1 18 . 1 1 14 14 SER HA H 14 4.223 4.223 4.371 -0.148 25342 14297 1 18 . 1 1 14 14 SER C C 14 172.747 172.747 173.822 -1.075 25342 14298 1 18 . 1 1 14 14 SER CA C 14 53.828 53.828 57.946 -4.118 25342 14299 1 18 . 1 1 14 14 SER CB C 14 60.037 60.037 62.420 -2.383 25342 14300 1 18 . 1 1 14 14 SER H H 14 10.026 10.026 7.638 2.388 25342 14301 1 18 . 1 1 15 15 GLY N N 15 110.489 110.489 110.793 -0.304 25342 14302 1 18 . 1 1 15 15 GLY CA C 15 44.659 44.659 46.154 -1.495 25342 14303 1 18 . 1 1 15 15 GLY H H 15 7.391 7.391 8.048 -0.657 25342 14304 1 18 . 1 1 16 16 GLU N N 16 129.005 129.005 121.113 7.892 25342 14305 1 18 . 1 1 16 16 GLU HA H 16 4.063 4.063 3.996 0.067 25342 14306 1 18 . 1 1 16 16 GLU CA C 16 56.761 56.761 59.421 -2.660 25342 14307 1 18 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.583 -3.171 25342 14308 1 18 . 1 1 16 16 GLU H H 16 11.550 11.550 8.619 2.931 25342 14309 1 18 . 1 1 17 17 THR N N 17 123.016 123.016 112.193 10.823 25342 14310 1 18 . 1 1 17 17 THR HA H 17 4.035 4.035 4.171 -0.136 25342 14311 1 18 . 1 1 17 17 THR C C 17 173.360 173.360 175.279 -1.919 25342 14312 1 18 . 1 1 17 17 THR CA C 17 64.303 64.303 63.742 0.561 25342 14313 1 18 . 1 1 17 17 THR CB C 17 63.999 63.999 68.576 -4.577 25342 14314 1 18 . 1 1 17 17 THR H H 17 11.293 11.293 8.337 2.956 25342 14315 1 18 . 1 1 18 18 LYS N N 18 120.156 120.156 120.504 -0.348 25342 14316 1 18 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.023 -1.167 25342 14317 1 18 . 1 1 18 18 LYS C C 18 173.901 173.901 177.272 -3.371 25342 14318 1 18 . 1 1 18 18 LYS CA C 18 56.834 56.834 58.284 -1.450 25342 14319 1 18 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.592 -3.111 25342 14320 1 18 . 1 1 18 18 LYS H H 18 6.940 6.940 7.293 -0.353 25342 14321 1 18 . 1 1 19 19 LYS N N 19 117.237 117.237 119.080 -1.843 25342 14322 1 18 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.067 -0.144 25342 14323 1 18 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.818 -2.494 25342 14324 1 18 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.312 -2.951 25342 14325 1 18 . 1 1 19 19 LYS H H 19 7.212 7.212 7.475 -0.263 25342 14326 1 18 . 1 1 20 20 MET N N 20 119.268 119.268 117.550 1.718 25342 14327 1 18 . 1 1 20 20 MET HA H 20 4.413 4.413 4.349 0.064 25342 14328 1 18 . 1 1 20 20 MET C C 20 173.625 173.625 174.601 -0.976 25342 14329 1 18 . 1 1 20 20 MET CA C 20 52.261 52.261 53.917 -1.656 25342 14330 1 18 . 1 1 20 20 MET CB C 20 26.680 26.680 30.429 -3.749 25342 14331 1 18 . 1 1 20 20 MET H H 20 7.600 7.600 7.835 -0.235 25342 14332 1 18 . 1 1 21 21 ALA N N 21 123.669 123.669 120.585 3.084 25342 14333 1 18 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.378 -0.896 25342 14334 1 18 . 1 1 21 21 ALA C C 21 176.628 176.628 178.523 -1.895 25342 14335 1 18 . 1 1 21 21 ALA CA C 21 52.374 52.374 52.886 -0.512 25342 14336 1 18 . 1 1 21 21 ALA CB C 21 16.495 16.495 19.515 -3.019 25342 14337 1 18 . 1 1 21 21 ALA H H 21 8.738 8.738 7.835 0.903 25342 14338 1 18 . 1 1 22 22 GLU N N 22 117.242 117.242 120.720 -3.478 25342 14339 1 18 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.907 -0.234 25342 14340 1 18 . 1 1 22 22 GLU C C 22 176.698 176.698 179.167 -2.469 25342 14341 1 18 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.700 -3.160 25342 14342 1 18 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.366 -2.932 25342 14343 1 18 . 1 1 22 22 GLU H H 22 7.959 7.959 8.250 -0.291 25342 14344 1 18 . 1 1 23 23 LYS N N 23 123.302 123.302 119.323 3.979 25342 14345 1 18 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.037 -0.216 25342 14346 1 18 . 1 1 23 23 LYS C C 23 177.389 177.389 179.006 -1.617 25342 14347 1 18 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.580 -2.658 25342 14348 1 18 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.090 -2.575 25342 14349 1 18 . 1 1 23 23 LYS H H 23 7.703 7.703 7.427 0.276 25342 14350 1 18 . 1 1 24 24 ILE N N 24 122.208 122.208 117.874 4.334 25342 14351 1 18 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.702 -0.419 25342 14352 1 18 . 1 1 24 24 ILE C C 24 174.934 174.934 177.734 -2.800 25342 14353 1 18 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.045 -1.753 25342 14354 1 18 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.723 -2.985 25342 14355 1 18 . 1 1 24 24 ILE H H 24 8.535 8.535 8.004 0.531 25342 14356 1 18 . 1 1 25 25 ASN N N 25 118.640 118.640 118.321 0.319 25342 14357 1 18 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.452 -0.225 25342 14358 1 18 . 1 1 25 25 ASN C C 25 173.530 173.530 176.856 -3.326 25342 14359 1 18 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.419 -4.208 25342 14360 1 18 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.939 -0.835 25342 14361 1 18 . 1 1 25 25 ASN H H 25 8.317 8.317 8.648 -0.331 25342 14362 1 18 . 1 1 26 26 SER N N 26 111.990 111.990 114.887 -2.897 25342 14363 1 18 . 1 1 26 26 SER HA H 26 4.153 4.153 4.329 -0.176 25342 14364 1 18 . 1 1 26 26 SER C C 26 172.110 172.110 175.631 -3.521 25342 14365 1 18 . 1 1 26 26 SER CA C 26 57.905 57.905 61.123 -3.217 25342 14366 1 18 . 1 1 26 26 SER CB C 26 60.655 60.655 63.416 -2.761 25342 14367 1 18 . 1 1 26 26 SER H H 26 7.369 7.369 7.990 -0.621 25342 14368 1 18 . 1 1 27 27 GLU N N 27 120.201 120.201 120.158 0.043 25342 14369 1 18 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.148 -0.047 25342 14370 1 18 . 1 1 27 27 GLU C C 27 173.673 173.673 177.577 -3.904 25342 14371 1 18 . 1 1 27 27 GLU CA C 27 54.235 54.235 58.023 -3.788 25342 14372 1 18 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.218 -3.617 25342 14373 1 18 . 1 1 27 27 GLU H H 27 7.451 7.451 8.075 -0.624 25342 14374 1 18 . 1 1 28 28 ILE N N 28 118.762 118.762 118.748 0.014 25342 14375 1 18 . 1 1 28 28 ILE HA H 28 4.199 4.199 3.963 0.236 25342 14376 1 18 . 1 1 28 28 ILE C C 28 172.487 172.487 176.106 -3.619 25342 14377 1 18 . 1 1 28 28 ILE CA C 28 57.732 57.732 61.795 -4.063 25342 14378 1 18 . 1 1 28 28 ILE CB C 28 35.738 35.738 38.849 -3.111 25342 14379 1 18 . 1 1 28 28 ILE H H 28 7.255 7.255 7.674 -0.419 25342 14380 1 18 . 1 1 29 29 LYS N N 29 130.563 130.563 122.492 8.071 25342 14381 1 18 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.227 -0.225 25342 14382 1 18 . 1 1 29 29 LYS C C 29 174.386 174.386 177.415 -3.029 25342 14383 1 18 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.656 -1.121 25342 14384 1 18 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.507 -2.921 25342 14385 1 18 . 1 1 29 29 LYS H H 29 8.564 8.564 8.570 -0.006 25342 14386 1 18 . 1 1 30 30 ASP N N 30 119.357 119.357 119.418 -0.061 25342 14387 1 18 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.600 -0.198 25342 14388 1 18 . 1 1 30 30 ASP C C 30 172.570 172.570 176.258 -3.688 25342 14389 1 18 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.716 -1.280 25342 14390 1 18 . 1 1 30 30 ASP CB C 30 36.744 36.744 38.499 -1.756 25342 14391 1 18 . 1 1 30 30 ASP H H 30 8.920 8.920 8.700 0.220 25342 14392 1 18 . 1 1 31 31 SER N N 31 114.019 114.019 115.410 -1.391 25342 14393 1 18 . 1 1 31 31 SER HA H 31 4.782 4.782 4.457 0.325 25342 14394 1 18 . 1 1 31 31 SER C C 31 171.150 171.150 174.353 -3.203 25342 14395 1 18 . 1 1 31 31 SER CA C 31 55.551 55.551 58.409 -2.858 25342 14396 1 18 . 1 1 31 31 SER CB C 31 62.259 62.259 64.799 -2.540 25342 14397 1 18 . 1 1 31 31 SER H H 31 8.006 8.006 8.104 -0.098 25342 14398 1 18 . 1 1 32 32 GLU N N 32 121.455 121.455 118.819 2.636 25342 14399 1 18 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.509 0.231 25342 14400 1 18 . 1 1 32 32 GLU C C 32 171.185 171.185 174.604 -3.419 25342 14401 1 18 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.331 -3.250 25342 14402 1 18 . 1 1 32 32 GLU CB C 32 30.827 30.827 31.681 -0.854 25342 14403 1 18 . 1 1 32 32 GLU H H 32 8.145 8.145 8.297 -0.152 25342 14404 1 18 . 1 1 33 33 LEU N N 33 126.176 126.176 121.207 4.969 25342 14405 1 18 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.618 0.688 25342 14406 1 18 . 1 1 33 33 LEU C C 33 173.365 173.365 175.292 -1.927 25342 14407 1 18 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.552 -3.112 25342 14408 1 18 . 1 1 33 33 LEU CB C 33 43.635 43.635 44.034 -0.399 25342 14409 1 18 . 1 1 33 33 LEU H H 33 8.589 8.589 8.320 0.269 25342 14410 1 18 . 1 1 34 34 LYS N N 34 127.200 127.200 125.982 1.218 25342 14411 1 18 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.819 -0.223 25342 14412 1 18 . 1 1 34 34 LYS C C 34 169.622 169.622 174.429 -4.807 25342 14413 1 18 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.165 -1.836 25342 14414 1 18 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.357 -2.157 25342 14415 1 18 . 1 1 34 34 LYS H H 34 9.380 9.380 8.914 0.466 25342 14416 1 18 . 1 1 35 35 GLU N N 35 122.324 122.324 120.973 1.351 25342 14417 1 18 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.473 -2.140 25342 14418 1 18 . 1 1 35 35 GLU C C 35 172.734 172.734 175.932 -3.198 25342 14419 1 18 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.665 -2.053 25342 14420 1 18 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.278 -3.959 25342 14421 1 18 . 1 1 35 35 GLU H H 35 8.094 8.094 8.493 -0.399 25342 14422 1 18 . 1 1 36 36 VAL N N 36 126.781 126.781 123.448 3.333 25342 14423 1 18 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.499 -0.660 25342 14424 1 18 . 1 1 36 36 VAL C C 36 171.482 171.482 175.224 -3.742 25342 14425 1 18 . 1 1 36 36 VAL CA C 36 59.405 59.405 61.331 -1.926 25342 14426 1 18 . 1 1 36 36 VAL CB C 36 29.348 29.348 33.611 -4.263 25342 14427 1 18 . 1 1 36 36 VAL H H 36 8.660 8.660 9.132 -0.472 25342 14428 1 18 . 1 1 37 37 LYS N N 37 126.065 126.065 119.400 6.665 25342 14429 1 18 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.606 0.359 25342 14430 1 18 . 1 1 37 37 LYS C C 37 173.187 173.187 175.078 -1.891 25342 14431 1 18 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.957 -2.677 25342 14432 1 18 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.996 -3.075 25342 14433 1 18 . 1 1 37 37 LYS H H 37 7.809 7.809 8.289 -0.480 25342 14434 1 18 . 1 1 38 38 VAL N N 38 111.020 111.020 115.759 -4.739 25342 14435 1 18 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.356 0.468 25342 14436 1 18 . 1 1 38 38 VAL C C 38 173.604 173.604 175.378 -1.774 25342 14437 1 18 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.701 -3.318 25342 14438 1 18 . 1 1 38 38 VAL CB C 38 32.376 32.376 33.874 -1.498 25342 14439 1 18 . 1 1 38 38 VAL H H 38 8.305 8.305 8.094 0.211 25342 14440 1 18 . 1 1 39 39 SER N N 39 117.887 117.887 116.188 1.699 25342 14441 1 18 . 1 1 39 39 SER HA H 39 4.183 4.183 4.330 -0.147 25342 14442 1 18 . 1 1 39 39 SER C C 39 173.538 173.538 174.865 -1.327 25342 14443 1 18 . 1 1 39 39 SER CA C 39 56.279 56.279 58.420 -2.141 25342 14444 1 18 . 1 1 39 39 SER CB C 39 60.537 60.537 64.010 -3.473 25342 14445 1 18 . 1 1 39 39 SER H H 39 8.847 8.847 8.204 0.643 25342 14446 1 18 . 1 1 40 40 GLU N N 40 126.316 126.316 123.157 3.159 25342 14447 1 18 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.183 -0.029 25342 14448 1 18 . 1 1 40 40 GLU C C 40 174.586 174.586 176.736 -2.150 25342 14449 1 18 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.582 -1.770 25342 14450 1 18 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.616 -2.896 25342 14451 1 18 . 1 1 40 40 GLU H H 40 9.049 9.049 8.684 0.365 25342 14452 1 18 . 1 1 41 41 GLY N N 41 112.494 112.494 114.795 -2.301 25342 14453 1 18 . 1 1 41 41 GLY C C 41 171.994 171.994 175.510 -3.516 25342 14454 1 18 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.885 -3.423 25342 14455 1 18 . 1 1 41 41 GLY H H 41 8.780 8.780 8.852 -0.072 25342 14456 1 18 . 1 1 42 42 THR N N 42 118.631 118.631 114.925 3.706 25342 14457 1 18 . 1 1 42 42 THR HA H 42 3.582 3.582 3.716 -0.134 25342 14458 1 18 . 1 1 42 42 THR C C 42 171.225 171.225 174.041 -2.816 25342 14459 1 18 . 1 1 42 42 THR CA C 42 64.104 64.104 65.132 -1.028 25342 14460 1 18 . 1 1 42 42 THR CB C 42 65.914 65.914 68.721 -2.807 25342 14461 1 18 . 1 1 42 42 THR H H 42 7.737 7.737 7.492 0.245 25342 14462 1 18 . 1 1 43 43 PHE N N 43 116.279 116.279 115.845 0.434 25342 14463 1 18 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.935 0.085 25342 14464 1 18 . 1 1 43 43 PHE C C 43 170.141 170.141 173.648 -3.507 25342 14465 1 18 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.153 -3.681 25342 14466 1 18 . 1 1 43 43 PHE CB C 43 37.385 37.385 42.062 -4.677 25342 14467 1 18 . 1 1 43 43 PHE H H 43 8.114 8.114 7.539 0.575 25342 14468 1 18 . 1 1 44 44 ASP N N 44 121.513 121.513 119.252 2.261 25342 14469 1 18 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.991 -0.140 25342 14470 1 18 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.296 -3.084 25342 14471 1 18 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.199 0.186 25342 14472 1 18 . 1 1 44 44 ASP H H 44 7.774 7.774 8.926 -1.152 25342 14473 1 18 . 1 1 45 45 ALA N N 45 125.663 125.663 120.826 4.837 25342 14474 1 18 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.814 -0.603 25342 14475 1 18 . 1 1 45 45 ALA C C 45 175.139 175.139 176.803 -1.664 25342 14476 1 18 . 1 1 45 45 ALA CA C 45 51.436 51.436 51.934 -0.498 25342 14477 1 18 . 1 1 45 45 ALA CB C 45 16.232 16.232 20.867 -4.635 25342 14478 1 18 . 1 1 45 45 ALA H H 45 8.324 8.324 8.494 -0.170 25342 14479 1 18 . 1 1 46 46 ASP N N 46 119.288 119.288 121.064 -1.776 25342 14480 1 18 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.580 0.245 25342 14481 1 18 . 1 1 46 46 ASP C C 46 175.013 175.013 177.607 -2.594 25342 14482 1 18 . 1 1 46 46 ASP CA C 46 51.161 51.161 54.652 -3.491 25342 14483 1 18 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.559 -1.326 25342 14484 1 18 . 1 1 46 46 ASP H H 46 9.618 9.618 8.290 1.328 25342 14485 1 18 . 1 1 47 47 MET N N 47 127.347 127.347 123.737 3.610 25342 14486 1 18 . 1 1 47 47 MET HA H 47 3.456 3.456 4.181 -0.726 25342 14487 1 18 . 1 1 47 47 MET C C 47 173.605 173.605 176.936 -3.331 25342 14488 1 18 . 1 1 47 47 MET CA C 47 56.699 56.699 57.875 -1.176 25342 14489 1 18 . 1 1 47 47 MET CB C 47 29.930 29.930 32.285 -2.355 25342 14490 1 18 . 1 1 47 47 MET H H 47 9.178 9.178 8.375 0.803 25342 14491 1 18 . 1 1 48 48 TYR N N 48 121.040 121.040 116.902 4.138 25342 14492 1 18 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.278 -0.406 25342 14493 1 18 . 1 1 48 48 TYR CA C 48 58.712 58.712 60.654 -1.942 25342 14494 1 18 . 1 1 48 48 TYR CB C 48 33.638 33.638 36.719 -3.081 25342 14495 1 18 . 1 1 48 48 TYR H H 48 7.881 7.881 7.568 0.313 25342 14496 1 18 . 1 1 49 49 LYS N N 49 121.754 121.754 120.448 1.306 25342 14497 1 18 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.153 -0.048 25342 14498 1 18 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.258 -2.873 25342 14499 1 18 . 1 1 49 49 LYS CB C 49 29.164 29.164 31.997 -2.833 25342 14500 1 18 . 1 1 49 49 LYS H H 49 8.365 8.365 7.796 0.569 25342 14501 1 18 . 1 1 50 50 THR N N 50 117.557 117.557 110.029 7.528 25342 14502 1 18 . 1 1 50 50 THR HA H 50 3.586 3.586 4.144 -0.558 25342 14503 1 18 . 1 1 50 50 THR CA C 50 65.634 65.634 64.535 1.099 25342 14504 1 18 . 1 1 50 50 THR CB C 50 65.904 65.904 67.703 -1.799 25342 14505 1 18 . 1 1 50 50 THR H H 50 8.007 8.007 8.114 -0.107 25342 14506 1 18 . 1 1 51 51 SER N N 51 115.110 115.110 118.405 -3.295 25342 14507 1 18 . 1 1 51 51 SER HA H 51 3.974 3.974 4.042 -0.068 25342 14508 1 18 . 1 1 51 51 SER CA C 51 59.042 59.042 62.339 -3.297 25342 14509 1 18 . 1 1 51 51 SER CB C 51 59.835 59.835 62.989 -3.154 25342 14510 1 18 . 1 1 51 51 SER H H 51 7.606 7.606 7.466 0.140 25342 14511 1 18 . 1 1 52 52 ASP N N 52 119.713 119.713 121.021 -1.308 25342 14512 1 18 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.574 -0.266 25342 14513 1 18 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.971 -2.445 25342 14514 1 18 . 1 1 52 52 ASP CB C 52 37.688 37.688 40.945 -3.257 25342 14515 1 18 . 1 1 52 52 ASP H H 52 7.552 7.552 7.781 -0.229 25342 14516 1 18 . 1 1 53 53 ILE N N 53 121.982 121.982 119.974 2.008 25342 14517 1 18 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.753 -0.031 25342 14518 1 18 . 1 1 53 53 ILE C C 53 175.325 175.325 177.665 -2.340 25342 14519 1 18 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.797 -3.253 25342 14520 1 18 . 1 1 53 53 ILE CB C 53 36.699 36.699 38.242 -1.544 25342 14521 1 18 . 1 1 53 53 ILE H H 53 7.815 7.815 8.320 -0.505 25342 14522 1 18 . 1 1 54 54 ALA N N 54 121.552 121.552 122.603 -1.051 25342 14523 1 18 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.516 -0.199 25342 14524 1 18 . 1 1 54 54 ALA C C 54 177.475 177.475 179.750 -2.275 25342 14525 1 18 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.824 -2.801 25342 14526 1 18 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.787 -2.803 25342 14527 1 18 . 1 1 54 54 ALA H H 54 8.332 8.332 7.623 0.709 25342 14528 1 18 . 1 1 55 55 LEU N N 55 117.176 117.176 118.977 -1.801 25342 14529 1 18 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.831 0.103 25342 14530 1 18 . 1 1 55 55 LEU C C 55 176.532 176.532 178.427 -1.895 25342 14531 1 18 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.892 -2.561 25342 14532 1 18 . 1 1 55 55 LEU CB C 55 38.428 38.428 40.972 -2.544 25342 14533 1 18 . 1 1 55 55 LEU H H 55 8.195 8.195 8.024 0.171 25342 14534 1 18 . 1 1 56 56 ASP N N 56 120.056 120.056 119.273 0.783 25342 14535 1 18 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.289 0.178 25342 14536 1 18 . 1 1 56 56 ASP C C 56 176.585 176.585 178.919 -2.334 25342 14537 1 18 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.682 -3.132 25342 14538 1 18 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.269 -1.964 25342 14539 1 18 . 1 1 56 56 ASP H H 56 7.806 7.806 7.794 0.012 25342 14540 1 18 . 1 1 57 57 GLN N N 57 120.020 120.020 119.069 0.951 25342 14541 1 18 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.269 -0.146 25342 14542 1 18 . 1 1 57 57 GLN C C 57 175.689 175.689 178.935 -3.246 25342 14543 1 18 . 1 1 57 57 GLN CA C 57 54.405 54.405 58.505 -4.100 25342 14544 1 18 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.888 -5.119 25342 14545 1 18 . 1 1 57 57 GLN H H 57 7.661 7.661 7.581 0.080 25342 14546 1 18 . 1 1 58 58 ILE N N 58 120.644 120.644 120.720 -0.076 25342 14547 1 18 . 1 1 58 58 ILE HA H 58 3.576 3.576 3.193 0.383 25342 14548 1 18 . 1 1 58 58 ILE C C 58 176.237 176.237 177.554 -1.317 25342 14549 1 18 . 1 1 58 58 ILE CA C 58 62.506 62.506 64.052 -1.546 25342 14550 1 18 . 1 1 58 58 ILE CB C 58 36.029 36.029 37.672 -1.643 25342 14551 1 18 . 1 1 58 58 ILE H H 58 8.228 8.228 8.396 -0.168 25342 14552 1 18 . 1 1 59 59 GLN N N 59 115.498 115.498 117.019 -1.521 25342 14553 1 18 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.165 -0.023 25342 14554 1 18 . 1 1 59 59 GLN C C 59 173.781 173.781 176.643 -2.862 25342 14555 1 18 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.184 -2.202 25342 14556 1 18 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.516 -2.905 25342 14557 1 18 . 1 1 59 59 GLN H H 59 8.331 8.331 7.748 0.583 25342 14558 1 18 . 1 1 60 60 GLY N N 60 106.623 106.623 106.423 0.200 25342 14559 1 18 . 1 1 60 60 GLY C C 60 172.068 172.068 175.294 -3.226 25342 14560 1 18 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.278 -2.405 25342 14561 1 18 . 1 1 60 60 GLY H H 60 7.611 7.611 7.671 -0.060 25342 14562 1 18 . 1 1 61 61 ASN N N 61 117.691 117.691 118.297 -0.606 25342 14563 1 18 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.507 0.037 25342 14564 1 18 . 1 1 61 61 ASN C C 61 171.946 171.946 175.982 -4.036 25342 14565 1 18 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.759 -3.190 25342 14566 1 18 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.087 -2.727 25342 14567 1 18 . 1 1 61 61 ASN H H 61 8.151 8.151 8.220 -0.069 25342 14568 1 18 . 1 1 62 62 LYS N N 62 118.289 118.289 118.621 -0.332 25342 14569 1 18 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.669 -0.341 25342 14570 1 18 . 1 1 62 62 LYS C C 62 171.773 171.773 175.224 -3.451 25342 14571 1 18 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.825 -3.529 25342 14572 1 18 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.813 -1.130 25342 14573 1 18 . 1 1 62 62 LYS H H 62 7.242 7.242 7.817 -0.575 25342 14574 1 18 . 1 1 63 63 ASP N N 63 119.888 119.888 121.088 -1.200 25342 14575 1 18 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.701 -0.285 25342 14576 1 18 . 1 1 63 63 ASP C C 63 174.476 174.476 176.583 -2.107 25342 14577 1 18 . 1 1 63 63 ASP CA C 63 51.461 51.461 54.224 -2.764 25342 14578 1 18 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.481 -2.966 25342 14579 1 18 . 1 1 63 63 ASP H H 63 8.230 8.230 8.427 -0.197 25342 14580 1 18 . 1 1 64 64 PHE N N 64 119.789 119.789 117.615 2.174 25342 14581 1 18 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.648 -0.832 25342 14582 1 18 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.903 1.347 25342 14583 1 18 . 1 1 64 64 PHE CB C 64 35.034 35.034 37.184 -2.150 25342 14584 1 18 . 1 1 64 64 PHE H H 64 8.428 8.428 8.530 -0.102 25342 14585 1 18 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.422 -0.109 25342 14586 1 18 . 1 1 65 65 PRO C C 65 173.975 173.975 174.788 -0.813 25342 14587 1 18 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.676 -2.620 25342 14588 1 18 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.626 -3.106 25342 14589 1 18 . 1 1 66 66 GLU N N 66 121.326 121.326 117.398 3.928 25342 14590 1 18 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.285 -0.052 25342 14591 1 18 . 1 1 66 66 GLU C C 66 173.978 173.978 174.482 -0.504 25342 14592 1 18 . 1 1 66 66 GLU CA C 66 53.531 53.531 54.702 -1.171 25342 14593 1 18 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.848 -4.148 25342 14594 1 18 . 1 1 66 66 GLU H H 66 8.225 8.225 8.489 -0.264 25342 14595 1 18 . 1 1 67 67 ILE N N 67 113.897 113.897 113.894 0.003 25342 14596 1 18 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.893 0.276 25342 14597 1 18 . 1 1 67 67 ILE C C 67 172.791 172.791 175.292 -2.501 25342 14598 1 18 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.864 -2.589 25342 14599 1 18 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.503 -2.487 25342 14600 1 18 . 1 1 67 67 ILE H H 67 8.366 8.366 8.114 0.252 25342 14601 1 18 . 1 1 68 68 GLN N N 68 121.654 121.654 118.432 3.222 25342 14602 1 18 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.427 0.092 25342 14603 1 18 . 1 1 68 68 GLN C C 68 171.562 171.562 175.303 -3.741 25342 14604 1 18 . 1 1 68 68 GLN CA C 68 52.313 52.313 55.353 -3.041 25342 14605 1 18 . 1 1 68 68 GLN CB C 68 26.785 26.785 29.215 -2.430 25342 14606 1 18 . 1 1 68 68 GLN H H 68 8.763 8.763 8.338 0.425 25342 14607 1 18 . 1 1 69 69 LEU N N 69 125.289 125.289 120.993 4.296 25342 14608 1 18 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.422 0.097 25342 14609 1 18 . 1 1 69 69 LEU C C 69 172.567 172.567 176.519 -3.952 25342 14610 1 18 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.953 -3.156 25342 14611 1 18 . 1 1 69 69 LEU CB C 69 42.742 42.742 42.889 -0.147 25342 14612 1 18 . 1 1 69 69 LEU H H 69 7.996 7.996 7.737 0.259 25342 14613 1 18 . 1 1 70 70 ASP N N 70 123.170 123.170 121.971 1.199 25342 14614 1 18 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.689 -0.283 25342 14615 1 18 . 1 1 70 70 ASP C C 70 171.978 171.978 175.549 -3.571 25342 14616 1 18 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.236 -2.554 25342 14617 1 18 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.518 -2.789 25342 14618 1 18 . 1 1 70 70 ASP H H 70 8.278 8.278 8.362 -0.084 25342 14619 1 18 . 1 1 71 71 ASN N N 71 117.524 117.524 119.687 -2.163 25342 14620 1 18 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.636 -0.309 25342 14621 1 18 . 1 1 71 71 ASN C C 71 171.825 171.825 174.229 -2.404 25342 14622 1 18 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.127 -1.470 25342 14623 1 18 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.921 -3.691 25342 14624 1 18 . 1 1 71 71 ASN H H 71 8.372 8.372 8.491 -0.119 25342 14625 1 18 . 1 1 72 72 ILE N N 72 124.515 124.515 123.932 0.583 25342 14626 1 18 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.117 -0.188 25342 14627 1 18 . 1 1 72 72 ILE C C 72 171.607 171.607 174.039 -2.432 25342 14628 1 18 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.014 -2.725 25342 14629 1 18 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.490 -2.731 25342 14630 1 18 . 1 1 72 72 ILE H H 72 7.653 7.653 8.055 -0.402 25342 14631 1 18 . 1 1 73 73 ASP N N 73 125.182 125.182 127.065 -1.883 25342 14632 1 18 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.491 0.137 25342 14633 1 18 . 1 1 73 73 ASP C C 73 173.980 173.980 176.090 -2.110 25342 14634 1 18 . 1 1 73 73 ASP CA C 73 49.214 49.214 55.082 -5.868 25342 14635 1 18 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.733 -3.831 25342 14636 1 18 . 1 1 73 73 ASP H H 73 8.382 8.382 8.579 -0.197 25342 14637 1 18 . 1 1 74 74 TYR N N 74 123.092 123.092 122.779 0.313 25342 14638 1 18 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.733 -0.868 25342 14639 1 18 . 1 1 74 74 TYR C C 74 173.582 173.582 177.050 -3.468 25342 14640 1 18 . 1 1 74 74 TYR CA C 74 59.486 59.486 58.201 1.285 25342 14641 1 18 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.030 -3.222 25342 14642 1 18 . 1 1 74 74 TYR H H 74 7.348 7.348 7.896 -0.548 25342 14643 1 18 . 1 1 75 75 ASN N N 75 109.447 109.447 115.139 -5.692 25342 14644 1 18 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.741 0.184 25342 14645 1 18 . 1 1 75 75 ASN C C 75 172.570 172.570 175.505 -2.935 25342 14646 1 18 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.793 -2.175 25342 14647 1 18 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.147 -2.613 25342 14648 1 18 . 1 1 75 75 ASN H H 75 8.040 8.040 8.778 -0.738 25342 14649 1 18 . 1 1 76 76 ASN N N 76 117.411 117.411 115.280 2.131 25342 14650 1 18 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.691 -0.237 25342 14651 1 18 . 1 1 76 76 ASN C C 76 171.155 171.155 174.656 -3.501 25342 14652 1 18 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.761 -2.826 25342 14653 1 18 . 1 1 76 76 ASN CB C 76 35.658 35.658 40.078 -4.420 25342 14654 1 18 . 1 1 76 76 ASN H H 76 7.750 7.750 7.921 -0.171 25342 14655 1 18 . 1 1 77 77 TYR N N 77 116.878 116.878 118.902 -2.024 25342 14656 1 18 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.697 -0.343 25342 14657 1 18 . 1 1 77 77 TYR C C 77 172.224 172.224 174.962 -2.738 25342 14658 1 18 . 1 1 77 77 TYR CA C 77 55.240 55.240 57.910 -2.670 25342 14659 1 18 . 1 1 77 77 TYR CB C 77 37.113 37.113 40.431 -3.318 25342 14660 1 18 . 1 1 77 77 TYR H H 77 7.789 7.789 7.717 0.072 25342 14661 1 18 . 1 1 78 78 ASP N N 78 121.352 121.352 120.061 1.291 25342 14662 1 18 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.860 -0.063 25342 14663 1 18 . 1 1 78 78 ASP C C 78 172.623 172.623 175.355 -2.732 25342 14664 1 18 . 1 1 78 78 ASP CA C 78 53.190 53.190 54.646 -1.456 25342 14665 1 18 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.809 -2.774 25342 14666 1 18 . 1 1 78 78 ASP H H 78 9.036 9.036 8.603 0.433 25342 14667 1 18 . 1 1 79 79 LEU N N 79 123.073 123.073 119.370 3.703 25342 14668 1 18 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.471 -0.363 25342 14669 1 18 . 1 1 79 79 LEU C C 79 170.730 170.730 174.268 -3.538 25342 14670 1 18 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.308 -3.051 25342 14671 1 18 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.390 -4.106 25342 14672 1 18 . 1 1 79 79 LEU H H 79 7.877 7.877 7.924 -0.047 25342 14673 1 18 . 1 1 80 80 ILE N N 80 126.348 126.348 123.829 2.519 25342 14674 1 18 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.765 0.304 25342 14675 1 18 . 1 1 80 80 ILE C C 80 171.584 171.584 174.295 -2.711 25342 14676 1 18 . 1 1 80 80 ILE CA C 80 57.415 57.415 59.936 -2.521 25342 14677 1 18 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.611 -2.613 25342 14678 1 18 . 1 1 80 80 ILE H H 80 8.704 8.704 8.457 0.247 25342 14679 1 18 . 1 1 81 81 LEU N N 81 126.303 126.303 128.230 -1.927 25342 14680 1 18 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.624 0.499 25342 14681 1 18 . 1 1 81 81 LEU C C 81 172.779 172.779 175.507 -2.728 25342 14682 1 18 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.588 -5.079 25342 14683 1 18 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.541 -1.826 25342 14684 1 18 . 1 1 81 81 LEU H H 81 9.202 9.202 8.575 0.627 25342 14685 1 18 . 1 1 82 82 ILE N N 82 120.931 120.931 120.830 0.101 25342 14686 1 18 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.092 -0.245 25342 14687 1 18 . 1 1 82 82 ILE C C 82 172.796 172.796 175.169 -2.373 25342 14688 1 18 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.157 -2.276 25342 14689 1 18 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.657 -4.860 25342 14690 1 18 . 1 1 82 82 ILE H H 82 8.846 8.846 8.374 0.472 25342 14691 1 18 . 1 1 83 83 GLY N N 83 120.905 120.905 110.253 10.652 25342 14692 1 18 . 1 1 83 83 GLY CA C 83 40.557 40.557 44.679 -4.122 25342 14693 1 18 . 1 1 83 83 GLY H H 83 9.558 9.558 7.977 1.581 25342 14694 1 18 . 1 1 84 84 SER N N 84 116.601 116.601 115.693 0.908 25342 14695 1 18 . 1 1 84 84 SER HA H 84 5.476 5.476 5.221 0.255 25342 14696 1 18 . 1 1 84 84 SER CA C 84 51.324 51.324 55.943 -4.619 25342 14697 1 18 . 1 1 84 84 SER CB C 84 64.271 64.271 65.388 -1.117 25342 14698 1 18 . 1 1 84 84 SER H H 84 7.533 7.533 8.681 -1.148 25342 14699 1 18 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.469 0.694 25342 14700 1 18 . 1 1 85 85 PRO C C 85 175.590 175.590 176.480 -0.890 25342 14701 1 18 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.501 -3.618 25342 14702 1 18 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.187 -1.712 25342 14703 1 18 . 1 1 86 86 VAL N N 86 116.295 116.295 120.297 -4.002 25342 14704 1 18 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.196 -0.375 25342 14705 1 18 . 1 1 86 86 VAL C C 86 172.692 172.692 175.281 -2.589 25342 14706 1 18 . 1 1 86 86 VAL CA C 86 59.812 59.812 63.685 -3.873 25342 14707 1 18 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.639 -2.556 25342 14708 1 18 . 1 1 86 86 VAL H H 86 7.246 7.246 7.723 -0.477 25342 14709 1 18 . 1 1 87 87 TRP N N 87 131.042 131.042 126.185 4.857 25342 14710 1 18 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.542 -0.231 25342 14711 1 18 . 1 1 87 87 TRP C C 87 173.323 173.323 177.628 -4.305 25342 14712 1 18 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.651 -4.764 25342 14713 1 18 . 1 1 87 87 TRP CB C 87 27.310 27.310 30.612 -3.302 25342 14714 1 18 . 1 1 87 87 TRP H H 87 9.555 9.555 7.985 1.570 25342 14715 1 18 . 1 1 88 88 SER N N 88 122.660 122.660 117.324 5.336 25342 14716 1 18 . 1 1 88 88 SER HA H 88 4.582 4.582 4.197 0.385 25342 14717 1 18 . 1 1 88 88 SER C C 88 172.096 172.096 174.668 -2.572 25342 14718 1 18 . 1 1 88 88 SER CA C 88 55.391 55.391 60.012 -4.621 25342 14719 1 18 . 1 1 88 88 SER CB C 88 57.813 57.813 61.715 -3.902 25342 14720 1 18 . 1 1 88 88 SER H H 88 10.257 10.257 8.518 1.739 25342 14721 1 18 . 1 1 89 89 GLY N N 89 128.381 128.381 106.144 22.237 25342 14722 1 18 . 1 1 89 89 GLY CA C 89 42.629 42.629 44.936 -2.307 25342 14723 1 18 . 1 1 89 89 GLY H H 89 6.372 6.372 8.035 -1.663 25342 14724 1 18 . 1 1 90 90 TYR N N 90 120.345 120.345 117.985 2.360 25342 14725 1 18 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.242 -1.053 25342 14726 1 18 . 1 1 90 90 TYR CA C 90 53.549 53.549 54.776 -1.227 25342 14727 1 18 . 1 1 90 90 TYR CB C 90 37.195 37.195 39.209 -2.014 25342 14728 1 18 . 1 1 90 90 TYR H H 90 8.113 8.113 7.768 0.345 25342 14729 1 18 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.576 0.258 25342 14730 1 18 . 1 1 91 91 PRO C C 91 170.911 170.911 177.390 -6.479 25342 14731 1 18 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.346 -3.511 25342 14732 1 18 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.503 -6.433 25342 14733 1 18 . 1 1 92 92 ALA N N 92 120.629 120.629 123.572 -2.943 25342 14734 1 18 . 1 1 92 92 ALA HA H 92 3.619 3.619 4.198 -0.579 25342 14735 1 18 . 1 1 92 92 ALA C C 92 176.782 176.782 176.665 0.117 25342 14736 1 18 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.270 -1.853 25342 14737 1 18 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.324 -0.808 25342 14738 1 18 . 1 1 92 92 ALA H H 92 7.554 7.554 8.484 -0.930 25342 14739 1 18 . 1 1 93 93 THR N N 93 112.558 112.558 110.709 1.849 25342 14740 1 18 . 1 1 93 93 THR CB C 93 64.173 64.173 67.231 -3.058 25342 14741 1 18 . 1 1 93 93 THR H H 93 6.730 6.730 7.901 -1.171 25342 14742 1 18 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.482 -0.623 25342 14743 1 18 . 1 1 94 94 PRO C C 94 173.309 173.309 177.243 -3.934 25342 14744 1 18 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.752 -1.689 25342 14745 1 18 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.021 -2.742 25342 14746 1 18 . 1 1 95 95 ILE N N 95 111.014 111.014 116.666 -5.652 25342 14747 1 18 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.121 -0.516 25342 14748 1 18 . 1 1 95 95 ILE C C 95 174.302 174.302 177.423 -3.121 25342 14749 1 18 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.972 -2.792 25342 14750 1 18 . 1 1 95 95 ILE CB C 95 31.783 31.783 37.159 -5.376 25342 14751 1 18 . 1 1 95 95 ILE H H 95 7.995 7.995 8.443 -0.448 25342 14752 1 18 . 1 1 96 96 LYS N N 96 123.208 123.208 121.970 1.238 25342 14753 1 18 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.041 -0.949 25342 14754 1 18 . 1 1 96 96 LYS C C 96 174.451 174.451 178.288 -3.837 25342 14755 1 18 . 1 1 96 96 LYS CA C 96 57.041 57.041 60.103 -3.062 25342 14756 1 18 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.992 -3.245 25342 14757 1 18 . 1 1 96 96 LYS H H 96 6.928 6.928 8.091 -1.163 25342 14758 1 18 . 1 1 97 97 THR N N 97 113.320 113.320 112.781 0.539 25342 14759 1 18 . 1 1 97 97 THR HA H 97 3.436 3.436 4.373 -0.937 25342 14760 1 18 . 1 1 97 97 THR C C 97 173.221 173.221 175.589 -2.368 25342 14761 1 18 . 1 1 97 97 THR CA C 97 62.710 62.710 64.457 -1.747 25342 14762 1 18 . 1 1 97 97 THR CB C 97 65.562 65.562 68.494 -2.932 25342 14763 1 18 . 1 1 97 97 THR H H 97 6.325 6.325 8.280 -1.955 25342 14764 1 18 . 1 1 98 98 LEU N N 98 120.963 120.963 121.656 -0.693 25342 14765 1 18 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.451 -0.826 25342 14766 1 18 . 1 1 98 98 LEU C C 98 174.713 174.713 178.129 -3.416 25342 14767 1 18 . 1 1 98 98 LEU CA C 98 55.514 55.514 56.831 -1.317 25342 14768 1 18 . 1 1 98 98 LEU CB C 98 39.728 39.728 42.417 -2.689 25342 14769 1 18 . 1 1 98 98 LEU H H 98 7.536 7.536 7.594 -0.058 25342 14770 1 18 . 1 1 99 99 LEU N N 99 118.859 118.859 119.708 -0.849 25342 14771 1 18 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.955 -0.283 25342 14772 1 18 . 1 1 99 99 LEU C C 99 177.458 177.458 179.234 -1.776 25342 14773 1 18 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.307 -3.162 25342 14774 1 18 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.185 -2.328 25342 14775 1 18 . 1 1 99 99 LEU H H 99 8.179 8.179 8.539 -0.360 25342 14776 1 18 . 1 1 100 100 ASP N N 100 118.703 118.703 119.153 -0.450 25342 14777 1 18 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.495 -0.274 25342 14778 1 18 . 1 1 100 100 ASP C C 100 176.472 176.472 178.604 -2.132 25342 14779 1 18 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.340 -3.033 25342 14780 1 18 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.994 -3.636 25342 14781 1 18 . 1 1 100 100 ASP H H 100 7.867 7.867 8.510 -0.643 25342 14782 1 18 . 1 1 101 101 GLN N N 101 117.829 117.829 117.417 0.412 25342 14783 1 18 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.345 -0.145 25342 14784 1 18 . 1 1 101 101 GLN C C 101 174.508 174.508 176.592 -2.084 25342 14785 1 18 . 1 1 101 101 GLN CA C 101 54.688 54.688 56.540 -1.852 25342 14786 1 18 . 1 1 101 101 GLN CB C 101 25.597 25.597 28.869 -3.272 25342 14787 1 18 . 1 1 101 101 GLN H H 101 7.597 7.597 7.927 -0.330 25342 14788 1 18 . 1 1 102 102 MET N N 102 118.406 118.406 115.592 2.814 25342 14789 1 18 . 1 1 102 102 MET HA H 102 3.864 3.864 4.926 -1.062 25342 14790 1 18 . 1 1 102 102 MET C C 102 172.820 172.820 176.579 -3.759 25342 14791 1 18 . 1 1 102 102 MET CA C 102 53.298 53.298 55.544 -2.246 25342 14792 1 18 . 1 1 102 102 MET CB C 102 31.207 31.207 33.660 -2.453 25342 14793 1 18 . 1 1 102 102 MET H H 102 7.434 7.434 7.739 -0.305 25342 14794 1 18 . 1 1 103 103 LYS N N 103 115.889 115.889 121.039 -5.150 25342 14795 1 18 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.327 -0.408 25342 14796 1 18 . 1 1 103 103 LYS C C 103 173.938 173.938 177.119 -3.181 25342 14797 1 18 . 1 1 103 103 LYS CA C 103 56.437 56.437 57.771 -1.334 25342 14798 1 18 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.547 -2.284 25342 14799 1 18 . 1 1 103 103 LYS H H 103 6.881 6.881 8.126 -1.245 25342 14800 1 18 . 1 1 104 104 ASN N N 104 114.951 114.951 115.993 -1.042 25342 14801 1 18 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.834 -0.103 25342 14802 1 18 . 1 1 104 104 ASN C C 104 172.617 172.617 174.566 -1.949 25342 14803 1 18 . 1 1 104 104 ASN CA C 104 50.266 50.266 52.908 -2.642 25342 14804 1 18 . 1 1 104 104 ASN CB C 104 35.783 35.783 39.660 -3.877 25342 14805 1 18 . 1 1 104 104 ASN H H 104 8.493 8.493 7.969 0.524 25342 14806 1 18 . 1 1 105 105 TYR N N 105 122.680 122.680 122.825 -0.145 25342 14807 1 18 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.414 0.148 25342 14808 1 18 . 1 1 105 105 TYR CA C 105 55.433 55.433 60.004 -4.571 25342 14809 1 18 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.247 -3.415 25342 14810 1 18 . 1 1 105 105 TYR H H 105 8.217 8.217 7.992 0.225 25342 14811 1 18 . 1 1 106 106 ARG N N 106 128.872 128.872 123.459 5.413 25342 14812 1 18 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.330 -0.065 25342 14813 1 18 . 1 1 106 106 ARG CA C 106 52.982 52.982 54.774 -1.792 25342 14814 1 18 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.472 -5.342 25342 14815 1 18 . 1 1 106 106 ARG H H 106 8.801 8.801 7.858 0.943 25342 14816 1 18 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.524 -2.123 25342 14817 1 18 . 1 1 108 108 GLU N N 108 117.000 117.000 120.259 -3.259 25342 14818 1 18 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.866 -0.240 25342 14819 1 18 . 1 1 108 108 GLU C C 108 174.125 174.125 175.782 -1.657 25342 14820 1 18 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.425 -1.637 25342 14821 1 18 . 1 1 108 108 GLU CB C 108 30.440 30.440 32.481 -2.041 25342 14822 1 18 . 1 1 108 108 GLU H H 108 7.514 7.514 8.377 -0.863 25342 14823 1 18 . 1 1 109 109 VAL N N 109 123.398 123.398 119.415 3.983 25342 14824 1 18 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.114 0.223 25342 14825 1 18 . 1 1 109 109 VAL C C 109 170.606 170.606 173.819 -3.213 25342 14826 1 18 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.155 -2.875 25342 14827 1 18 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.542 -2.885 25342 14828 1 18 . 1 1 109 109 VAL H H 109 8.942 8.942 8.046 0.896 25342 14829 1 18 . 1 1 110 110 ALA N N 110 127.905 127.905 127.330 0.575 25342 14830 1 18 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.935 -0.308 25342 14831 1 18 . 1 1 110 110 ALA C C 110 173.195 173.195 174.554 -1.359 25342 14832 1 18 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.905 -2.559 25342 14833 1 18 . 1 1 110 110 ALA CB C 110 18.325 18.325 22.676 -4.351 25342 14834 1 18 . 1 1 110 110 ALA H H 110 8.776 8.776 8.159 0.617 25342 14835 1 18 . 1 1 111 111 SER N N 111 110.523 110.523 114.607 -4.084 25342 14836 1 18 . 1 1 111 111 SER HA H 111 5.562 5.562 4.641 0.921 25342 14837 1 18 . 1 1 111 111 SER C C 111 170.719 170.719 171.949 -1.230 25342 14838 1 18 . 1 1 111 111 SER CA C 111 51.314 51.314 55.831 -4.517 25342 14839 1 18 . 1 1 111 111 SER CB C 111 61.907 61.907 64.008 -2.101 25342 14840 1 18 . 1 1 111 111 SER H H 111 7.480 7.480 7.580 -0.100 25342 14841 1 18 . 1 1 112 112 PHE N N 112 125.567 125.567 122.744 2.823 25342 14842 1 18 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.772 0.584 25342 14843 1 18 . 1 1 112 112 PHE C C 112 169.536 169.536 174.746 -5.210 25342 14844 1 18 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.452 -5.081 25342 14845 1 18 . 1 1 112 112 PHE CB C 112 39.788 39.788 42.784 -2.996 25342 14846 1 18 . 1 1 112 112 PHE H H 112 7.848 7.848 7.905 -0.057 25342 14847 1 18 . 1 1 113 113 PHE N N 113 115.065 115.065 113.811 1.254 25342 14848 1 18 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.285 0.819 25342 14849 1 18 . 1 1 113 113 PHE C C 113 173.006 173.006 173.317 -0.311 25342 14850 1 18 . 1 1 113 113 PHE CA C 113 50.262 50.262 56.173 -5.911 25342 14851 1 18 . 1 1 113 113 PHE CB C 113 38.749 38.749 40.447 -1.698 25342 14852 1 18 . 1 1 113 113 PHE H H 113 7.361 7.361 8.473 -1.112 25342 14853 1 18 . 1 1 114 114 THR N N 114 108.014 108.014 111.223 -3.209 25342 14854 1 18 . 1 1 114 114 THR HA H 114 4.999 4.999 4.484 0.515 25342 14855 1 18 . 1 1 114 114 THR C C 114 169.874 169.874 173.252 -3.378 25342 14856 1 18 . 1 1 114 114 THR CA C 114 56.500 56.500 60.198 -3.698 25342 14857 1 18 . 1 1 114 114 THR CB C 114 68.809 68.809 71.705 -2.896 25342 14858 1 18 . 1 1 114 114 THR H H 114 7.867 7.867 8.050 -0.183 25342 14859 1 18 . 1 1 115 115 SER N N 115 115.049 115.049 116.917 -1.868 25342 14860 1 18 . 1 1 115 115 SER HA H 115 5.613 5.613 4.501 1.112 25342 14861 1 18 . 1 1 115 115 SER C C 115 171.247 171.247 173.645 -2.398 25342 14862 1 18 . 1 1 115 115 SER CA C 115 54.830 54.830 57.574 -2.744 25342 14863 1 18 . 1 1 115 115 SER CB C 115 63.992 63.992 65.901 -1.909 25342 14864 1 18 . 1 1 115 115 SER H H 115 8.970 8.970 8.290 0.680 25342 14865 1 18 . 1 1 116 116 ALA N N 116 122.671 122.671 123.044 -0.373 25342 14866 1 18 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.422 0.563 25342 14867 1 18 . 1 1 116 116 ALA C C 116 176.180 176.180 178.058 -1.878 25342 14868 1 18 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.369 -3.169 25342 14869 1 18 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.707 -2.712 25342 14870 1 18 . 1 1 116 116 ALA H H 116 8.963 8.963 8.491 0.472 25342 14871 1 18 . 1 1 117 117 GLY N N 117 107.387 107.387 106.101 1.286 25342 14872 1 18 . 1 1 117 117 GLY C C 117 172.528 172.528 174.193 -1.665 25342 14873 1 18 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.040 -1.308 25342 14874 1 18 . 1 1 117 117 GLY H H 117 9.340 9.340 8.233 1.107 25342 14875 1 18 . 1 1 118 118 THR N N 118 113.481 113.481 110.142 3.339 25342 14876 1 18 . 1 1 118 118 THR HA H 118 4.651 4.651 4.484 0.167 25342 14877 1 18 . 1 1 118 118 THR C C 118 172.067 172.067 173.205 -1.138 25342 14878 1 18 . 1 1 118 118 THR CA C 118 57.357 57.357 60.426 -3.069 25342 14879 1 18 . 1 1 118 118 THR CB C 118 69.475 69.475 70.598 -1.123 25342 14880 1 18 . 1 1 118 118 THR H H 118 9.373 9.373 7.306 2.067 25342 14881 1 18 . 1 1 119 119 ASN N N 119 113.202 113.202 114.247 -1.045 25342 14882 1 18 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.350 0.268 25342 14883 1 18 . 1 1 119 119 ASN C C 119 173.114 173.114 175.613 -2.499 25342 14884 1 18 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.436 -2.752 25342 14885 1 18 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.416 -3.686 25342 14886 1 18 . 1 1 119 119 ASN H H 119 8.908 8.908 8.722 0.186 25342 14887 1 18 . 1 1 120 120 HIS N N 120 117.315 117.315 119.895 -2.580 25342 14888 1 18 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.406 -0.620 25342 14889 1 18 . 1 1 120 120 HIS C C 120 174.381 174.381 177.141 -2.760 25342 14890 1 18 . 1 1 120 120 HIS CA C 120 54.516 54.516 59.953 -5.437 25342 14891 1 18 . 1 1 120 120 HIS CB C 120 26.504 26.504 30.120 -3.616 25342 14892 1 18 . 1 1 120 120 HIS H H 120 8.074 8.074 8.485 -0.411 25342 14893 1 18 . 1 1 121 121 LYS N N 121 118.678 118.678 118.629 0.049 25342 14894 1 18 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.858 -0.024 25342 14895 1 18 . 1 1 121 121 LYS C C 121 176.564 176.564 178.546 -1.982 25342 14896 1 18 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.843 -2.548 25342 14897 1 18 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.151 -3.209 25342 14898 1 18 . 1 1 121 121 LYS H H 121 8.336 8.336 8.658 -0.322 25342 14899 1 18 . 1 1 122 122 ALA N N 122 122.146 122.146 120.919 1.227 25342 14900 1 18 . 1 1 122 122 ALA HA H 122 3.695 3.695 3.833 -0.138 25342 14901 1 18 . 1 1 122 122 ALA C C 122 175.163 175.163 179.053 -3.890 25342 14902 1 18 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.500 -2.808 25342 14903 1 18 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.605 -1.887 25342 14904 1 18 . 1 1 122 122 ALA H H 122 7.584 7.584 8.069 -0.485 25342 14905 1 18 . 1 1 123 123 TYR N N 123 119.730 119.730 119.586 0.144 25342 14906 1 18 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.072 -0.919 25342 14907 1 18 . 1 1 123 123 TYR C C 123 174.340 174.340 177.485 -3.145 25342 14908 1 18 . 1 1 123 123 TYR CA C 123 60.398 60.398 61.812 -1.414 25342 14909 1 18 . 1 1 123 123 TYR CB C 123 34.663 34.663 38.177 -3.514 25342 14910 1 18 . 1 1 123 123 TYR H H 123 7.317 7.317 7.825 -0.508 25342 14911 1 18 . 1 1 124 124 VAL N N 124 118.649 118.649 117.571 1.078 25342 14912 1 18 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.373 -0.171 25342 14913 1 18 . 1 1 124 124 VAL C C 124 175.603 175.603 178.290 -2.687 25342 14914 1 18 . 1 1 124 124 VAL CA C 124 64.680 64.680 65.992 -1.312 25342 14915 1 18 . 1 1 124 124 VAL CB C 124 29.289 29.289 31.096 -1.807 25342 14916 1 18 . 1 1 124 124 VAL H H 124 7.799 7.799 7.215 0.584 25342 14917 1 18 . 1 1 125 125 SER N N 125 114.475 114.475 115.868 -1.393 25342 14918 1 18 . 1 1 125 125 SER HA H 125 4.032 4.032 4.091 -0.059 25342 14919 1 18 . 1 1 125 125 SER C C 125 174.849 174.849 176.654 -1.805 25342 14920 1 18 . 1 1 125 125 SER CA C 125 59.002 59.002 62.195 -3.193 25342 14921 1 18 . 1 1 125 125 SER CB C 125 59.613 59.613 63.046 -3.433 25342 14922 1 18 . 1 1 125 125 SER H H 125 7.766 7.766 7.389 0.377 25342 14923 1 18 . 1 1 126 126 HIS N N 126 119.326 119.326 120.973 -1.647 25342 14924 1 18 . 1 1 126 126 HIS HA H 126 4.127 4.127 3.889 0.238 25342 14925 1 18 . 1 1 126 126 HIS C C 126 172.865 172.865 177.494 -4.629 25342 14926 1 18 . 1 1 126 126 HIS CA C 126 55.706 55.706 57.911 -2.205 25342 14927 1 18 . 1 1 126 126 HIS CB C 126 25.993 25.993 29.563 -3.570 25342 14928 1 18 . 1 1 126 126 HIS H H 126 8.569 8.569 8.045 0.524 25342 14929 1 18 . 1 1 127 127 PHE N N 127 121.044 121.044 120.018 1.026 25342 14930 1 18 . 1 1 127 127 PHE HA H 127 3.174 3.174 3.695 -0.521 25342 14931 1 18 . 1 1 127 127 PHE C C 127 173.378 173.378 177.042 -3.664 25342 14932 1 18 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.229 -0.362 25342 14933 1 18 . 1 1 127 127 PHE CB C 127 36.054 36.054 38.622 -2.568 25342 14934 1 18 . 1 1 127 127 PHE H H 127 9.139 9.139 8.515 0.624 25342 14935 1 18 . 1 1 128 128 ASN N N 128 114.893 114.893 116.711 -1.818 25342 14936 1 18 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.090 -0.050 25342 14937 1 18 . 1 1 128 128 ASN C C 128 175.230 175.230 177.684 -2.454 25342 14938 1 18 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.397 -2.097 25342 14939 1 18 . 1 1 128 128 ASN CB C 128 36.171 36.171 37.814 -1.643 25342 14940 1 18 . 1 1 128 128 ASN H H 128 7.774 7.774 7.747 0.027 25342 14941 1 18 . 1 1 129 129 GLU N N 129 119.804 119.804 117.987 1.817 25342 14942 1 18 . 1 1 129 129 GLU HA H 129 4.040 4.040 4.032 0.008 25342 14943 1 18 . 1 1 129 129 GLU C C 129 177.052 177.052 177.423 -0.371 25342 14944 1 18 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.586 -1.856 25342 14945 1 18 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.444 -2.248 25342 14946 1 18 . 1 1 129 129 GLU H H 129 7.577 7.577 7.641 -0.064 25342 14947 1 18 . 1 1 130 130 TRP N N 130 120.979 120.979 115.506 5.473 25342 14948 1 18 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.769 -0.312 25342 14949 1 18 . 1 1 130 130 TRP C C 130 174.329 174.329 175.659 -1.330 25342 14950 1 18 . 1 1 130 130 TRP CA C 130 54.688 54.688 54.952 -0.264 25342 14951 1 18 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.750 -2.759 25342 14952 1 18 . 1 1 130 130 TRP H H 130 8.225 8.225 7.246 0.979 25342 14953 1 18 . 1 1 131 131 ALA N N 131 120.450 120.450 121.198 -0.748 25342 14954 1 18 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.274 -0.338 25342 14955 1 18 . 1 1 131 131 ALA C C 131 172.487 172.487 177.294 -4.807 25342 14956 1 18 . 1 1 131 131 ALA CA C 131 48.434 48.434 52.234 -3.800 25342 14957 1 18 . 1 1 131 131 ALA CB C 131 16.288 16.288 18.677 -2.389 25342 14958 1 18 . 1 1 131 131 ALA H H 131 8.081 8.081 7.734 0.347 25342 14959 1 18 . 1 1 132 132 ASP N N 132 117.813 117.813 121.034 -3.221 25342 14960 1 18 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.528 -0.320 25342 14961 1 18 . 1 1 132 132 ASP C C 132 173.804 173.804 176.888 -3.084 25342 14962 1 18 . 1 1 132 132 ASP CA C 132 54.181 54.181 53.514 0.667 25342 14963 1 18 . 1 1 132 132 ASP CB C 132 39.321 39.321 39.557 -0.236 25342 14964 1 18 . 1 1 132 132 ASP H H 132 6.772 6.772 8.401 -1.629 25342 14965 1 18 . 1 1 133 133 GLY N N 133 115.052 115.052 107.946 7.106 25342 14966 1 18 . 1 1 133 133 GLY C C 133 172.078 172.078 174.653 -2.575 25342 14967 1 18 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.551 -3.131 25342 14968 1 18 . 1 1 133 133 GLY H H 133 8.626 8.626 7.898 0.728 25342 14969 1 18 . 1 1 134 134 LEU N N 134 120.063 120.063 119.923 0.140 25342 14970 1 18 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.717 -0.245 25342 14971 1 18 . 1 1 134 134 LEU C C 134 174.079 174.079 175.526 -1.447 25342 14972 1 18 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.354 -2.390 25342 14973 1 18 . 1 1 134 134 LEU CB C 134 40.370 40.370 44.582 -4.212 25342 14974 1 18 . 1 1 134 134 LEU H H 134 8.094 8.094 7.756 0.338 25342 14975 1 18 . 1 1 135 135 ASN N N 135 119.292 119.292 120.788 -1.496 25342 14976 1 18 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.661 -0.038 25342 14977 1 18 . 1 1 135 135 ASN C C 135 170.527 170.527 174.776 -4.249 25342 14978 1 18 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.395 -4.393 25342 14979 1 18 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.668 -5.108 25342 14980 1 18 . 1 1 135 135 ASN H H 135 8.513 8.513 8.693 -0.180 25342 14981 1 18 . 1 1 136 136 VAL N N 136 125.412 125.412 124.404 1.008 25342 14982 1 18 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.324 0.282 25342 14983 1 18 . 1 1 136 136 VAL C C 136 175.420 175.420 176.746 -1.326 25342 14984 1 18 . 1 1 136 136 VAL CA C 136 58.382 58.382 63.156 -4.774 25342 14985 1 18 . 1 1 136 136 VAL CB C 136 29.247 29.247 32.667 -3.420 25342 14986 1 18 . 1 1 136 136 VAL H H 136 7.648 7.648 8.361 -0.713 25342 14987 1 18 . 1 1 137 137 ILE N N 137 121.881 121.881 118.657 3.224 25342 14988 1 18 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.679 -0.246 25342 14989 1 18 . 1 1 137 137 ILE C C 137 173.906 173.906 174.664 -0.758 25342 14990 1 18 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.058 -1.080 25342 14991 1 18 . 1 1 137 137 ILE CB C 137 36.196 36.196 39.323 -3.127 25342 14992 1 18 . 1 1 137 137 ILE H H 137 9.139 9.139 8.986 0.153 25342 14993 1 18 . 1 1 138 138 GLY N N 138 108.226 108.226 107.010 1.216 25342 14994 1 18 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.843 -2.452 25342 14995 1 18 . 1 1 138 138 GLY H H 138 6.645 6.645 7.491 -0.846 25342 14996 1 18 . 1 1 139 139 VAL N N 139 119.408 119.408 123.282 -3.874 25342 14997 1 18 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.020 0.337 25342 14998 1 18 . 1 1 139 139 VAL C C 139 172.327 172.327 174.302 -1.975 25342 14999 1 18 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.896 -2.629 25342 15000 1 18 . 1 1 139 139 VAL CB C 139 32.743 32.743 33.420 -0.677 25342 15001 1 18 . 1 1 139 139 VAL H H 139 8.092 8.092 8.639 -0.547 25342 15002 1 18 . 1 1 140 140 ALA N N 140 127.415 127.415 130.620 -3.205 25342 15003 1 18 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.158 -0.713 25342 15004 1 18 . 1 1 140 140 ALA C C 140 170.718 170.718 175.077 -4.359 25342 15005 1 18 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.885 -1.985 25342 15006 1 18 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.992 -1.933 25342 15007 1 18 . 1 1 140 140 ALA H H 140 9.093 9.093 8.725 0.368 25342 15008 1 18 . 1 1 141 141 ARG N N 141 119.287 119.287 119.448 -0.161 25342 15009 1 18 . 1 1 141 141 ARG HA H 141 2.487 2.487 4.902 -2.415 25342 15010 1 18 . 1 1 141 141 ARG C C 141 173.375 173.375 176.739 -3.364 25342 15011 1 18 . 1 1 141 141 ARG CA C 141 51.884 51.884 56.004 -4.120 25342 15012 1 18 . 1 1 141 141 ARG CB C 141 28.684 28.684 31.171 -2.486 25342 15013 1 18 . 1 1 141 141 ARG H H 141 7.620 7.620 8.702 -1.082 25342 15014 1 18 . 1 1 142 142 ASP N N 142 125.999 125.999 121.438 4.561 25342 15015 1 18 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.242 -0.518 25342 15016 1 18 . 1 1 142 142 ASP C C 142 169.292 169.292 174.834 -5.542 25342 15017 1 18 . 1 1 142 142 ASP CA C 142 53.338 53.338 55.836 -2.498 25342 15018 1 18 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.537 -3.860 25342 15019 1 18 . 1 1 142 142 ASP H H 142 9.482 9.482 8.209 1.273 25342 15020 1 18 . 1 1 143 143 ASP N N 143 119.293 119.293 118.673 0.620 25342 15021 1 18 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.725 -0.419 25342 15022 1 18 . 1 1 143 143 ASP C C 143 175.686 175.686 176.427 -0.741 25342 15023 1 18 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.541 -4.636 25342 15024 1 18 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.121 -3.809 25342 15025 1 18 . 1 1 143 143 ASP H H 143 8.108 8.108 8.474 -0.366 25342 15026 1 18 . 1 1 144 144 SER N N 144 115.303 115.303 115.674 -0.371 25342 15027 1 18 . 1 1 144 144 SER HA H 144 3.740 3.740 4.336 -0.596 25342 15028 1 18 . 1 1 144 144 SER C C 144 172.925 172.925 175.026 -2.101 25342 15029 1 18 . 1 1 144 144 SER CA C 144 59.213 59.213 60.294 -1.081 25342 15030 1 18 . 1 1 144 144 SER CB C 144 60.806 60.806 63.570 -2.764 25342 15031 1 18 . 1 1 144 144 SER H H 144 7.642 7.642 8.514 -0.872 25342 15032 1 18 . 1 1 145 145 GLU N N 145 119.523 119.523 120.398 -0.875 25342 15033 1 18 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.098 0.208 25342 15034 1 18 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.467 -3.428 25342 15035 1 18 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.337 -2.537 25342 15036 1 18 . 1 1 145 145 GLU H H 145 7.771 7.771 7.983 -0.212 25342 15037 1 18 . 1 1 146 146 VAL N N 146 118.683 118.683 119.610 -0.927 25342 15038 1 18 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.585 -0.644 25342 15039 1 18 . 1 1 146 146 VAL C C 146 174.591 174.591 177.094 -2.503 25342 15040 1 18 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.181 -2.249 25342 15041 1 18 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.002 -1.955 25342 15042 1 18 . 1 1 146 146 VAL H H 146 6.352 6.352 7.655 -1.303 25342 15043 1 18 . 1 1 147 147 ASP N N 147 119.312 119.312 118.038 1.274 25342 15044 1 18 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.225 -0.170 25342 15045 1 18 . 1 1 147 147 ASP C C 147 174.783 174.783 176.770 -1.987 25342 15046 1 18 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.795 -2.554 25342 15047 1 18 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.698 -3.465 25342 15048 1 18 . 1 1 147 147 ASP H H 147 8.370 8.370 8.497 -0.127 25342 15049 1 18 . 1 1 148 148 LYS N N 148 119.342 119.342 115.463 3.879 25342 15050 1 18 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.335 -0.398 25342 15051 1 18 . 1 1 148 148 LYS C C 148 176.384 176.384 177.667 -1.283 25342 15052 1 18 . 1 1 148 148 LYS CA C 148 55.706 55.706 56.764 -1.058 25342 15053 1 18 . 1 1 148 148 LYS CB C 148 29.511 29.511 31.914 -2.403 25342 15054 1 18 . 1 1 148 148 LYS H H 148 7.040 7.040 7.449 -0.409 25342 15055 1 18 . 1 1 149 149 TRP N N 149 118.258 118.258 119.811 -1.553 25342 15056 1 18 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.953 -0.362 25342 15057 1 18 . 1 1 149 149 TRP C C 149 174.212 174.212 177.243 -3.031 25342 15058 1 18 . 1 1 149 149 TRP CA C 149 53.745 53.745 56.209 -2.464 25342 15059 1 18 . 1 1 149 149 TRP CB C 149 26.940 26.940 30.511 -3.571 25342 15060 1 18 . 1 1 149 149 TRP H H 149 7.811 7.811 7.781 0.030 25342 15061 1 18 . 1 1 150 150 SER N N 150 109.618 109.618 114.127 -4.509 25342 15062 1 18 . 1 1 150 150 SER HA H 150 4.234 4.234 4.680 -0.446 25342 15063 1 18 . 1 1 150 150 SER C C 150 170.189 170.189 174.845 -4.656 25342 15064 1 18 . 1 1 150 150 SER CA C 150 56.695 56.695 57.559 -0.864 25342 15065 1 18 . 1 1 150 150 SER CB C 150 61.935 61.935 63.790 -1.855 25342 15066 1 18 . 1 1 150 150 SER H H 150 7.793 7.793 7.862 -0.069 25342 15067 1 19 . 1 1 3 3 ALA N N 3 125.638 125.638 124.677 0.961 25342 15068 1 19 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.644 -0.279 25342 15069 1 19 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.016 -2.718 25342 15070 1 19 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.327 -2.468 25342 15071 1 19 . 1 1 3 3 ALA H H 3 8.325 8.325 7.970 0.355 25342 15072 1 19 . 1 1 4 4 LYS N N 4 121.813 121.813 120.629 1.184 25342 15073 1 19 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.460 -0.233 25342 15074 1 19 . 1 1 4 4 LYS C C 4 174.574 174.574 174.512 0.062 25342 15075 1 19 . 1 1 4 4 LYS CA C 4 53.781 53.781 56.074 -2.293 25342 15076 1 19 . 1 1 4 4 LYS CB C 4 31.490 31.490 32.878 -1.388 25342 15077 1 19 . 1 1 4 4 LYS H H 4 8.486 8.486 7.958 0.528 25342 15078 1 19 . 1 1 5 5 LYS N N 5 129.722 129.722 122.080 7.642 25342 15079 1 19 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.688 -0.170 25342 15080 1 19 . 1 1 5 5 LYS C C 5 174.720 174.720 174.812 -0.092 25342 15081 1 19 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.369 -0.647 25342 15082 1 19 . 1 1 5 5 LYS CB C 5 29.785 29.785 36.540 -6.755 25342 15083 1 19 . 1 1 5 5 LYS H H 5 10.015 10.015 8.263 1.752 25342 15084 1 19 . 1 1 6 6 THR N N 6 126.254 126.254 117.216 9.038 25342 15085 1 19 . 1 1 6 6 THR HA H 6 5.654 5.654 5.058 0.596 25342 15086 1 19 . 1 1 6 6 THR C C 6 169.926 169.926 172.814 -2.888 25342 15087 1 19 . 1 1 6 6 THR CA C 6 60.598 60.598 61.955 -1.357 25342 15088 1 19 . 1 1 6 6 THR CB C 6 68.041 68.041 69.491 -1.450 25342 15089 1 19 . 1 1 6 6 THR H H 6 8.538 8.538 8.613 -0.075 25342 15090 1 19 . 1 1 7 7 LEU N N 7 130.775 130.775 129.610 1.165 25342 15091 1 19 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.401 0.193 25342 15092 1 19 . 1 1 7 7 LEU C C 7 170.404 170.404 174.721 -4.317 25342 15093 1 19 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.638 -3.704 25342 15094 1 19 . 1 1 7 7 LEU CB C 7 40.728 40.728 41.999 -1.271 25342 15095 1 19 . 1 1 7 7 LEU H H 7 8.575 8.575 8.435 0.140 25342 15096 1 19 . 1 1 8 8 ILE N N 8 127.242 127.242 127.920 -0.678 25342 15097 1 19 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.144 0.704 25342 15098 1 19 . 1 1 8 8 ILE C C 8 170.936 170.936 174.752 -3.816 25342 15099 1 19 . 1 1 8 8 ILE CA C 8 57.252 57.252 62.309 -5.057 25342 15100 1 19 . 1 1 8 8 ILE CB C 8 36.935 36.935 38.065 -1.130 25342 15101 1 19 . 1 1 8 8 ILE H H 8 9.217 9.217 8.086 1.131 25342 15102 1 19 . 1 1 9 9 LEU N N 9 127.183 127.183 128.250 -1.067 25342 15103 1 19 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.966 0.728 25342 15104 1 19 . 1 1 9 9 LEU C C 9 173.824 173.824 175.930 -2.106 25342 15105 1 19 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.950 -4.111 25342 15106 1 19 . 1 1 9 9 LEU CB C 9 43.963 43.963 43.289 0.673 25342 15107 1 19 . 1 1 9 9 LEU H H 9 9.248 9.248 8.927 0.321 25342 15108 1 19 . 1 1 10 10 TYR N N 10 113.330 113.330 121.777 -8.447 25342 15109 1 19 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.102 0.412 25342 15110 1 19 . 1 1 10 10 TYR C C 10 167.898 167.898 175.026 -7.128 25342 15111 1 19 . 1 1 10 10 TYR CA C 10 52.875 52.875 54.558 -1.683 25342 15112 1 19 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.334 -1.898 25342 15113 1 19 . 1 1 10 10 TYR H H 10 7.306 7.306 8.058 -0.752 25342 15114 1 19 . 1 1 11 11 TYR N N 11 121.297 121.297 120.658 0.639 25342 15115 1 19 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.338 -0.576 25342 15116 1 19 . 1 1 11 11 TYR C C 11 169.698 169.698 174.821 -5.123 25342 15117 1 19 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.742 -1.695 25342 15118 1 19 . 1 1 11 11 TYR CB C 11 40.538 40.538 41.872 -1.334 25342 15119 1 19 . 1 1 11 11 TYR H H 11 7.891 7.891 8.420 -0.529 25342 15120 1 19 . 1 1 12 12 SER N N 12 117.763 117.763 117.223 0.540 25342 15121 1 19 . 1 1 12 12 SER HA H 12 4.679 4.679 4.489 0.190 25342 15122 1 19 . 1 1 12 12 SER C C 12 170.075 170.075 172.884 -2.809 25342 15123 1 19 . 1 1 12 12 SER CA C 12 53.619 53.619 56.383 -2.764 25342 15124 1 19 . 1 1 12 12 SER CB C 12 62.847 62.847 65.543 -2.696 25342 15125 1 19 . 1 1 12 12 SER H H 12 7.557 7.557 8.038 -0.481 25342 15126 1 19 . 1 1 13 13 TRP N N 13 135.232 135.232 127.257 7.975 25342 15127 1 19 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.032 0.604 25342 15128 1 19 . 1 1 13 13 TRP C C 13 175.708 175.708 176.281 -0.573 25342 15129 1 19 . 1 1 13 13 TRP CA C 13 58.116 58.116 60.447 -2.331 25342 15130 1 19 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.608 -1.973 25342 15131 1 19 . 1 1 13 13 TRP H H 13 9.755 9.755 8.476 1.279 25342 15132 1 19 . 1 1 14 14 SER N N 14 113.789 113.789 111.795 1.994 25342 15133 1 19 . 1 1 14 14 SER HA H 14 4.223 4.223 4.452 -0.229 25342 15134 1 19 . 1 1 14 14 SER C C 14 172.747 172.747 174.293 -1.546 25342 15135 1 19 . 1 1 14 14 SER CA C 14 53.828 53.828 58.444 -4.616 25342 15136 1 19 . 1 1 14 14 SER CB C 14 60.037 60.037 63.315 -3.278 25342 15137 1 19 . 1 1 14 14 SER H H 14 10.026 10.026 8.624 1.402 25342 15138 1 19 . 1 1 15 15 GLY N N 15 110.489 110.489 108.637 1.852 25342 15139 1 19 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.820 -1.161 25342 15140 1 19 . 1 1 15 15 GLY H H 15 7.391 7.391 8.294 -0.903 25342 15141 1 19 . 1 1 16 16 GLU N N 16 129.005 129.005 121.367 7.638 25342 15142 1 19 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.398 -0.335 25342 15143 1 19 . 1 1 16 16 GLU CA C 16 56.761 56.761 56.961 -0.200 25342 15144 1 19 . 1 1 16 16 GLU CB C 16 26.412 26.412 30.083 -3.671 25342 15145 1 19 . 1 1 16 16 GLU H H 16 11.550 11.550 8.218 3.332 25342 15146 1 19 . 1 1 17 17 THR N N 17 123.016 123.016 116.228 6.788 25342 15147 1 19 . 1 1 17 17 THR HA H 17 4.035 4.035 4.125 -0.090 25342 15148 1 19 . 1 1 17 17 THR C C 17 173.360 173.360 176.644 -3.284 25342 15149 1 19 . 1 1 17 17 THR CA C 17 64.303 64.303 65.649 -1.346 25342 15150 1 19 . 1 1 17 17 THR CB C 17 63.999 63.999 68.530 -4.531 25342 15151 1 19 . 1 1 17 17 THR H H 17 11.293 11.293 8.418 2.875 25342 15152 1 19 . 1 1 18 18 LYS N N 18 120.156 120.156 122.223 -2.067 25342 15153 1 19 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.168 -1.312 25342 15154 1 19 . 1 1 18 18 LYS C C 18 173.901 173.901 178.967 -5.066 25342 15155 1 19 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.115 -2.281 25342 15156 1 19 . 1 1 18 18 LYS CB C 18 29.481 29.481 31.794 -2.313 25342 15157 1 19 . 1 1 18 18 LYS H H 18 6.940 6.940 8.459 -1.519 25342 15158 1 19 . 1 1 19 19 LYS N N 19 117.237 117.237 119.340 -2.103 25342 15159 1 19 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.093 -0.170 25342 15160 1 19 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.827 -2.503 25342 15161 1 19 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.170 -2.809 25342 15162 1 19 . 1 1 19 19 LYS H H 19 7.212 7.212 7.730 -0.518 25342 15163 1 19 . 1 1 20 20 MET N N 20 119.268 119.268 117.591 1.677 25342 15164 1 19 . 1 1 20 20 MET HA H 20 4.413 4.413 4.230 0.183 25342 15165 1 19 . 1 1 20 20 MET C C 20 173.625 173.625 177.295 -3.670 25342 15166 1 19 . 1 1 20 20 MET CA C 20 52.261 52.261 57.152 -4.891 25342 15167 1 19 . 1 1 20 20 MET CB C 20 26.680 26.680 32.397 -5.716 25342 15168 1 19 . 1 1 20 20 MET H H 20 7.600 7.600 7.720 -0.120 25342 15169 1 19 . 1 1 21 21 ALA N N 21 123.669 123.669 121.584 2.085 25342 15170 1 19 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.242 -0.760 25342 15171 1 19 . 1 1 21 21 ALA C C 21 176.628 176.628 179.337 -2.709 25342 15172 1 19 . 1 1 21 21 ALA CA C 21 52.374 52.374 55.430 -3.056 25342 15173 1 19 . 1 1 21 21 ALA CB C 21 16.495 16.495 18.435 -1.940 25342 15174 1 19 . 1 1 21 21 ALA H H 21 8.738 8.738 8.156 0.582 25342 15175 1 19 . 1 1 22 22 GLU N N 22 117.242 117.242 116.810 0.432 25342 15176 1 19 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.048 -0.375 25342 15177 1 19 . 1 1 22 22 GLU C C 22 176.698 176.698 178.654 -1.956 25342 15178 1 19 . 1 1 22 22 GLU CA C 22 56.540 56.540 58.499 -1.959 25342 15179 1 19 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.268 -2.834 25342 15180 1 19 . 1 1 22 22 GLU H H 22 7.959 7.959 7.972 -0.013 25342 15181 1 19 . 1 1 23 23 LYS N N 23 123.302 123.302 121.503 1.799 25342 15182 1 19 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.154 -0.333 25342 15183 1 19 . 1 1 23 23 LYS C C 23 177.389 177.389 178.747 -1.358 25342 15184 1 19 . 1 1 23 23 LYS CA C 23 56.922 56.922 58.308 -1.386 25342 15185 1 19 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.307 -2.793 25342 15186 1 19 . 1 1 23 23 LYS H H 23 7.703 7.703 7.325 0.378 25342 15187 1 19 . 1 1 24 24 ILE N N 24 122.208 122.208 119.588 2.620 25342 15188 1 19 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.591 -0.308 25342 15189 1 19 . 1 1 24 24 ILE C C 24 174.934 174.934 177.860 -2.926 25342 15190 1 19 . 1 1 24 24 ILE CA C 24 63.292 63.292 65.320 -2.029 25342 15191 1 19 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.637 -2.899 25342 15192 1 19 . 1 1 24 24 ILE H H 24 8.535 8.535 8.309 0.226 25342 15193 1 19 . 1 1 25 25 ASN N N 25 118.640 118.640 118.847 -0.207 25342 15194 1 19 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.347 -0.120 25342 15195 1 19 . 1 1 25 25 ASN C C 25 173.530 173.530 177.416 -3.886 25342 15196 1 19 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.538 -4.327 25342 15197 1 19 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.365 -0.262 25342 15198 1 19 . 1 1 25 25 ASN H H 25 8.317 8.317 8.133 0.184 25342 15199 1 19 . 1 1 26 26 SER N N 26 111.990 111.990 113.843 -1.853 25342 15200 1 19 . 1 1 26 26 SER HA H 26 4.153 4.153 4.317 -0.164 25342 15201 1 19 . 1 1 26 26 SER C C 26 172.110 172.110 175.032 -2.922 25342 15202 1 19 . 1 1 26 26 SER CA C 26 57.905 57.905 60.456 -2.551 25342 15203 1 19 . 1 1 26 26 SER CB C 26 60.655 60.655 63.238 -2.583 25342 15204 1 19 . 1 1 26 26 SER H H 26 7.369 7.369 7.813 -0.444 25342 15205 1 19 . 1 1 27 27 GLU N N 27 120.201 120.201 119.138 1.063 25342 15206 1 19 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.440 -0.339 25342 15207 1 19 . 1 1 27 27 GLU C C 27 173.673 173.673 175.651 -1.978 25342 15208 1 19 . 1 1 27 27 GLU CA C 27 54.235 54.235 55.839 -1.604 25342 15209 1 19 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.437 -3.836 25342 15210 1 19 . 1 1 27 27 GLU H H 27 7.451 7.451 7.626 -0.175 25342 15211 1 19 . 1 1 28 28 ILE N N 28 118.762 118.762 118.233 0.529 25342 15212 1 19 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.239 -0.040 25342 15213 1 19 . 1 1 28 28 ILE C C 28 172.487 172.487 175.270 -2.783 25342 15214 1 19 . 1 1 28 28 ILE CA C 28 57.732 57.732 59.945 -2.213 25342 15215 1 19 . 1 1 28 28 ILE CB C 28 35.738 35.738 40.354 -4.616 25342 15216 1 19 . 1 1 28 28 ILE H H 28 7.255 7.255 7.265 -0.010 25342 15217 1 19 . 1 1 29 29 LYS N N 29 130.563 130.563 121.845 8.718 25342 15218 1 19 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.167 -0.165 25342 15219 1 19 . 1 1 29 29 LYS C C 29 174.386 174.386 177.132 -2.746 25342 15220 1 19 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.267 -1.732 25342 15221 1 19 . 1 1 29 29 LYS CB C 29 29.586 29.586 32.989 -3.403 25342 15222 1 19 . 1 1 29 29 LYS H H 29 8.564 8.564 8.577 -0.013 25342 15223 1 19 . 1 1 30 30 ASP N N 30 119.357 119.357 120.716 -1.359 25342 15224 1 19 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.532 -0.130 25342 15225 1 19 . 1 1 30 30 ASP C C 30 172.570 172.570 176.162 -3.592 25342 15226 1 19 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.766 -1.329 25342 15227 1 19 . 1 1 30 30 ASP CB C 30 36.744 36.744 38.638 -1.894 25342 15228 1 19 . 1 1 30 30 ASP H H 30 8.920 8.920 8.642 0.278 25342 15229 1 19 . 1 1 31 31 SER N N 31 114.019 114.019 115.394 -1.375 25342 15230 1 19 . 1 1 31 31 SER HA H 31 4.782 4.782 4.503 0.279 25342 15231 1 19 . 1 1 31 31 SER C C 31 171.150 171.150 174.470 -3.320 25342 15232 1 19 . 1 1 31 31 SER CA C 31 55.551 55.551 58.534 -2.983 25342 15233 1 19 . 1 1 31 31 SER CB C 31 62.259 62.259 64.635 -2.376 25342 15234 1 19 . 1 1 31 31 SER H H 31 8.006 8.006 8.042 -0.036 25342 15235 1 19 . 1 1 32 32 GLU N N 32 121.455 121.455 119.519 1.936 25342 15236 1 19 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.621 0.119 25342 15237 1 19 . 1 1 32 32 GLU C C 32 171.185 171.185 174.305 -3.120 25342 15238 1 19 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.533 -3.453 25342 15239 1 19 . 1 1 32 32 GLU CB C 32 30.827 30.827 33.022 -2.195 25342 15240 1 19 . 1 1 32 32 GLU H H 32 8.145 8.145 8.071 0.074 25342 15241 1 19 . 1 1 33 33 LEU N N 33 126.176 126.176 123.205 2.971 25342 15242 1 19 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.518 0.788 25342 15243 1 19 . 1 1 33 33 LEU C C 33 173.365 173.365 175.681 -2.316 25342 15244 1 19 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.303 -2.863 25342 15245 1 19 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.565 0.070 25342 15246 1 19 . 1 1 33 33 LEU H H 33 8.589 8.589 8.527 0.062 25342 15247 1 19 . 1 1 34 34 LYS N N 34 127.200 127.200 125.386 1.814 25342 15248 1 19 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.740 -0.144 25342 15249 1 19 . 1 1 34 34 LYS C C 34 169.622 169.622 174.129 -4.507 25342 15250 1 19 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.697 -2.368 25342 15251 1 19 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.604 -2.404 25342 15252 1 19 . 1 1 34 34 LYS H H 34 9.380 9.380 8.428 0.952 25342 15253 1 19 . 1 1 35 35 GLU N N 35 122.324 122.324 120.466 1.858 25342 15254 1 19 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.301 -1.968 25342 15255 1 19 . 1 1 35 35 GLU C C 35 172.734 172.734 174.994 -2.260 25342 15256 1 19 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.917 -2.305 25342 15257 1 19 . 1 1 35 35 GLU CB C 35 29.319 29.319 33.471 -4.152 25342 15258 1 19 . 1 1 35 35 GLU H H 35 8.094 8.094 8.638 -0.544 25342 15259 1 19 . 1 1 36 36 VAL N N 36 126.781 126.781 120.193 6.588 25342 15260 1 19 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.480 -0.641 25342 15261 1 19 . 1 1 36 36 VAL C C 36 171.482 171.482 174.695 -3.213 25342 15262 1 19 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.547 -1.142 25342 15263 1 19 . 1 1 36 36 VAL CB C 36 29.348 29.348 35.012 -5.664 25342 15264 1 19 . 1 1 36 36 VAL H H 36 8.660 8.660 8.946 -0.286 25342 15265 1 19 . 1 1 37 37 LYS N N 37 126.065 126.065 121.173 4.892 25342 15266 1 19 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.565 0.400 25342 15267 1 19 . 1 1 37 37 LYS C C 37 173.187 173.187 174.147 -0.960 25342 15268 1 19 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.513 -2.233 25342 15269 1 19 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.289 -2.368 25342 15270 1 19 . 1 1 37 37 LYS H H 37 7.809 7.809 7.977 -0.168 25342 15271 1 19 . 1 1 38 38 VAL N N 38 111.020 111.020 115.391 -4.371 25342 15272 1 19 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.810 0.014 25342 15273 1 19 . 1 1 38 38 VAL C C 38 173.604 173.604 175.467 -1.863 25342 15274 1 19 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.328 -2.945 25342 15275 1 19 . 1 1 38 38 VAL CB C 38 32.376 32.376 34.323 -1.947 25342 15276 1 19 . 1 1 38 38 VAL H H 38 8.305 8.305 7.942 0.363 25342 15277 1 19 . 1 1 39 39 SER N N 39 117.887 117.887 116.200 1.687 25342 15278 1 19 . 1 1 39 39 SER HA H 39 4.183 4.183 4.510 -0.327 25342 15279 1 19 . 1 1 39 39 SER C C 39 173.538 173.538 175.157 -1.619 25342 15280 1 19 . 1 1 39 39 SER CA C 39 56.279 56.279 58.637 -2.358 25342 15281 1 19 . 1 1 39 39 SER CB C 39 60.537 60.537 63.924 -3.387 25342 15282 1 19 . 1 1 39 39 SER H H 39 8.847 8.847 8.456 0.391 25342 15283 1 19 . 1 1 40 40 GLU N N 40 126.316 126.316 121.447 4.869 25342 15284 1 19 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.269 -0.115 25342 15285 1 19 . 1 1 40 40 GLU C C 40 174.586 174.586 177.184 -2.598 25342 15286 1 19 . 1 1 40 40 GLU CA C 40 55.812 55.812 57.363 -1.551 25342 15287 1 19 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.860 -3.140 25342 15288 1 19 . 1 1 40 40 GLU H H 40 9.049 9.049 8.452 0.597 25342 15289 1 19 . 1 1 41 41 GLY N N 41 112.494 112.494 110.895 1.599 25342 15290 1 19 . 1 1 41 41 GLY C C 41 171.994 171.994 175.632 -3.638 25342 15291 1 19 . 1 1 41 41 GLY CA C 41 42.462 42.462 46.382 -3.920 25342 15292 1 19 . 1 1 41 41 GLY H H 41 8.780 8.780 8.989 -0.209 25342 15293 1 19 . 1 1 42 42 THR N N 42 118.631 118.631 115.482 3.149 25342 15294 1 19 . 1 1 42 42 THR HA H 42 3.582 3.582 3.760 -0.178 25342 15295 1 19 . 1 1 42 42 THR C C 42 171.225 171.225 173.402 -2.177 25342 15296 1 19 . 1 1 42 42 THR CA C 42 64.104 64.104 65.108 -1.004 25342 15297 1 19 . 1 1 42 42 THR CB C 42 65.914 65.914 69.281 -3.367 25342 15298 1 19 . 1 1 42 42 THR H H 42 7.737 7.737 7.566 0.171 25342 15299 1 19 . 1 1 43 43 PHE N N 43 116.279 116.279 113.292 2.987 25342 15300 1 19 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.479 0.541 25342 15301 1 19 . 1 1 43 43 PHE C C 43 170.141 170.141 173.712 -3.571 25342 15302 1 19 . 1 1 43 43 PHE CA C 43 52.472 52.472 57.228 -4.756 25342 15303 1 19 . 1 1 43 43 PHE CB C 43 37.385 37.385 42.262 -4.877 25342 15304 1 19 . 1 1 43 43 PHE H H 43 8.114 8.114 7.565 0.549 25342 15305 1 19 . 1 1 44 44 ASP N N 44 121.513 121.513 119.017 2.496 25342 15306 1 19 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.954 -0.103 25342 15307 1 19 . 1 1 44 44 ASP CA C 44 50.212 50.212 52.313 -2.101 25342 15308 1 19 . 1 1 44 44 ASP CB C 44 44.385 44.385 44.095 0.290 25342 15309 1 19 . 1 1 44 44 ASP H H 44 7.774 7.774 8.457 -0.683 25342 15310 1 19 . 1 1 45 45 ALA N N 45 125.663 125.663 123.248 2.415 25342 15311 1 19 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.915 -0.704 25342 15312 1 19 . 1 1 45 45 ALA C C 45 175.139 175.139 176.163 -1.024 25342 15313 1 19 . 1 1 45 45 ALA CA C 45 51.436 51.436 51.938 -0.502 25342 15314 1 19 . 1 1 45 45 ALA CB C 45 16.232 16.232 18.397 -2.165 25342 15315 1 19 . 1 1 45 45 ALA H H 45 8.324 8.324 8.473 -0.149 25342 15316 1 19 . 1 1 46 46 ASP N N 46 119.288 119.288 120.772 -1.484 25342 15317 1 19 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.722 0.103 25342 15318 1 19 . 1 1 46 46 ASP C C 46 175.013 175.013 175.541 -0.528 25342 15319 1 19 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.837 -2.675 25342 15320 1 19 . 1 1 46 46 ASP CB C 46 41.233 41.233 43.866 -2.633 25342 15321 1 19 . 1 1 46 46 ASP H H 46 9.618 9.618 7.910 1.708 25342 15322 1 19 . 1 1 47 47 MET N N 47 127.347 127.347 115.855 11.492 25342 15323 1 19 . 1 1 47 47 MET HA H 47 3.456 3.456 4.691 -1.235 25342 15324 1 19 . 1 1 47 47 MET C C 47 173.605 173.605 175.453 -1.848 25342 15325 1 19 . 1 1 47 47 MET CA C 47 56.699 56.699 56.047 0.652 25342 15326 1 19 . 1 1 47 47 MET CB C 47 29.930 29.930 34.295 -4.365 25342 15327 1 19 . 1 1 47 47 MET H H 47 9.178 9.178 7.705 1.473 25342 15328 1 19 . 1 1 48 48 TYR N N 48 121.040 121.040 117.566 3.474 25342 15329 1 19 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.928 -1.056 25342 15330 1 19 . 1 1 48 48 TYR CA C 48 58.712 58.712 58.500 0.212 25342 15331 1 19 . 1 1 48 48 TYR CB C 48 33.638 33.638 37.945 -4.307 25342 15332 1 19 . 1 1 48 48 TYR H H 48 7.881 7.881 8.128 -0.247 25342 15333 1 19 . 1 1 49 49 LYS N N 49 121.754 121.754 120.325 1.429 25342 15334 1 19 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.057 0.048 25342 15335 1 19 . 1 1 49 49 LYS CA C 49 56.385 56.385 60.264 -3.878 25342 15336 1 19 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.392 -3.228 25342 15337 1 19 . 1 1 49 49 LYS H H 49 8.365 8.365 8.219 0.146 25342 15338 1 19 . 1 1 50 50 THR N N 50 117.557 117.557 107.447 10.110 25342 15339 1 19 . 1 1 50 50 THR HA H 50 3.586 3.586 4.361 -0.775 25342 15340 1 19 . 1 1 50 50 THR CA C 50 65.634 65.634 64.587 1.047 25342 15341 1 19 . 1 1 50 50 THR CB C 50 65.904 65.904 68.150 -2.246 25342 15342 1 19 . 1 1 50 50 THR H H 50 8.007 8.007 8.330 -0.323 25342 15343 1 19 . 1 1 51 51 SER N N 51 115.110 115.110 119.355 -4.245 25342 15344 1 19 . 1 1 51 51 SER HA H 51 3.974 3.974 4.349 -0.375 25342 15345 1 19 . 1 1 51 51 SER CA C 51 59.042 59.042 62.364 -3.321 25342 15346 1 19 . 1 1 51 51 SER CB C 51 59.835 59.835 63.248 -3.413 25342 15347 1 19 . 1 1 51 51 SER H H 51 7.606 7.606 7.696 -0.090 25342 15348 1 19 . 1 1 52 52 ASP N N 52 119.713 119.713 122.557 -2.844 25342 15349 1 19 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.410 -0.102 25342 15350 1 19 . 1 1 52 52 ASP CA C 52 54.526 54.526 57.531 -3.005 25342 15351 1 19 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.007 -3.319 25342 15352 1 19 . 1 1 52 52 ASP H H 52 7.552 7.552 7.652 -0.100 25342 15353 1 19 . 1 1 53 53 ILE N N 53 121.982 121.982 119.366 2.616 25342 15354 1 19 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.549 0.173 25342 15355 1 19 . 1 1 53 53 ILE C C 53 175.325 175.325 178.068 -2.743 25342 15356 1 19 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.246 -2.702 25342 15357 1 19 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.649 -0.950 25342 15358 1 19 . 1 1 53 53 ILE H H 53 7.815 7.815 8.192 -0.377 25342 15359 1 19 . 1 1 54 54 ALA N N 54 121.552 121.552 121.451 0.101 25342 15360 1 19 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.103 0.214 25342 15361 1 19 . 1 1 54 54 ALA C C 54 177.475 177.475 179.816 -2.341 25342 15362 1 19 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.666 -2.644 25342 15363 1 19 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.389 -2.405 25342 15364 1 19 . 1 1 54 54 ALA H H 54 8.332 8.332 7.657 0.675 25342 15365 1 19 . 1 1 55 55 LEU N N 55 117.176 117.176 120.154 -2.978 25342 15366 1 19 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.904 0.030 25342 15367 1 19 . 1 1 55 55 LEU C C 55 176.532 176.532 178.380 -1.848 25342 15368 1 19 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.655 -2.324 25342 15369 1 19 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.836 -3.408 25342 15370 1 19 . 1 1 55 55 LEU H H 55 8.195 8.195 8.154 0.041 25342 15371 1 19 . 1 1 56 56 ASP N N 56 120.056 120.056 117.597 2.459 25342 15372 1 19 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.458 0.009 25342 15373 1 19 . 1 1 56 56 ASP C C 56 176.585 176.585 178.197 -1.612 25342 15374 1 19 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.325 -2.775 25342 15375 1 19 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.840 -2.534 25342 15376 1 19 . 1 1 56 56 ASP H H 56 7.806 7.806 8.513 -0.707 25342 15377 1 19 . 1 1 57 57 GLN N N 57 120.020 120.020 116.210 3.810 25342 15378 1 19 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.383 -0.260 25342 15379 1 19 . 1 1 57 57 GLN C C 57 175.689 175.689 176.534 -0.845 25342 15380 1 19 . 1 1 57 57 GLN CA C 57 54.405 54.405 56.270 -1.865 25342 15381 1 19 . 1 1 57 57 GLN CB C 57 23.769 23.769 29.015 -5.246 25342 15382 1 19 . 1 1 57 57 GLN H H 57 7.661 7.661 7.589 0.072 25342 15383 1 19 . 1 1 58 58 ILE N N 58 120.644 120.644 118.959 1.685 25342 15384 1 19 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.357 -0.781 25342 15385 1 19 . 1 1 58 58 ILE C C 58 176.237 176.237 177.120 -0.883 25342 15386 1 19 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.542 -0.036 25342 15387 1 19 . 1 1 58 58 ILE CB C 58 36.029 36.029 39.002 -2.973 25342 15388 1 19 . 1 1 58 58 ILE H H 58 8.228 8.228 7.460 0.768 25342 15389 1 19 . 1 1 59 59 GLN N N 59 115.498 115.498 118.670 -3.172 25342 15390 1 19 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.157 -0.015 25342 15391 1 19 . 1 1 59 59 GLN C C 59 173.781 173.781 176.901 -3.120 25342 15392 1 19 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.332 -3.350 25342 15393 1 19 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.269 -2.658 25342 15394 1 19 . 1 1 59 59 GLN H H 59 8.331 8.331 8.334 -0.003 25342 15395 1 19 . 1 1 60 60 GLY N N 60 106.623 106.623 104.815 1.808 25342 15396 1 19 . 1 1 60 60 GLY C C 60 172.068 172.068 174.390 -2.322 25342 15397 1 19 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.145 -2.272 25342 15398 1 19 . 1 1 60 60 GLY H H 60 7.611 7.611 8.402 -0.791 25342 15399 1 19 . 1 1 61 61 ASN N N 61 117.691 117.691 118.459 -0.768 25342 15400 1 19 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.959 -0.415 25342 15401 1 19 . 1 1 61 61 ASN C C 61 171.946 171.946 175.918 -3.972 25342 15402 1 19 . 1 1 61 61 ASN CA C 61 51.569 51.569 53.267 -1.698 25342 15403 1 19 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.460 -3.100 25342 15404 1 19 . 1 1 61 61 ASN H H 61 8.151 8.151 8.119 0.032 25342 15405 1 19 . 1 1 62 62 LYS N N 62 118.289 118.289 121.562 -3.273 25342 15406 1 19 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.390 -0.062 25342 15407 1 19 . 1 1 62 62 LYS C C 62 171.773 171.773 175.813 -4.040 25342 15408 1 19 . 1 1 62 62 LYS CA C 62 51.296 51.296 55.649 -4.353 25342 15409 1 19 . 1 1 62 62 LYS CB C 62 34.683 34.683 33.056 1.627 25342 15410 1 19 . 1 1 62 62 LYS H H 62 7.242 7.242 8.183 -0.941 25342 15411 1 19 . 1 1 63 63 ASP N N 63 119.888 119.888 118.403 1.485 25342 15412 1 19 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.555 -0.139 25342 15413 1 19 . 1 1 63 63 ASP C C 63 174.476 174.476 175.313 -0.837 25342 15414 1 19 . 1 1 63 63 ASP CA C 63 51.461 51.461 52.891 -1.430 25342 15415 1 19 . 1 1 63 63 ASP CB C 63 38.515 38.515 42.086 -3.571 25342 15416 1 19 . 1 1 63 63 ASP H H 63 8.230 8.230 8.046 0.184 25342 15417 1 19 . 1 1 64 64 PHE N N 64 119.789 119.789 114.855 4.934 25342 15418 1 19 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.832 -1.016 25342 15419 1 19 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.172 2.079 25342 15420 1 19 . 1 1 64 64 PHE CB C 64 35.034 35.034 37.847 -2.813 25342 15421 1 19 . 1 1 64 64 PHE H H 64 8.428 8.428 7.524 0.904 25342 15422 1 19 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.546 -0.233 25342 15423 1 19 . 1 1 65 65 PRO C C 65 173.975 173.975 175.602 -1.627 25342 15424 1 19 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.693 -2.637 25342 15425 1 19 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.631 -3.111 25342 15426 1 19 . 1 1 66 66 GLU N N 66 121.326 121.326 116.934 4.392 25342 15427 1 19 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.768 -0.535 25342 15428 1 19 . 1 1 66 66 GLU C C 66 173.978 173.978 175.686 -1.708 25342 15429 1 19 . 1 1 66 66 GLU CA C 66 53.531 53.531 54.615 -1.084 25342 15430 1 19 . 1 1 66 66 GLU CB C 66 27.700 27.700 32.303 -4.603 25342 15431 1 19 . 1 1 66 66 GLU H H 66 8.225 8.225 8.497 -0.272 25342 15432 1 19 . 1 1 67 67 ILE N N 67 113.897 113.897 117.123 -3.226 25342 15433 1 19 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.433 0.736 25342 15434 1 19 . 1 1 67 67 ILE C C 67 172.791 172.791 175.580 -2.789 25342 15435 1 19 . 1 1 67 67 ILE CA C 67 56.275 56.275 60.158 -3.883 25342 15436 1 19 . 1 1 67 67 ILE CB C 67 39.016 39.016 39.433 -0.417 25342 15437 1 19 . 1 1 67 67 ILE H H 67 8.366 8.366 8.230 0.136 25342 15438 1 19 . 1 1 68 68 GLN N N 68 121.654 121.654 122.973 -1.319 25342 15439 1 19 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.608 -0.089 25342 15440 1 19 . 1 1 68 68 GLN C C 68 171.562 171.562 174.117 -2.555 25342 15441 1 19 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.870 -2.557 25342 15442 1 19 . 1 1 68 68 GLN CB C 68 26.785 26.785 29.663 -2.878 25342 15443 1 19 . 1 1 68 68 GLN H H 68 8.763 8.763 8.528 0.235 25342 15444 1 19 . 1 1 69 69 LEU N N 69 125.289 125.289 123.256 2.033 25342 15445 1 19 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.692 -0.173 25342 15446 1 19 . 1 1 69 69 LEU C C 69 172.567 172.567 175.257 -2.690 25342 15447 1 19 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.317 -2.520 25342 15448 1 19 . 1 1 69 69 LEU CB C 69 42.742 42.742 45.060 -2.318 25342 15449 1 19 . 1 1 69 69 LEU H H 69 7.996 7.996 8.206 -0.210 25342 15450 1 19 . 1 1 70 70 ASP N N 70 123.170 123.170 123.045 0.125 25342 15451 1 19 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.652 -0.246 25342 15452 1 19 . 1 1 70 70 ASP C C 70 171.978 171.978 175.357 -3.379 25342 15453 1 19 . 1 1 70 70 ASP CA C 70 51.682 51.682 54.153 -2.471 25342 15454 1 19 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.287 -2.558 25342 15455 1 19 . 1 1 70 70 ASP H H 70 8.278 8.278 8.498 -0.220 25342 15456 1 19 . 1 1 71 71 ASN N N 71 117.524 117.524 118.389 -0.865 25342 15457 1 19 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.727 -0.400 25342 15458 1 19 . 1 1 71 71 ASN C C 71 171.825 171.825 174.226 -2.401 25342 15459 1 19 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.061 -1.404 25342 15460 1 19 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.455 -3.225 25342 15461 1 19 . 1 1 71 71 ASN H H 71 8.372 8.372 8.411 -0.039 25342 15462 1 19 . 1 1 72 72 ILE N N 72 124.515 124.515 124.179 0.336 25342 15463 1 19 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.201 -0.272 25342 15464 1 19 . 1 1 72 72 ILE C C 72 171.607 171.607 174.118 -2.511 25342 15465 1 19 . 1 1 72 72 ILE CA C 72 57.289 57.289 60.176 -2.887 25342 15466 1 19 . 1 1 72 72 ILE CB C 72 38.760 38.760 40.595 -1.835 25342 15467 1 19 . 1 1 72 72 ILE H H 72 7.653 7.653 8.091 -0.438 25342 15468 1 19 . 1 1 73 73 ASP N N 73 125.182 125.182 127.361 -2.179 25342 15469 1 19 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.365 0.263 25342 15470 1 19 . 1 1 73 73 ASP C C 73 173.980 173.980 175.658 -1.678 25342 15471 1 19 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.468 -5.254 25342 15472 1 19 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.321 -4.419 25342 15473 1 19 . 1 1 73 73 ASP H H 73 8.382 8.382 8.584 -0.202 25342 15474 1 19 . 1 1 74 74 TYR N N 74 123.092 123.092 123.552 -0.460 25342 15475 1 19 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.907 -1.042 25342 15476 1 19 . 1 1 74 74 TYR C C 74 173.582 173.582 176.555 -2.973 25342 15477 1 19 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.853 1.633 25342 15478 1 19 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.833 -4.025 25342 15479 1 19 . 1 1 74 74 TYR H H 74 7.348 7.348 8.586 -1.238 25342 15480 1 19 . 1 1 75 75 ASN N N 75 109.447 109.447 117.562 -8.115 25342 15481 1 19 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.810 0.115 25342 15482 1 19 . 1 1 75 75 ASN C C 75 172.570 172.570 175.731 -3.161 25342 15483 1 19 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.451 -1.833 25342 15484 1 19 . 1 1 75 75 ASN CB C 75 35.534 35.534 39.067 -3.533 25342 15485 1 19 . 1 1 75 75 ASN H H 75 8.040 8.040 8.049 -0.009 25342 15486 1 19 . 1 1 76 76 ASN N N 76 117.411 117.411 116.198 1.213 25342 15487 1 19 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.648 -0.194 25342 15488 1 19 . 1 1 76 76 ASN C C 76 171.155 171.155 174.876 -3.721 25342 15489 1 19 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.136 -2.202 25342 15490 1 19 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.882 -3.224 25342 15491 1 19 . 1 1 76 76 ASN H H 76 7.750 7.750 7.703 0.047 25342 15492 1 19 . 1 1 77 77 TYR N N 77 116.878 116.878 118.722 -1.844 25342 15493 1 19 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.570 -0.216 25342 15494 1 19 . 1 1 77 77 TYR C C 77 172.224 172.224 175.316 -3.092 25342 15495 1 19 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.036 -2.796 25342 15496 1 19 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.861 -2.748 25342 15497 1 19 . 1 1 77 77 TYR H H 77 7.789 7.789 7.645 0.144 25342 15498 1 19 . 1 1 78 78 ASP N N 78 121.352 121.352 120.777 0.575 25342 15499 1 19 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.691 0.106 25342 15500 1 19 . 1 1 78 78 ASP C C 78 172.623 172.623 175.632 -3.009 25342 15501 1 19 . 1 1 78 78 ASP CA C 78 53.190 53.190 55.862 -2.672 25342 15502 1 19 . 1 1 78 78 ASP CB C 78 41.035 41.035 43.195 -2.160 25342 15503 1 19 . 1 1 78 78 ASP H H 78 9.036 9.036 8.396 0.640 25342 15504 1 19 . 1 1 79 79 LEU N N 79 123.073 123.073 118.796 4.277 25342 15505 1 19 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.387 -0.279 25342 15506 1 19 . 1 1 79 79 LEU C C 79 170.730 170.730 174.693 -3.963 25342 15507 1 19 . 1 1 79 79 LEU CA C 79 51.257 51.257 53.738 -2.481 25342 15508 1 19 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.529 -4.245 25342 15509 1 19 . 1 1 79 79 LEU H H 79 7.877 7.877 8.246 -0.369 25342 15510 1 19 . 1 1 80 80 ILE N N 80 126.348 126.348 122.398 3.950 25342 15511 1 19 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.677 0.392 25342 15512 1 19 . 1 1 80 80 ILE C C 80 171.584 171.584 174.377 -2.793 25342 15513 1 19 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.106 -2.691 25342 15514 1 19 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.607 -2.609 25342 15515 1 19 . 1 1 80 80 ILE H H 80 8.704 8.704 8.249 0.455 25342 15516 1 19 . 1 1 81 81 LEU N N 81 126.303 126.303 128.631 -2.328 25342 15517 1 19 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.989 0.134 25342 15518 1 19 . 1 1 81 81 LEU C C 81 172.779 172.779 175.615 -2.836 25342 15519 1 19 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.427 -4.918 25342 15520 1 19 . 1 1 81 81 LEU CB C 81 41.715 41.715 44.183 -2.468 25342 15521 1 19 . 1 1 81 81 LEU H H 81 9.202 9.202 8.090 1.112 25342 15522 1 19 . 1 1 82 82 ILE N N 82 120.931 120.931 123.143 -2.212 25342 15523 1 19 . 1 1 82 82 ILE HA H 82 4.847 4.847 5.264 -0.417 25342 15524 1 19 . 1 1 82 82 ILE C C 82 172.796 172.796 175.007 -2.211 25342 15525 1 19 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.732 -2.851 25342 15526 1 19 . 1 1 82 82 ILE CB C 82 37.797 37.797 41.928 -4.131 25342 15527 1 19 . 1 1 82 82 ILE H H 82 8.846 8.846 8.971 -0.125 25342 15528 1 19 . 1 1 83 83 GLY N N 83 120.905 120.905 111.773 9.132 25342 15529 1 19 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.071 -2.514 25342 15530 1 19 . 1 1 83 83 GLY H H 83 9.558 9.558 8.149 1.409 25342 15531 1 19 . 1 1 84 84 SER N N 84 116.601 116.601 114.472 2.129 25342 15532 1 19 . 1 1 84 84 SER HA H 84 5.476 5.476 5.077 0.399 25342 15533 1 19 . 1 1 84 84 SER CA C 84 51.324 51.324 55.588 -4.264 25342 15534 1 19 . 1 1 84 84 SER CB C 84 64.271 64.271 64.435 -0.164 25342 15535 1 19 . 1 1 84 84 SER H H 84 7.533 7.533 7.572 -0.039 25342 15536 1 19 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.469 0.694 25342 15537 1 19 . 1 1 85 85 PRO C C 85 175.590 175.590 176.435 -0.845 25342 15538 1 19 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.312 -3.429 25342 15539 1 19 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.703 -2.229 25342 15540 1 19 . 1 1 86 86 VAL N N 86 116.295 116.295 118.383 -2.088 25342 15541 1 19 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.353 -0.532 25342 15542 1 19 . 1 1 86 86 VAL C C 86 172.692 172.692 175.608 -2.916 25342 15543 1 19 . 1 1 86 86 VAL CA C 86 59.812 59.812 60.818 -1.006 25342 15544 1 19 . 1 1 86 86 VAL CB C 86 30.083 30.083 33.241 -3.158 25342 15545 1 19 . 1 1 86 86 VAL H H 86 7.246 7.246 7.584 -0.338 25342 15546 1 19 . 1 1 87 87 TRP N N 87 131.042 131.042 124.053 6.989 25342 15547 1 19 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.766 -0.455 25342 15548 1 19 . 1 1 87 87 TRP C C 87 173.323 173.323 175.694 -2.371 25342 15549 1 19 . 1 1 87 87 TRP CA C 87 50.887 50.887 55.503 -4.616 25342 15550 1 19 . 1 1 87 87 TRP CB C 87 27.310 27.310 32.927 -5.617 25342 15551 1 19 . 1 1 87 87 TRP H H 87 9.555 9.555 8.717 0.838 25342 15552 1 19 . 1 1 88 88 SER N N 88 122.660 122.660 116.134 6.526 25342 15553 1 19 . 1 1 88 88 SER HA H 88 4.582 4.582 4.346 0.236 25342 15554 1 19 . 1 1 88 88 SER C C 88 172.096 172.096 175.502 -3.406 25342 15555 1 19 . 1 1 88 88 SER CA C 88 55.391 55.391 59.763 -4.372 25342 15556 1 19 . 1 1 88 88 SER CB C 88 57.813 57.813 61.833 -4.020 25342 15557 1 19 . 1 1 88 88 SER H H 88 10.257 10.257 8.979 1.278 25342 15558 1 19 . 1 1 89 89 GLY N N 89 128.381 128.381 113.271 15.110 25342 15559 1 19 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.846 -3.217 25342 15560 1 19 . 1 1 89 89 GLY H H 89 6.372 6.372 8.754 -2.382 25342 15561 1 19 . 1 1 90 90 TYR N N 90 120.345 120.345 115.028 5.317 25342 15562 1 19 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.488 -1.299 25342 15563 1 19 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.499 0.050 25342 15564 1 19 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.255 -1.060 25342 15565 1 19 . 1 1 90 90 TYR H H 90 8.113 8.113 7.170 0.943 25342 15566 1 19 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.458 0.376 25342 15567 1 19 . 1 1 91 91 PRO C C 91 170.911 170.911 177.387 -6.476 25342 15568 1 19 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.456 -3.621 25342 15569 1 19 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.273 -6.203 25342 15570 1 19 . 1 1 92 92 ALA N N 92 120.629 120.629 124.387 -3.758 25342 15571 1 19 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.350 0.269 25342 15572 1 19 . 1 1 92 92 ALA C C 92 176.782 176.782 176.492 0.290 25342 15573 1 19 . 1 1 92 92 ALA CA C 92 49.417 49.417 50.727 -1.310 25342 15574 1 19 . 1 1 92 92 ALA CB C 92 15.516 15.516 16.773 -1.258 25342 15575 1 19 . 1 1 92 92 ALA H H 92 7.554 7.554 8.694 -1.140 25342 15576 1 19 . 1 1 93 93 THR N N 93 112.558 112.558 109.928 2.630 25342 15577 1 19 . 1 1 93 93 THR CB C 93 64.173 64.173 66.961 -2.788 25342 15578 1 19 . 1 1 93 93 THR H H 93 6.730 6.730 7.673 -0.943 25342 15579 1 19 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.240 -0.381 25342 15580 1 19 . 1 1 94 94 PRO C C 94 173.309 173.309 177.248 -3.939 25342 15581 1 19 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.238 -1.175 25342 15582 1 19 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.332 -3.053 25342 15583 1 19 . 1 1 95 95 ILE N N 95 111.014 111.014 119.646 -8.632 25342 15584 1 19 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.236 -0.631 25342 15585 1 19 . 1 1 95 95 ILE C C 95 174.302 174.302 174.868 -0.566 25342 15586 1 19 . 1 1 95 95 ILE CA C 95 57.181 57.181 59.248 -2.067 25342 15587 1 19 . 1 1 95 95 ILE CB C 95 31.783 31.783 35.132 -3.349 25342 15588 1 19 . 1 1 95 95 ILE H H 95 7.995 7.995 7.959 0.036 25342 15589 1 19 . 1 1 96 96 LYS N N 96 123.208 123.208 121.039 2.169 25342 15590 1 19 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.622 -1.530 25342 15591 1 19 . 1 1 96 96 LYS C C 96 174.451 174.451 177.435 -2.984 25342 15592 1 19 . 1 1 96 96 LYS CA C 96 57.041 57.041 57.368 -0.327 25342 15593 1 19 . 1 1 96 96 LYS CB C 96 28.747 28.747 34.531 -5.784 25342 15594 1 19 . 1 1 96 96 LYS H H 96 6.928 6.928 7.813 -0.885 25342 15595 1 19 . 1 1 97 97 THR N N 97 113.320 113.320 117.792 -4.472 25342 15596 1 19 . 1 1 97 97 THR HA H 97 3.436 3.436 3.554 -0.118 25342 15597 1 19 . 1 1 97 97 THR C C 97 173.221 173.221 176.181 -2.960 25342 15598 1 19 . 1 1 97 97 THR CA C 97 62.710 62.710 66.148 -3.438 25342 15599 1 19 . 1 1 97 97 THR CB C 97 65.562 65.562 68.329 -2.767 25342 15600 1 19 . 1 1 97 97 THR H H 97 6.325 6.325 7.459 -1.134 25342 15601 1 19 . 1 1 98 98 LEU N N 98 120.963 120.963 122.467 -1.504 25342 15602 1 19 . 1 1 98 98 LEU HA H 98 3.625 3.625 3.994 -0.369 25342 15603 1 19 . 1 1 98 98 LEU C C 98 174.713 174.713 177.675 -2.962 25342 15604 1 19 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.934 -2.420 25342 15605 1 19 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.717 -1.988 25342 15606 1 19 . 1 1 98 98 LEU H H 98 7.536 7.536 7.772 -0.236 25342 15607 1 19 . 1 1 99 99 LEU N N 99 118.859 118.859 117.164 1.695 25342 15608 1 19 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.773 -0.101 25342 15609 1 19 . 1 1 99 99 LEU C C 99 177.458 177.458 178.179 -0.721 25342 15610 1 19 . 1 1 99 99 LEU CA C 99 55.145 55.145 57.407 -2.262 25342 15611 1 19 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.380 -2.523 25342 15612 1 19 . 1 1 99 99 LEU H H 99 8.179 8.179 7.729 0.450 25342 15613 1 19 . 1 1 100 100 ASP N N 100 118.703 118.703 116.051 2.652 25342 15614 1 19 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.311 -0.090 25342 15615 1 19 . 1 1 100 100 ASP C C 100 176.472 176.472 179.175 -2.703 25342 15616 1 19 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.782 -2.475 25342 15617 1 19 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.971 -3.613 25342 15618 1 19 . 1 1 100 100 ASP H H 100 7.867 7.867 7.523 0.344 25342 15619 1 19 . 1 1 101 101 GLN N N 101 117.829 117.829 118.875 -1.046 25342 15620 1 19 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.127 0.073 25342 15621 1 19 . 1 1 101 101 GLN C C 101 174.508 174.508 178.405 -3.897 25342 15622 1 19 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.425 -3.737 25342 15623 1 19 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.159 -3.562 25342 15624 1 19 . 1 1 101 101 GLN H H 101 7.597 7.597 7.567 0.030 25342 15625 1 19 . 1 1 102 102 MET N N 102 118.406 118.406 114.246 4.160 25342 15626 1 19 . 1 1 102 102 MET HA H 102 3.864 3.864 4.557 -0.693 25342 15627 1 19 . 1 1 102 102 MET C C 102 172.820 172.820 176.955 -4.135 25342 15628 1 19 . 1 1 102 102 MET CA C 102 53.298 53.298 56.612 -3.314 25342 15629 1 19 . 1 1 102 102 MET CB C 102 31.207 31.207 31.500 -0.293 25342 15630 1 19 . 1 1 102 102 MET H H 102 7.434 7.434 7.735 -0.301 25342 15631 1 19 . 1 1 103 103 LYS N N 103 115.889 115.889 119.802 -3.913 25342 15632 1 19 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.069 -0.150 25342 15633 1 19 . 1 1 103 103 LYS C C 103 173.938 173.938 177.413 -3.475 25342 15634 1 19 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.584 -2.147 25342 15635 1 19 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.628 -2.365 25342 15636 1 19 . 1 1 103 103 LYS H H 103 6.881 6.881 7.602 -0.721 25342 15637 1 19 . 1 1 104 104 ASN N N 104 114.951 114.951 114.564 0.387 25342 15638 1 19 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.949 -0.218 25342 15639 1 19 . 1 1 104 104 ASN C C 104 172.617 172.617 175.228 -2.611 25342 15640 1 19 . 1 1 104 104 ASN CA C 104 50.266 50.266 52.944 -2.678 25342 15641 1 19 . 1 1 104 104 ASN CB C 104 35.783 35.783 40.033 -4.250 25342 15642 1 19 . 1 1 104 104 ASN H H 104 8.493 8.493 8.362 0.131 25342 15643 1 19 . 1 1 105 105 TYR N N 105 122.680 122.680 120.575 2.105 25342 15644 1 19 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.897 -0.335 25342 15645 1 19 . 1 1 105 105 TYR CA C 105 55.433 55.433 56.877 -1.444 25342 15646 1 19 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.219 -3.387 25342 15647 1 19 . 1 1 105 105 TYR H H 105 8.217 8.217 7.633 0.584 25342 15648 1 19 . 1 1 106 106 ARG N N 106 128.872 128.872 120.260 8.612 25342 15649 1 19 . 1 1 106 106 ARG HA H 106 4.265 4.265 3.913 0.352 25342 15650 1 19 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.273 -2.291 25342 15651 1 19 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.401 -5.271 25342 15652 1 19 . 1 1 106 106 ARG H H 106 8.801 8.801 8.493 0.308 25342 15653 1 19 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.649 -2.248 25342 15654 1 19 . 1 1 108 108 GLU N N 108 117.000 117.000 119.963 -2.963 25342 15655 1 19 . 1 1 108 108 GLU HA H 108 4.626 4.626 5.113 -0.487 25342 15656 1 19 . 1 1 108 108 GLU C C 108 174.125 174.125 175.232 -1.107 25342 15657 1 19 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.317 -1.529 25342 15658 1 19 . 1 1 108 108 GLU CB C 108 30.440 30.440 33.761 -3.321 25342 15659 1 19 . 1 1 108 108 GLU H H 108 7.514 7.514 8.216 -0.702 25342 15660 1 19 . 1 1 109 109 VAL N N 109 123.398 123.398 120.023 3.375 25342 15661 1 19 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.999 0.338 25342 15662 1 19 . 1 1 109 109 VAL C C 109 170.606 170.606 173.665 -3.059 25342 15663 1 19 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.907 -3.627 25342 15664 1 19 . 1 1 109 109 VAL CB C 109 32.657 32.657 36.066 -3.409 25342 15665 1 19 . 1 1 109 109 VAL H H 109 8.942 8.942 8.014 0.928 25342 15666 1 19 . 1 1 110 110 ALA N N 110 127.905 127.905 128.352 -0.447 25342 15667 1 19 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.820 -0.193 25342 15668 1 19 . 1 1 110 110 ALA C C 110 173.195 173.195 174.871 -1.676 25342 15669 1 19 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.547 -2.201 25342 15670 1 19 . 1 1 110 110 ALA CB C 110 18.325 18.325 21.904 -3.579 25342 15671 1 19 . 1 1 110 110 ALA H H 110 8.776 8.776 8.615 0.161 25342 15672 1 19 . 1 1 111 111 SER N N 111 110.523 110.523 114.860 -4.337 25342 15673 1 19 . 1 1 111 111 SER HA H 111 5.562 5.562 5.560 0.002 25342 15674 1 19 . 1 1 111 111 SER C C 111 170.719 170.719 173.318 -2.599 25342 15675 1 19 . 1 1 111 111 SER CA C 111 51.314 51.314 57.127 -5.813 25342 15676 1 19 . 1 1 111 111 SER CB C 111 61.907 61.907 64.871 -2.963 25342 15677 1 19 . 1 1 111 111 SER H H 111 7.480 7.480 7.915 -0.435 25342 15678 1 19 . 1 1 112 112 PHE N N 112 125.567 125.567 122.495 3.072 25342 15679 1 19 . 1 1 112 112 PHE HA H 112 6.356 6.356 6.190 0.166 25342 15680 1 19 . 1 1 112 112 PHE C C 112 169.536 169.536 173.459 -3.923 25342 15681 1 19 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.556 -5.184 25342 15682 1 19 . 1 1 112 112 PHE CB C 112 39.788 39.788 43.364 -3.576 25342 15683 1 19 . 1 1 112 112 PHE H H 112 7.848 7.848 8.308 -0.460 25342 15684 1 19 . 1 1 113 113 PHE N N 113 115.065 115.065 113.811 1.254 25342 15685 1 19 . 1 1 113 113 PHE HA H 113 6.104 6.104 4.781 1.323 25342 15686 1 19 . 1 1 113 113 PHE C C 113 173.006 173.006 173.467 -0.461 25342 15687 1 19 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.619 -5.357 25342 15688 1 19 . 1 1 113 113 PHE CB C 113 38.749 38.749 41.115 -2.366 25342 15689 1 19 . 1 1 113 113 PHE H H 113 7.361 7.361 7.941 -0.580 25342 15690 1 19 . 1 1 114 114 THR N N 114 108.014 108.014 113.760 -5.746 25342 15691 1 19 . 1 1 114 114 THR HA H 114 4.999 4.999 4.655 0.344 25342 15692 1 19 . 1 1 114 114 THR C C 114 169.874 169.874 173.822 -3.948 25342 15693 1 19 . 1 1 114 114 THR CA C 114 56.500 56.500 60.875 -4.375 25342 15694 1 19 . 1 1 114 114 THR CB C 114 68.809 68.809 70.088 -1.279 25342 15695 1 19 . 1 1 114 114 THR H H 114 7.867 7.867 7.768 0.099 25342 15696 1 19 . 1 1 115 115 SER N N 115 115.049 115.049 120.244 -5.195 25342 15697 1 19 . 1 1 115 115 SER HA H 115 5.613 5.613 4.544 1.069 25342 15698 1 19 . 1 1 115 115 SER C C 115 171.247 171.247 173.795 -2.548 25342 15699 1 19 . 1 1 115 115 SER CA C 115 54.830 54.830 56.915 -2.085 25342 15700 1 19 . 1 1 115 115 SER CB C 115 63.992 63.992 65.837 -1.845 25342 15701 1 19 . 1 1 115 115 SER H H 115 8.970 8.970 8.363 0.607 25342 15702 1 19 . 1 1 116 116 ALA N N 116 122.671 122.671 123.936 -1.265 25342 15703 1 19 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.491 0.494 25342 15704 1 19 . 1 1 116 116 ALA C C 116 176.180 176.180 177.710 -1.530 25342 15705 1 19 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.014 -1.815 25342 15706 1 19 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.870 -1.875 25342 15707 1 19 . 1 1 116 116 ALA H H 116 8.963 8.963 9.013 -0.050 25342 15708 1 19 . 1 1 117 117 GLY N N 117 107.387 107.387 108.019 -0.632 25342 15709 1 19 . 1 1 117 117 GLY C C 117 172.528 172.528 174.385 -1.857 25342 15710 1 19 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.664 -1.932 25342 15711 1 19 . 1 1 117 117 GLY H H 117 9.340 9.340 7.984 1.356 25342 15712 1 19 . 1 1 118 118 THR N N 118 113.481 113.481 112.061 1.420 25342 15713 1 19 . 1 1 118 118 THR HA H 118 4.651 4.651 4.471 0.180 25342 15714 1 19 . 1 1 118 118 THR C C 118 172.067 172.067 173.361 -1.294 25342 15715 1 19 . 1 1 118 118 THR CA C 118 57.357 57.357 60.049 -2.692 25342 15716 1 19 . 1 1 118 118 THR CB C 118 69.475 69.475 71.020 -1.545 25342 15717 1 19 . 1 1 118 118 THR H H 118 9.373 9.373 7.538 1.835 25342 15718 1 19 . 1 1 119 119 ASN N N 119 113.202 113.202 115.660 -2.458 25342 15719 1 19 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.127 0.491 25342 15720 1 19 . 1 1 119 119 ASN C C 119 173.114 173.114 175.341 -2.227 25342 15721 1 19 . 1 1 119 119 ASN CA C 119 51.684 51.684 53.614 -1.931 25342 15722 1 19 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.017 -3.287 25342 15723 1 19 . 1 1 119 119 ASN H H 119 8.908 8.908 8.629 0.279 25342 15724 1 19 . 1 1 120 120 HIS N N 120 117.315 117.315 119.228 -1.913 25342 15725 1 19 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.230 -0.444 25342 15726 1 19 . 1 1 120 120 HIS C C 120 174.381 174.381 176.645 -2.264 25342 15727 1 19 . 1 1 120 120 HIS CA C 120 54.516 54.516 60.357 -5.841 25342 15728 1 19 . 1 1 120 120 HIS CB C 120 26.504 26.504 30.106 -3.602 25342 15729 1 19 . 1 1 120 120 HIS H H 120 8.074 8.074 8.393 -0.319 25342 15730 1 19 . 1 1 121 121 LYS N N 121 118.678 118.678 117.443 1.235 25342 15731 1 19 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.911 -0.077 25342 15732 1 19 . 1 1 121 121 LYS C C 121 176.564 176.564 178.320 -1.756 25342 15733 1 19 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.507 -2.212 25342 15734 1 19 . 1 1 121 121 LYS CB C 121 28.942 28.942 32.111 -3.169 25342 15735 1 19 . 1 1 121 121 LYS H H 121 8.336 8.336 8.470 -0.134 25342 15736 1 19 . 1 1 122 122 ALA N N 122 122.146 122.146 121.843 0.303 25342 15737 1 19 . 1 1 122 122 ALA HA H 122 3.695 3.695 3.755 -0.060 25342 15738 1 19 . 1 1 122 122 ALA C C 122 175.163 175.163 179.661 -4.498 25342 15739 1 19 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.737 -3.045 25342 15740 1 19 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.811 -2.093 25342 15741 1 19 . 1 1 122 122 ALA H H 122 7.584 7.584 7.262 0.322 25342 15742 1 19 . 1 1 123 123 TYR N N 123 119.730 119.730 117.981 1.749 25342 15743 1 19 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.326 -1.173 25342 15744 1 19 . 1 1 123 123 TYR C C 123 174.340 174.340 178.976 -4.636 25342 15745 1 19 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.031 0.367 25342 15746 1 19 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.100 -2.437 25342 15747 1 19 . 1 1 123 123 TYR H H 123 7.317 7.317 7.682 -0.365 25342 15748 1 19 . 1 1 124 124 VAL N N 124 118.649 118.649 118.460 0.189 25342 15749 1 19 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.524 -0.322 25342 15750 1 19 . 1 1 124 124 VAL C C 124 175.603 175.603 178.484 -2.881 25342 15751 1 19 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.754 -2.074 25342 15752 1 19 . 1 1 124 124 VAL CB C 124 29.289 29.289 31.278 -1.989 25342 15753 1 19 . 1 1 124 124 VAL H H 124 7.799 7.799 7.923 -0.124 25342 15754 1 19 . 1 1 125 125 SER N N 125 114.475 114.475 115.957 -1.482 25342 15755 1 19 . 1 1 125 125 SER HA H 125 4.032 4.032 4.225 -0.193 25342 15756 1 19 . 1 1 125 125 SER C C 125 174.849 174.849 176.964 -2.115 25342 15757 1 19 . 1 1 125 125 SER CA C 125 59.002 59.002 62.245 -3.243 25342 15758 1 19 . 1 1 125 125 SER CB C 125 59.613 59.613 63.098 -3.485 25342 15759 1 19 . 1 1 125 125 SER H H 125 7.766 7.766 7.619 0.147 25342 15760 1 19 . 1 1 126 126 HIS N N 126 119.326 119.326 121.391 -2.065 25342 15761 1 19 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.276 -0.149 25342 15762 1 19 . 1 1 126 126 HIS C C 126 172.865 172.865 177.857 -4.992 25342 15763 1 19 . 1 1 126 126 HIS CA C 126 55.706 55.706 58.994 -3.288 25342 15764 1 19 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.100 -4.107 25342 15765 1 19 . 1 1 126 126 HIS H H 126 8.569 8.569 8.595 -0.026 25342 15766 1 19 . 1 1 127 127 PHE N N 127 121.044 121.044 120.189 0.855 25342 15767 1 19 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.287 -1.113 25342 15768 1 19 . 1 1 127 127 PHE C C 127 173.378 173.378 176.348 -2.970 25342 15769 1 19 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.515 0.352 25342 15770 1 19 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.018 -2.964 25342 15771 1 19 . 1 1 127 127 PHE H H 127 9.139 9.139 8.733 0.406 25342 15772 1 19 . 1 1 128 128 ASN N N 128 114.893 114.893 116.623 -1.730 25342 15773 1 19 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.098 -0.058 25342 15774 1 19 . 1 1 128 128 ASN C C 128 175.230 175.230 178.173 -2.943 25342 15775 1 19 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.359 -2.059 25342 15776 1 19 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.295 -2.124 25342 15777 1 19 . 1 1 128 128 ASN H H 128 7.774 7.774 7.952 -0.178 25342 15778 1 19 . 1 1 129 129 GLU N N 129 119.804 119.804 121.292 -1.488 25342 15779 1 19 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.870 0.170 25342 15780 1 19 . 1 1 129 129 GLU C C 129 177.052 177.052 178.804 -1.752 25342 15781 1 19 . 1 1 129 129 GLU CA C 129 56.730 56.730 59.541 -2.811 25342 15782 1 19 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.322 -2.126 25342 15783 1 19 . 1 1 129 129 GLU H H 129 7.577 7.577 7.825 -0.248 25342 15784 1 19 . 1 1 130 130 TRP N N 130 120.979 120.979 116.652 4.327 25342 15785 1 19 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.338 0.119 25342 15786 1 19 . 1 1 130 130 TRP C C 130 174.329 174.329 175.581 -1.252 25342 15787 1 19 . 1 1 130 130 TRP CA C 130 54.688 54.688 58.108 -3.421 25342 15788 1 19 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.317 -2.326 25342 15789 1 19 . 1 1 130 130 TRP H H 130 8.225 8.225 7.358 0.867 25342 15790 1 19 . 1 1 131 131 ALA N N 131 120.450 120.450 117.577 2.873 25342 15791 1 19 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.418 -0.482 25342 15792 1 19 . 1 1 131 131 ALA C C 131 172.487 172.487 175.452 -2.965 25342 15793 1 19 . 1 1 131 131 ALA CA C 131 48.434 48.434 50.849 -2.415 25342 15794 1 19 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.720 -3.432 25342 15795 1 19 . 1 1 131 131 ALA H H 131 8.081 8.081 7.168 0.913 25342 15796 1 19 . 1 1 132 132 ASP N N 132 117.813 117.813 120.700 -2.887 25342 15797 1 19 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.391 -0.183 25342 15798 1 19 . 1 1 132 132 ASP C C 132 173.804 173.804 176.336 -2.532 25342 15799 1 19 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.572 -1.391 25342 15800 1 19 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.131 -0.810 25342 15801 1 19 . 1 1 132 132 ASP H H 132 6.772 6.772 7.510 -0.738 25342 15802 1 19 . 1 1 133 133 GLY N N 133 115.052 115.052 112.983 2.069 25342 15803 1 19 . 1 1 133 133 GLY C C 133 172.078 172.078 173.879 -1.801 25342 15804 1 19 . 1 1 133 133 GLY CA C 133 42.420 42.420 45.094 -2.674 25342 15805 1 19 . 1 1 133 133 GLY H H 133 8.626 8.626 7.890 0.736 25342 15806 1 19 . 1 1 134 134 LEU N N 134 120.063 120.063 123.294 -3.231 25342 15807 1 19 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.673 -0.201 25342 15808 1 19 . 1 1 134 134 LEU C C 134 174.079 174.079 176.202 -2.123 25342 15809 1 19 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.947 -2.983 25342 15810 1 19 . 1 1 134 134 LEU CB C 134 40.370 40.370 42.676 -2.306 25342 15811 1 19 . 1 1 134 134 LEU H H 134 8.094 8.094 8.092 0.002 25342 15812 1 19 . 1 1 135 135 ASN N N 135 119.292 119.292 121.688 -2.396 25342 15813 1 19 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.731 -0.108 25342 15814 1 19 . 1 1 135 135 ASN C C 135 170.527 170.527 174.691 -4.164 25342 15815 1 19 . 1 1 135 135 ASN CA C 135 49.002 49.002 52.925 -3.922 25342 15816 1 19 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.019 -4.459 25342 15817 1 19 . 1 1 135 135 ASN H H 135 8.513 8.513 8.761 -0.248 25342 15818 1 19 . 1 1 136 136 VAL N N 136 125.412 125.412 124.406 1.006 25342 15819 1 19 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.235 0.371 25342 15820 1 19 . 1 1 136 136 VAL C C 136 175.420 175.420 176.910 -1.490 25342 15821 1 19 . 1 1 136 136 VAL CA C 136 58.382 58.382 63.644 -5.262 25342 15822 1 19 . 1 1 136 136 VAL CB C 136 29.247 29.247 32.289 -3.042 25342 15823 1 19 . 1 1 136 136 VAL H H 136 7.648 7.648 7.937 -0.289 25342 15824 1 19 . 1 1 137 137 ILE N N 137 121.881 121.881 119.621 2.260 25342 15825 1 19 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.655 -0.222 25342 15826 1 19 . 1 1 137 137 ILE C C 137 173.906 173.906 174.996 -1.090 25342 15827 1 19 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.579 -1.601 25342 15828 1 19 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.853 -2.657 25342 15829 1 19 . 1 1 137 137 ILE H H 137 9.139 9.139 9.057 0.082 25342 15830 1 19 . 1 1 138 138 GLY N N 138 108.226 108.226 106.902 1.324 25342 15831 1 19 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.575 -2.184 25342 15832 1 19 . 1 1 138 138 GLY H H 138 6.645 6.645 7.481 -0.836 25342 15833 1 19 . 1 1 139 139 VAL N N 139 119.408 119.408 122.225 -2.817 25342 15834 1 19 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.283 0.074 25342 15835 1 19 . 1 1 139 139 VAL C C 139 172.327 172.327 175.739 -3.412 25342 15836 1 19 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.154 -2.888 25342 15837 1 19 . 1 1 139 139 VAL CB C 139 32.743 32.743 32.294 0.449 25342 15838 1 19 . 1 1 139 139 VAL H H 139 8.092 8.092 8.655 -0.563 25342 15839 1 19 . 1 1 140 140 ALA N N 140 127.415 127.415 132.740 -5.325 25342 15840 1 19 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.230 -0.785 25342 15841 1 19 . 1 1 140 140 ALA C C 140 170.718 170.718 175.329 -4.611 25342 15842 1 19 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.177 -2.277 25342 15843 1 19 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.644 -1.585 25342 15844 1 19 . 1 1 140 140 ALA H H 140 9.093 9.093 9.566 -0.473 25342 15845 1 19 . 1 1 141 141 ARG N N 141 119.287 119.287 118.257 1.030 25342 15846 1 19 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.114 -2.627 25342 15847 1 19 . 1 1 141 141 ARG C C 141 173.375 173.375 175.973 -2.598 25342 15848 1 19 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.706 -2.822 25342 15849 1 19 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.010 -4.325 25342 15850 1 19 . 1 1 141 141 ARG H H 141 7.620 7.620 8.355 -0.735 25342 15851 1 19 . 1 1 142 142 ASP N N 142 125.999 125.999 120.420 5.579 25342 15852 1 19 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.312 -0.588 25342 15853 1 19 . 1 1 142 142 ASP C C 142 169.292 169.292 175.388 -6.096 25342 15854 1 19 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.692 -3.354 25342 15855 1 19 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.786 -4.109 25342 15856 1 19 . 1 1 142 142 ASP H H 142 9.482 9.482 8.552 0.930 25342 15857 1 19 . 1 1 143 143 ASP N N 143 119.293 119.293 119.966 -0.673 25342 15858 1 19 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.500 -0.194 25342 15859 1 19 . 1 1 143 143 ASP C C 143 175.686 175.686 175.894 -0.208 25342 15860 1 19 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.004 -4.099 25342 15861 1 19 . 1 1 143 143 ASP CB C 143 36.312 36.312 39.676 -3.364 25342 15862 1 19 . 1 1 143 143 ASP H H 143 8.108 8.108 8.493 -0.385 25342 15863 1 19 . 1 1 144 144 SER N N 144 115.303 115.303 114.346 0.957 25342 15864 1 19 . 1 1 144 144 SER HA H 144 3.740 3.740 4.510 -0.770 25342 15865 1 19 . 1 1 144 144 SER C C 144 172.925 172.925 174.876 -1.951 25342 15866 1 19 . 1 1 144 144 SER CA C 144 59.213 59.213 58.763 0.450 25342 15867 1 19 . 1 1 144 144 SER CB C 144 60.806 60.806 63.973 -3.167 25342 15868 1 19 . 1 1 144 144 SER H H 144 7.642 7.642 7.744 -0.102 25342 15869 1 19 . 1 1 145 145 GLU N N 145 119.523 119.523 121.722 -2.199 25342 15870 1 19 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.156 0.150 25342 15871 1 19 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.733 -3.694 25342 15872 1 19 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.422 -2.622 25342 15873 1 19 . 1 1 145 145 GLU H H 145 7.771 7.771 8.063 -0.292 25342 15874 1 19 . 1 1 146 146 VAL N N 146 118.683 118.683 121.331 -2.648 25342 15875 1 19 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.543 -0.602 25342 15876 1 19 . 1 1 146 146 VAL C C 146 174.591 174.591 177.484 -2.893 25342 15877 1 19 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.203 -2.271 25342 15878 1 19 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.335 -2.288 25342 15879 1 19 . 1 1 146 146 VAL H H 146 6.352 6.352 7.798 -1.446 25342 15880 1 19 . 1 1 147 147 ASP N N 147 119.312 119.312 117.174 2.138 25342 15881 1 19 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.442 -0.387 25342 15882 1 19 . 1 1 147 147 ASP C C 147 174.783 174.783 176.722 -1.939 25342 15883 1 19 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.514 -2.273 25342 15884 1 19 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.313 -3.080 25342 15885 1 19 . 1 1 147 147 ASP H H 147 8.370 8.370 8.582 -0.212 25342 15886 1 19 . 1 1 148 148 LYS N N 148 119.342 119.342 114.595 4.747 25342 15887 1 19 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.610 -0.673 25342 15888 1 19 . 1 1 148 148 LYS C C 148 176.384 176.384 177.995 -1.611 25342 15889 1 19 . 1 1 148 148 LYS CA C 148 55.706 55.706 56.258 -0.552 25342 15890 1 19 . 1 1 148 148 LYS CB C 148 29.511 29.511 33.045 -3.534 25342 15891 1 19 . 1 1 148 148 LYS H H 148 7.040 7.040 7.649 -0.609 25342 15892 1 19 . 1 1 149 149 TRP N N 149 118.258 118.258 121.427 -3.169 25342 15893 1 19 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.948 -0.357 25342 15894 1 19 . 1 1 149 149 TRP C C 149 174.212 174.212 176.125 -1.913 25342 15895 1 19 . 1 1 149 149 TRP CA C 149 53.745 53.745 55.767 -2.022 25342 15896 1 19 . 1 1 149 149 TRP CB C 149 26.940 26.940 29.027 -2.087 25342 15897 1 19 . 1 1 149 149 TRP H H 149 7.811 7.811 7.487 0.324 25342 15898 1 19 . 1 1 150 150 SER N N 150 109.618 109.618 112.561 -2.943 25342 15899 1 19 . 1 1 150 150 SER HA H 150 4.234 4.234 4.693 -0.459 25342 15900 1 19 . 1 1 150 150 SER C C 150 170.189 170.189 174.449 -4.260 25342 15901 1 19 . 1 1 150 150 SER CA C 150 56.695 56.695 57.290 -0.595 25342 15902 1 19 . 1 1 150 150 SER CB C 150 61.935 61.935 63.301 -1.366 25342 15903 1 19 . 1 1 150 150 SER H H 150 7.793 7.793 8.030 -0.237 25342 15904 1 20 . 1 1 3 3 ALA N N 3 125.638 125.638 126.695 -1.057 25342 15905 1 20 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.532 -0.167 25342 15906 1 20 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.196 -2.898 25342 15907 1 20 . 1 1 3 3 ALA CB C 3 16.859 16.859 20.149 -3.290 25342 15908 1 20 . 1 1 3 3 ALA H H 3 8.325 8.325 8.158 0.167 25342 15909 1 20 . 1 1 4 4 LYS N N 4 121.813 121.813 119.331 2.482 25342 15910 1 20 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.538 -0.311 25342 15911 1 20 . 1 1 4 4 LYS C C 4 174.574 174.574 173.999 0.575 25342 15912 1 20 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.317 -1.536 25342 15913 1 20 . 1 1 4 4 LYS CB C 4 31.490 31.490 34.474 -2.983 25342 15914 1 20 . 1 1 4 4 LYS H H 4 8.486 8.486 7.912 0.574 25342 15915 1 20 . 1 1 5 5 LYS N N 5 129.722 129.722 119.233 10.489 25342 15916 1 20 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.783 -0.265 25342 15917 1 20 . 1 1 5 5 LYS C C 5 174.720 174.720 174.807 -0.087 25342 15918 1 20 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.706 -0.984 25342 15919 1 20 . 1 1 5 5 LYS CB C 5 29.785 29.785 37.111 -7.326 25342 15920 1 20 . 1 1 5 5 LYS H H 5 10.015 10.015 8.343 1.672 25342 15921 1 20 . 1 1 6 6 THR N N 6 126.254 126.254 117.321 8.933 25342 15922 1 20 . 1 1 6 6 THR HA H 6 5.654 5.654 5.229 0.425 25342 15923 1 20 . 1 1 6 6 THR C C 6 169.926 169.926 173.264 -3.338 25342 15924 1 20 . 1 1 6 6 THR CA C 6 60.598 60.598 62.469 -1.871 25342 15925 1 20 . 1 1 6 6 THR CB C 6 68.041 68.041 69.571 -1.530 25342 15926 1 20 . 1 1 6 6 THR H H 6 8.538 8.538 8.773 -0.235 25342 15927 1 20 . 1 1 7 7 LEU N N 7 130.775 130.775 127.900 2.875 25342 15928 1 20 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.621 -0.027 25342 15929 1 20 . 1 1 7 7 LEU C C 7 170.404 170.404 174.399 -3.995 25342 15930 1 20 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.424 -3.491 25342 15931 1 20 . 1 1 7 7 LEU CB C 7 40.728 40.728 44.881 -4.153 25342 15932 1 20 . 1 1 7 7 LEU H H 7 8.575 8.575 8.584 -0.009 25342 15933 1 20 . 1 1 8 8 ILE N N 8 127.242 127.242 119.520 7.722 25342 15934 1 20 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.473 0.375 25342 15935 1 20 . 1 1 8 8 ILE C C 8 170.936 170.936 174.188 -3.252 25342 15936 1 20 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.156 -2.904 25342 15937 1 20 . 1 1 8 8 ILE CB C 8 36.935 36.935 40.497 -3.562 25342 15938 1 20 . 1 1 8 8 ILE H H 8 9.217 9.217 7.401 1.816 25342 15939 1 20 . 1 1 9 9 LEU N N 9 127.183 127.183 125.242 1.941 25342 15940 1 20 . 1 1 9 9 LEU HA H 9 5.694 5.694 5.025 0.669 25342 15941 1 20 . 1 1 9 9 LEU C C 9 173.824 173.824 174.815 -0.991 25342 15942 1 20 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.426 -3.587 25342 15943 1 20 . 1 1 9 9 LEU CB C 9 43.963 43.963 46.122 -2.159 25342 15944 1 20 . 1 1 9 9 LEU H H 9 9.248 9.248 8.488 0.760 25342 15945 1 20 . 1 1 10 10 TYR N N 10 113.330 113.330 114.845 -1.515 25342 15946 1 20 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.203 0.311 25342 15947 1 20 . 1 1 10 10 TYR C C 10 167.898 167.898 173.787 -5.889 25342 15948 1 20 . 1 1 10 10 TYR CA C 10 52.875 52.875 55.300 -2.425 25342 15949 1 20 . 1 1 10 10 TYR CB C 10 38.436 38.436 39.963 -1.527 25342 15950 1 20 . 1 1 10 10 TYR H H 10 7.306 7.306 8.070 -0.764 25342 15951 1 20 . 1 1 11 11 TYR N N 11 121.297 121.297 121.189 0.108 25342 15952 1 20 . 1 1 11 11 TYR HA H 11 4.762 4.762 4.922 -0.160 25342 15953 1 20 . 1 1 11 11 TYR C C 11 169.698 169.698 175.187 -5.489 25342 15954 1 20 . 1 1 11 11 TYR CA C 11 54.047 54.047 57.322 -3.275 25342 15955 1 20 . 1 1 11 11 TYR CB C 11 40.538 40.538 41.590 -1.052 25342 15956 1 20 . 1 1 11 11 TYR H H 11 7.891 7.891 8.225 -0.334 25342 15957 1 20 . 1 1 12 12 SER N N 12 117.763 117.763 113.883 3.880 25342 15958 1 20 . 1 1 12 12 SER HA H 12 4.679 4.679 4.439 0.240 25342 15959 1 20 . 1 1 12 12 SER C C 12 170.075 170.075 172.197 -2.122 25342 15960 1 20 . 1 1 12 12 SER CA C 12 53.619 53.619 56.842 -3.223 25342 15961 1 20 . 1 1 12 12 SER CB C 12 62.847 62.847 65.302 -2.455 25342 15962 1 20 . 1 1 12 12 SER H H 12 7.557 7.557 6.844 0.713 25342 15963 1 20 . 1 1 13 13 TRP N N 13 135.232 135.232 122.387 12.845 25342 15964 1 20 . 1 1 13 13 TRP HA H 13 4.636 4.636 4.693 -0.057 25342 15965 1 20 . 1 1 13 13 TRP C C 13 175.708 175.708 175.326 0.382 25342 15966 1 20 . 1 1 13 13 TRP CA C 13 58.116 58.116 58.199 -0.083 25342 15967 1 20 . 1 1 13 13 TRP CB C 13 27.635 27.635 30.254 -2.619 25342 15968 1 20 . 1 1 13 13 TRP H H 13 9.755 9.755 7.990 1.765 25342 15969 1 20 . 1 1 14 14 SER N N 14 113.789 113.789 116.076 -2.287 25342 15970 1 20 . 1 1 14 14 SER HA H 14 4.223 4.223 4.545 -0.322 25342 15971 1 20 . 1 1 14 14 SER C C 14 172.747 172.747 174.984 -2.237 25342 15972 1 20 . 1 1 14 14 SER CA C 14 53.828 53.828 58.262 -4.434 25342 15973 1 20 . 1 1 14 14 SER CB C 14 60.037 60.037 62.782 -2.745 25342 15974 1 20 . 1 1 14 14 SER H H 14 10.026 10.026 8.573 1.453 25342 15975 1 20 . 1 1 15 15 GLY N N 15 110.489 110.489 110.030 0.459 25342 15976 1 20 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.758 -1.099 25342 15977 1 20 . 1 1 15 15 GLY H H 15 7.391 7.391 8.592 -1.201 25342 15978 1 20 . 1 1 16 16 GLU N N 16 129.005 129.005 119.378 9.627 25342 15979 1 20 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.234 -0.171 25342 15980 1 20 . 1 1 16 16 GLU CA C 16 56.761 56.761 57.950 -1.189 25342 15981 1 20 . 1 1 16 16 GLU CB C 16 26.412 26.412 28.949 -2.537 25342 15982 1 20 . 1 1 16 16 GLU H H 16 11.550 11.550 8.351 3.199 25342 15983 1 20 . 1 1 17 17 THR N N 17 123.016 123.016 113.311 9.705 25342 15984 1 20 . 1 1 17 17 THR HA H 17 4.035 4.035 4.105 -0.070 25342 15985 1 20 . 1 1 17 17 THR C C 17 173.360 173.360 175.600 -2.240 25342 15986 1 20 . 1 1 17 17 THR CA C 17 64.303 64.303 64.580 -0.277 25342 15987 1 20 . 1 1 17 17 THR CB C 17 63.999 63.999 68.260 -4.261 25342 15988 1 20 . 1 1 17 17 THR H H 17 11.293 11.293 8.159 3.134 25342 15989 1 20 . 1 1 18 18 LYS N N 18 120.156 120.156 119.715 0.441 25342 15990 1 20 . 1 1 18 18 LYS HA H 18 2.856 2.856 3.959 -1.103 25342 15991 1 20 . 1 1 18 18 LYS C C 18 173.901 173.901 178.280 -4.379 25342 15992 1 20 . 1 1 18 18 LYS CA C 18 56.834 56.834 58.160 -1.326 25342 15993 1 20 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.206 -2.725 25342 15994 1 20 . 1 1 18 18 LYS H H 18 6.940 6.940 8.132 -1.192 25342 15995 1 20 . 1 1 19 19 LYS N N 19 117.237 117.237 119.556 -2.319 25342 15996 1 20 . 1 1 19 19 LYS HA H 19 3.923 3.923 3.992 -0.069 25342 15997 1 20 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.975 -2.651 25342 15998 1 20 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.329 -2.968 25342 15999 1 20 . 1 1 19 19 LYS H H 19 7.212 7.212 7.794 -0.582 25342 16000 1 20 . 1 1 20 20 MET N N 20 119.268 119.268 114.457 4.811 25342 16001 1 20 . 1 1 20 20 MET HA H 20 4.413 4.413 4.282 0.131 25342 16002 1 20 . 1 1 20 20 MET C C 20 173.625 173.625 175.259 -1.634 25342 16003 1 20 . 1 1 20 20 MET CA C 20 52.261 52.261 54.661 -2.400 25342 16004 1 20 . 1 1 20 20 MET CB C 20 26.680 26.680 31.275 -4.595 25342 16005 1 20 . 1 1 20 20 MET H H 20 7.600 7.600 7.666 -0.066 25342 16006 1 20 . 1 1 21 21 ALA N N 21 123.669 123.669 120.410 3.259 25342 16007 1 20 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.192 -0.710 25342 16008 1 20 . 1 1 21 21 ALA C C 21 176.628 176.628 178.211 -1.583 25342 16009 1 20 . 1 1 21 21 ALA CA C 21 52.374 52.374 52.748 -0.374 25342 16010 1 20 . 1 1 21 21 ALA CB C 21 16.495 16.495 19.491 -2.996 25342 16011 1 20 . 1 1 21 21 ALA H H 21 8.738 8.738 7.742 0.996 25342 16012 1 20 . 1 1 22 22 GLU N N 22 117.242 117.242 119.110 -1.868 25342 16013 1 20 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.062 -0.389 25342 16014 1 20 . 1 1 22 22 GLU C C 22 176.698 176.698 178.853 -2.155 25342 16015 1 20 . 1 1 22 22 GLU CA C 22 56.540 56.540 58.602 -2.062 25342 16016 1 20 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.224 -2.790 25342 16017 1 20 . 1 1 22 22 GLU H H 22 7.959 7.959 7.864 0.095 25342 16018 1 20 . 1 1 23 23 LYS N N 23 123.302 123.302 120.664 2.638 25342 16019 1 20 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.050 -0.229 25342 16020 1 20 . 1 1 23 23 LYS C C 23 177.389 177.389 178.990 -1.601 25342 16021 1 20 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.152 -2.230 25342 16022 1 20 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.122 -2.608 25342 16023 1 20 . 1 1 23 23 LYS H H 23 7.703 7.703 7.443 0.260 25342 16024 1 20 . 1 1 24 24 ILE N N 24 122.208 122.208 118.306 3.902 25342 16025 1 20 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.632 -0.349 25342 16026 1 20 . 1 1 24 24 ILE C C 24 174.934 174.934 177.283 -2.349 25342 16027 1 20 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.257 -0.965 25342 16028 1 20 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.614 -2.877 25342 16029 1 20 . 1 1 24 24 ILE H H 24 8.535 8.535 7.900 0.635 25342 16030 1 20 . 1 1 25 25 ASN N N 25 118.640 118.640 118.081 0.559 25342 16031 1 20 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.279 -0.052 25342 16032 1 20 . 1 1 25 25 ASN C C 25 173.530 173.530 177.288 -3.758 25342 16033 1 20 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.861 -4.650 25342 16034 1 20 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.544 -0.440 25342 16035 1 20 . 1 1 25 25 ASN H H 25 8.317 8.317 8.522 -0.205 25342 16036 1 20 . 1 1 26 26 SER N N 26 111.990 111.990 114.616 -2.626 25342 16037 1 20 . 1 1 26 26 SER HA H 26 4.153 4.153 4.258 -0.105 25342 16038 1 20 . 1 1 26 26 SER C C 26 172.110 172.110 175.446 -3.336 25342 16039 1 20 . 1 1 26 26 SER CA C 26 57.905 57.905 61.202 -3.297 25342 16040 1 20 . 1 1 26 26 SER CB C 26 60.655 60.655 63.021 -2.366 25342 16041 1 20 . 1 1 26 26 SER H H 26 7.369 7.369 7.799 -0.430 25342 16042 1 20 . 1 1 27 27 GLU N N 27 120.201 120.201 118.276 1.925 25342 16043 1 20 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.296 -0.195 25342 16044 1 20 . 1 1 27 27 GLU C C 27 173.673 173.673 176.657 -2.984 25342 16045 1 20 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.421 -2.186 25342 16046 1 20 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.465 -3.864 25342 16047 1 20 . 1 1 27 27 GLU H H 27 7.451 7.451 7.479 -0.028 25342 16048 1 20 . 1 1 28 28 ILE N N 28 118.762 118.762 120.363 -1.601 25342 16049 1 20 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.219 -0.020 25342 16050 1 20 . 1 1 28 28 ILE C C 28 172.487 172.487 174.723 -2.236 25342 16051 1 20 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.458 -2.726 25342 16052 1 20 . 1 1 28 28 ILE CB C 28 35.738 35.738 39.920 -4.182 25342 16053 1 20 . 1 1 28 28 ILE H H 28 7.255 7.255 7.465 -0.210 25342 16054 1 20 . 1 1 29 29 LYS N N 29 130.563 130.563 126.648 3.915 25342 16055 1 20 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.281 -0.279 25342 16056 1 20 . 1 1 29 29 LYS C C 29 174.386 174.386 176.665 -2.279 25342 16057 1 20 . 1 1 29 29 LYS CA C 29 55.535 55.535 57.227 -1.692 25342 16058 1 20 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.439 -3.853 25342 16059 1 20 . 1 1 29 29 LYS H H 29 8.564 8.564 8.515 0.049 25342 16060 1 20 . 1 1 30 30 ASP N N 30 119.357 119.357 118.871 0.486 25342 16061 1 20 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.411 -0.009 25342 16062 1 20 . 1 1 30 30 ASP C C 30 172.570 172.570 175.918 -3.348 25342 16063 1 20 . 1 1 30 30 ASP CA C 30 53.436 53.436 55.162 -1.726 25342 16064 1 20 . 1 1 30 30 ASP CB C 30 36.744 36.744 40.700 -3.956 25342 16065 1 20 . 1 1 30 30 ASP H H 30 8.920 8.920 8.770 0.150 25342 16066 1 20 . 1 1 31 31 SER N N 31 114.019 114.019 113.221 0.798 25342 16067 1 20 . 1 1 31 31 SER HA H 31 4.782 4.782 4.742 0.040 25342 16068 1 20 . 1 1 31 31 SER C C 31 171.150 171.150 174.801 -3.651 25342 16069 1 20 . 1 1 31 31 SER CA C 31 55.551 55.551 58.773 -3.222 25342 16070 1 20 . 1 1 31 31 SER CB C 31 62.259 62.259 64.236 -1.977 25342 16071 1 20 . 1 1 31 31 SER H H 31 8.006 8.006 7.714 0.292 25342 16072 1 20 . 1 1 32 32 GLU N N 32 121.455 121.455 121.681 -0.226 25342 16073 1 20 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.532 0.208 25342 16074 1 20 . 1 1 32 32 GLU C C 32 171.185 171.185 175.259 -4.074 25342 16075 1 20 . 1 1 32 32 GLU CA C 32 52.081 52.081 54.976 -2.895 25342 16076 1 20 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.941 -2.114 25342 16077 1 20 . 1 1 32 32 GLU H H 32 8.145 8.145 8.276 -0.131 25342 16078 1 20 . 1 1 33 33 LEU N N 33 126.176 126.176 121.243 4.933 25342 16079 1 20 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.527 0.779 25342 16080 1 20 . 1 1 33 33 LEU C C 33 173.365 173.365 175.257 -1.892 25342 16081 1 20 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.426 -2.986 25342 16082 1 20 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.706 -0.071 25342 16083 1 20 . 1 1 33 33 LEU H H 33 8.589 8.589 8.540 0.049 25342 16084 1 20 . 1 1 34 34 LYS N N 34 127.200 127.200 124.732 2.468 25342 16085 1 20 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.885 -0.289 25342 16086 1 20 . 1 1 34 34 LYS C C 34 169.622 169.622 174.769 -5.147 25342 16087 1 20 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.096 -1.767 25342 16088 1 20 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.918 -2.718 25342 16089 1 20 . 1 1 34 34 LYS H H 34 9.380 9.380 8.764 0.616 25342 16090 1 20 . 1 1 35 35 GLU N N 35 122.324 122.324 118.993 3.331 25342 16091 1 20 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.295 -1.962 25342 16092 1 20 . 1 1 35 35 GLU C C 35 172.734 172.734 174.788 -2.054 25342 16093 1 20 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.816 -2.204 25342 16094 1 20 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.810 -3.491 25342 16095 1 20 . 1 1 35 35 GLU H H 35 8.094 8.094 8.429 -0.335 25342 16096 1 20 . 1 1 36 36 VAL N N 36 126.781 126.781 118.201 8.580 25342 16097 1 20 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.525 -0.686 25342 16098 1 20 . 1 1 36 36 VAL C C 36 171.482 171.482 174.980 -3.498 25342 16099 1 20 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.794 -1.389 25342 16100 1 20 . 1 1 36 36 VAL CB C 36 29.348 29.348 34.391 -5.043 25342 16101 1 20 . 1 1 36 36 VAL H H 36 8.660 8.660 8.123 0.537 25342 16102 1 20 . 1 1 37 37 LYS N N 37 126.065 126.065 120.076 5.989 25342 16103 1 20 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.768 0.197 25342 16104 1 20 . 1 1 37 37 LYS C C 37 173.187 173.187 175.284 -2.097 25342 16105 1 20 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.879 -2.599 25342 16106 1 20 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.952 -3.030 25342 16107 1 20 . 1 1 37 37 LYS H H 37 7.809 7.809 8.327 -0.518 25342 16108 1 20 . 1 1 38 38 VAL N N 38 111.020 111.020 117.539 -6.519 25342 16109 1 20 . 1 1 38 38 VAL HA H 38 4.824 4.824 5.088 -0.264 25342 16110 1 20 . 1 1 38 38 VAL C C 38 173.604 173.604 175.880 -2.276 25342 16111 1 20 . 1 1 38 38 VAL CA C 38 56.383 56.383 58.623 -2.240 25342 16112 1 20 . 1 1 38 38 VAL CB C 38 32.376 32.376 32.980 -0.604 25342 16113 1 20 . 1 1 38 38 VAL H H 38 8.305 8.305 8.389 -0.084 25342 16114 1 20 . 1 1 39 39 SER N N 39 117.887 117.887 115.135 2.752 25342 16115 1 20 . 1 1 39 39 SER HA H 39 4.183 4.183 4.378 -0.195 25342 16116 1 20 . 1 1 39 39 SER C C 39 173.538 173.538 173.815 -0.277 25342 16117 1 20 . 1 1 39 39 SER CA C 39 56.279 56.279 58.616 -2.337 25342 16118 1 20 . 1 1 39 39 SER CB C 39 60.537 60.537 63.869 -3.332 25342 16119 1 20 . 1 1 39 39 SER H H 39 8.847 8.847 8.249 0.598 25342 16120 1 20 . 1 1 40 40 GLU N N 40 126.316 126.316 120.490 5.826 25342 16121 1 20 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.167 -0.013 25342 16122 1 20 . 1 1 40 40 GLU C C 40 174.586 174.586 177.138 -2.552 25342 16123 1 20 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.943 -1.131 25342 16124 1 20 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.742 -3.022 25342 16125 1 20 . 1 1 40 40 GLU H H 40 9.049 9.049 8.450 0.599 25342 16126 1 20 . 1 1 41 41 GLY N N 41 112.494 112.494 113.414 -0.920 25342 16127 1 20 . 1 1 41 41 GLY C C 41 171.994 171.994 175.242 -3.248 25342 16128 1 20 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.159 -2.697 25342 16129 1 20 . 1 1 41 41 GLY H H 41 8.780 8.780 8.774 0.006 25342 16130 1 20 . 1 1 42 42 THR N N 42 118.631 118.631 116.104 2.527 25342 16131 1 20 . 1 1 42 42 THR HA H 42 3.582 3.582 4.040 -0.458 25342 16132 1 20 . 1 1 42 42 THR C C 42 171.225 171.225 173.278 -2.053 25342 16133 1 20 . 1 1 42 42 THR CA C 42 64.104 64.104 64.065 0.039 25342 16134 1 20 . 1 1 42 42 THR CB C 42 65.914 65.914 69.193 -3.279 25342 16135 1 20 . 1 1 42 42 THR H H 42 7.737 7.737 7.936 -0.199 25342 16136 1 20 . 1 1 43 43 PHE N N 43 116.279 116.279 110.979 5.300 25342 16137 1 20 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.554 0.466 25342 16138 1 20 . 1 1 43 43 PHE C C 43 170.141 170.141 173.045 -2.904 25342 16139 1 20 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.876 -4.404 25342 16140 1 20 . 1 1 43 43 PHE CB C 43 37.385 37.385 40.210 -2.825 25342 16141 1 20 . 1 1 43 43 PHE H H 43 8.114 8.114 6.973 1.141 25342 16142 1 20 . 1 1 44 44 ASP N N 44 121.513 121.513 120.545 0.968 25342 16143 1 20 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.771 0.080 25342 16144 1 20 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.377 -3.164 25342 16145 1 20 . 1 1 44 44 ASP CB C 44 44.385 44.385 41.417 2.968 25342 16146 1 20 . 1 1 44 44 ASP H H 44 7.774 7.774 8.850 -1.076 25342 16147 1 20 . 1 1 45 45 ALA N N 45 125.663 125.663 121.340 4.323 25342 16148 1 20 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.302 -0.091 25342 16149 1 20 . 1 1 45 45 ALA C C 45 175.139 175.139 176.970 -1.831 25342 16150 1 20 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.891 -1.455 25342 16151 1 20 . 1 1 45 45 ALA CB C 45 16.232 16.232 17.262 -1.030 25342 16152 1 20 . 1 1 45 45 ALA H H 45 8.324 8.324 8.304 0.020 25342 16153 1 20 . 1 1 46 46 ASP N N 46 119.288 119.288 117.557 1.731 25342 16154 1 20 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.604 0.221 25342 16155 1 20 . 1 1 46 46 ASP C C 46 175.013 175.013 176.801 -1.788 25342 16156 1 20 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.953 -2.792 25342 16157 1 20 . 1 1 46 46 ASP CB C 46 41.233 41.233 41.649 -0.416 25342 16158 1 20 . 1 1 46 46 ASP H H 46 9.618 9.618 8.111 1.507 25342 16159 1 20 . 1 1 47 47 MET N N 47 127.347 127.347 116.695 10.652 25342 16160 1 20 . 1 1 47 47 MET HA H 47 3.456 3.456 4.689 -1.233 25342 16161 1 20 . 1 1 47 47 MET C C 47 173.605 173.605 176.965 -3.360 25342 16162 1 20 . 1 1 47 47 MET CA C 47 56.699 56.699 56.643 0.056 25342 16163 1 20 . 1 1 47 47 MET CB C 47 29.930 29.930 34.906 -4.976 25342 16164 1 20 . 1 1 47 47 MET H H 47 9.178 9.178 8.058 1.120 25342 16165 1 20 . 1 1 48 48 TYR N N 48 121.040 121.040 116.999 4.041 25342 16166 1 20 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.741 -0.869 25342 16167 1 20 . 1 1 48 48 TYR CA C 48 58.712 58.712 59.044 -0.332 25342 16168 1 20 . 1 1 48 48 TYR CB C 48 33.638 33.638 38.081 -4.443 25342 16169 1 20 . 1 1 48 48 TYR H H 48 7.881 7.881 8.245 -0.363 25342 16170 1 20 . 1 1 49 49 LYS N N 49 121.754 121.754 121.450 0.304 25342 16171 1 20 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.042 0.063 25342 16172 1 20 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.653 -3.268 25342 16173 1 20 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.208 -3.044 25342 16174 1 20 . 1 1 49 49 LYS H H 49 8.365 8.365 8.449 -0.084 25342 16175 1 20 . 1 1 50 50 THR N N 50 117.557 117.557 107.377 10.180 25342 16176 1 20 . 1 1 50 50 THR HA H 50 3.586 3.586 4.176 -0.590 25342 16177 1 20 . 1 1 50 50 THR CA C 50 65.634 65.634 63.817 1.817 25342 16178 1 20 . 1 1 50 50 THR CB C 50 65.904 65.904 67.519 -1.615 25342 16179 1 20 . 1 1 50 50 THR H H 50 8.007 8.007 8.324 -0.317 25342 16180 1 20 . 1 1 51 51 SER N N 51 115.110 115.110 117.048 -1.938 25342 16181 1 20 . 1 1 51 51 SER HA H 51 3.974 3.974 4.439 -0.466 25342 16182 1 20 . 1 1 51 51 SER CA C 51 59.042 59.042 61.213 -2.171 25342 16183 1 20 . 1 1 51 51 SER CB C 51 59.835 59.835 63.494 -3.659 25342 16184 1 20 . 1 1 51 51 SER H H 51 7.606 7.606 7.811 -0.205 25342 16185 1 20 . 1 1 52 52 ASP N N 52 119.713 119.713 121.066 -1.353 25342 16186 1 20 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.663 -0.355 25342 16187 1 20 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.846 -2.320 25342 16188 1 20 . 1 1 52 52 ASP CB C 52 37.688 37.688 42.065 -4.377 25342 16189 1 20 . 1 1 52 52 ASP H H 52 7.552 7.552 7.622 -0.070 25342 16190 1 20 . 1 1 53 53 ILE N N 53 121.982 121.982 119.688 2.294 25342 16191 1 20 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.599 0.123 25342 16192 1 20 . 1 1 53 53 ILE C C 53 175.325 175.325 177.599 -2.274 25342 16193 1 20 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.949 -3.405 25342 16194 1 20 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.900 -1.201 25342 16195 1 20 . 1 1 53 53 ILE H H 53 7.815 7.815 7.640 0.175 25342 16196 1 20 . 1 1 54 54 ALA N N 54 121.552 121.552 120.779 0.773 25342 16197 1 20 . 1 1 54 54 ALA HA H 54 4.317 4.317 3.919 0.398 25342 16198 1 20 . 1 1 54 54 ALA C C 54 177.475 177.475 179.374 -1.899 25342 16199 1 20 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.700 -2.678 25342 16200 1 20 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.142 -2.158 25342 16201 1 20 . 1 1 54 54 ALA H H 54 8.332 8.332 8.089 0.243 25342 16202 1 20 . 1 1 55 55 LEU N N 55 117.176 117.176 119.395 -2.219 25342 16203 1 20 . 1 1 55 55 LEU HA H 55 3.934 3.934 3.888 0.046 25342 16204 1 20 . 1 1 55 55 LEU C C 55 176.532 176.532 178.379 -1.847 25342 16205 1 20 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.136 -1.805 25342 16206 1 20 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.655 -3.227 25342 16207 1 20 . 1 1 55 55 LEU H H 55 8.195 8.195 7.211 0.984 25342 16208 1 20 . 1 1 56 56 ASP N N 56 120.056 120.056 119.838 0.218 25342 16209 1 20 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.203 0.264 25342 16210 1 20 . 1 1 56 56 ASP C C 56 176.585 176.585 178.704 -2.119 25342 16211 1 20 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.756 -3.206 25342 16212 1 20 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.224 -1.919 25342 16213 1 20 . 1 1 56 56 ASP H H 56 7.806 7.806 8.483 -0.677 25342 16214 1 20 . 1 1 57 57 GLN N N 57 120.020 120.020 118.379 1.641 25342 16215 1 20 . 1 1 57 57 GLN HA H 57 4.123 4.123 3.878 0.245 25342 16216 1 20 . 1 1 57 57 GLN C C 57 175.689 175.689 178.506 -2.817 25342 16217 1 20 . 1 1 57 57 GLN CA C 57 54.405 54.405 58.118 -3.713 25342 16218 1 20 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.688 -4.919 25342 16219 1 20 . 1 1 57 57 GLN H H 57 7.661 7.661 7.344 0.317 25342 16220 1 20 . 1 1 58 58 ILE N N 58 120.644 120.644 119.850 0.794 25342 16221 1 20 . 1 1 58 58 ILE HA H 58 3.576 3.576 3.663 -0.087 25342 16222 1 20 . 1 1 58 58 ILE C C 58 176.237 176.237 177.984 -1.747 25342 16223 1 20 . 1 1 58 58 ILE CA C 58 62.506 62.506 63.963 -1.457 25342 16224 1 20 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.028 -1.999 25342 16225 1 20 . 1 1 58 58 ILE H H 58 8.228 8.228 7.430 0.798 25342 16226 1 20 . 1 1 59 59 GLN N N 59 115.498 115.498 116.968 -1.470 25342 16227 1 20 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.153 -0.011 25342 16228 1 20 . 1 1 59 59 GLN C C 59 173.781 173.781 177.032 -3.251 25342 16229 1 20 . 1 1 59 59 GLN CA C 59 53.982 53.982 56.869 -2.887 25342 16230 1 20 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.504 -2.893 25342 16231 1 20 . 1 1 59 59 GLN H H 59 8.331 8.331 8.279 0.052 25342 16232 1 20 . 1 1 60 60 GLY N N 60 106.623 106.623 106.093 0.530 25342 16233 1 20 . 1 1 60 60 GLY C C 60 172.068 172.068 174.990 -2.922 25342 16234 1 20 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.132 -2.259 25342 16235 1 20 . 1 1 60 60 GLY H H 60 7.611 7.611 7.906 -0.295 25342 16236 1 20 . 1 1 61 61 ASN N N 61 117.691 117.691 117.508 0.183 25342 16237 1 20 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.588 -0.044 25342 16238 1 20 . 1 1 61 61 ASN C C 61 171.946 171.946 175.436 -3.490 25342 16239 1 20 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.015 -2.446 25342 16240 1 20 . 1 1 61 61 ASN CB C 61 36.360 36.360 38.938 -2.578 25342 16241 1 20 . 1 1 61 61 ASN H H 61 8.151 8.151 8.579 -0.428 25342 16242 1 20 . 1 1 62 62 LYS N N 62 118.289 118.289 118.946 -0.657 25342 16243 1 20 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.532 -0.203 25342 16244 1 20 . 1 1 62 62 LYS C C 62 171.773 171.773 174.202 -2.429 25342 16245 1 20 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.216 -2.920 25342 16246 1 20 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.722 -1.039 25342 16247 1 20 . 1 1 62 62 LYS H H 62 7.242 7.242 7.461 -0.219 25342 16248 1 20 . 1 1 63 63 ASP N N 63 119.888 119.888 119.607 0.281 25342 16249 1 20 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.355 0.061 25342 16250 1 20 . 1 1 63 63 ASP C C 63 174.476 174.476 175.640 -1.164 25342 16251 1 20 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.016 -1.555 25342 16252 1 20 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.095 -2.580 25342 16253 1 20 . 1 1 63 63 ASP H H 63 8.230 8.230 8.269 -0.039 25342 16254 1 20 . 1 1 64 64 PHE N N 64 119.789 119.789 118.116 1.673 25342 16255 1 20 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.423 -0.607 25342 16256 1 20 . 1 1 64 64 PHE CA C 64 56.250 56.250 56.297 -0.047 25342 16257 1 20 . 1 1 64 64 PHE CB C 64 35.034 35.034 39.213 -4.179 25342 16258 1 20 . 1 1 64 64 PHE H H 64 8.428 8.428 8.150 0.278 25342 16259 1 20 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.581 -0.268 25342 16260 1 20 . 1 1 65 65 PRO C C 65 173.975 173.975 176.010 -2.035 25342 16261 1 20 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.561 -2.505 25342 16262 1 20 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.271 -2.751 25342 16263 1 20 . 1 1 66 66 GLU N N 66 121.326 121.326 123.243 -1.917 25342 16264 1 20 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.283 -0.050 25342 16265 1 20 . 1 1 66 66 GLU C C 66 173.978 173.978 175.544 -1.566 25342 16266 1 20 . 1 1 66 66 GLU CA C 66 53.531 53.531 56.476 -2.945 25342 16267 1 20 . 1 1 66 66 GLU CB C 66 27.700 27.700 30.532 -2.832 25342 16268 1 20 . 1 1 66 66 GLU H H 66 8.225 8.225 8.633 -0.408 25342 16269 1 20 . 1 1 67 67 ILE N N 67 113.897 113.897 117.633 -3.736 25342 16270 1 20 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.902 0.267 25342 16271 1 20 . 1 1 67 67 ILE C C 67 172.791 172.791 175.934 -3.143 25342 16272 1 20 . 1 1 67 67 ILE CA C 67 56.275 56.275 58.932 -2.657 25342 16273 1 20 . 1 1 67 67 ILE CB C 67 39.016 39.016 40.632 -1.616 25342 16274 1 20 . 1 1 67 67 ILE H H 67 8.366 8.366 8.266 0.100 25342 16275 1 20 . 1 1 68 68 GLN N N 68 121.654 121.654 121.095 0.559 25342 16276 1 20 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.406 0.113 25342 16277 1 20 . 1 1 68 68 GLN C C 68 171.562 171.562 175.610 -4.048 25342 16278 1 20 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.854 -2.541 25342 16279 1 20 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.682 -1.897 25342 16280 1 20 . 1 1 68 68 GLN H H 68 8.763 8.763 8.503 0.260 25342 16281 1 20 . 1 1 69 69 LEU N N 69 125.289 125.289 122.082 3.207 25342 16282 1 20 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.325 0.194 25342 16283 1 20 . 1 1 69 69 LEU C C 69 172.567 172.567 176.807 -4.240 25342 16284 1 20 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.945 -3.148 25342 16285 1 20 . 1 1 69 69 LEU CB C 69 42.742 42.742 42.754 -0.012 25342 16286 1 20 . 1 1 69 69 LEU H H 69 7.996 7.996 7.751 0.245 25342 16287 1 20 . 1 1 70 70 ASP N N 70 123.170 123.170 120.938 2.232 25342 16288 1 20 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.665 -0.259 25342 16289 1 20 . 1 1 70 70 ASP C C 70 171.978 171.978 175.304 -3.326 25342 16290 1 20 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.766 -2.084 25342 16291 1 20 . 1 1 70 70 ASP CB C 70 38.729 38.729 41.783 -3.054 25342 16292 1 20 . 1 1 70 70 ASP H H 70 8.278 8.278 8.217 0.061 25342 16293 1 20 . 1 1 71 71 ASN N N 71 117.524 117.524 118.202 -0.678 25342 16294 1 20 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.626 -0.299 25342 16295 1 20 . 1 1 71 71 ASN C C 71 171.825 171.825 174.854 -3.029 25342 16296 1 20 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.670 -2.013 25342 16297 1 20 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.639 -3.409 25342 16298 1 20 . 1 1 71 71 ASN H H 71 8.372 8.372 8.527 -0.155 25342 16299 1 20 . 1 1 72 72 ILE N N 72 124.515 124.515 124.894 -0.379 25342 16300 1 20 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.109 -0.180 25342 16301 1 20 . 1 1 72 72 ILE C C 72 171.607 171.607 174.608 -3.001 25342 16302 1 20 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.730 -2.441 25342 16303 1 20 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.367 -2.607 25342 16304 1 20 . 1 1 72 72 ILE H H 72 7.653 7.653 8.105 -0.452 25342 16305 1 20 . 1 1 73 73 ASP N N 73 125.182 125.182 122.918 2.264 25342 16306 1 20 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.633 -0.005 25342 16307 1 20 . 1 1 73 73 ASP C C 73 173.980 173.980 175.155 -1.175 25342 16308 1 20 . 1 1 73 73 ASP CA C 73 49.214 49.214 53.303 -4.089 25342 16309 1 20 . 1 1 73 73 ASP CB C 73 36.902 36.902 41.566 -4.664 25342 16310 1 20 . 1 1 73 73 ASP H H 73 8.382 8.382 8.348 0.034 25342 16311 1 20 . 1 1 74 74 TYR N N 74 123.092 123.092 122.955 0.137 25342 16312 1 20 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.745 -0.880 25342 16313 1 20 . 1 1 74 74 TYR C C 74 173.582 173.582 176.997 -3.415 25342 16314 1 20 . 1 1 74 74 TYR CA C 74 59.486 59.486 57.750 1.736 25342 16315 1 20 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.396 -3.588 25342 16316 1 20 . 1 1 74 74 TYR H H 74 7.348 7.348 8.593 -1.245 25342 16317 1 20 . 1 1 75 75 ASN N N 75 109.447 109.447 119.143 -9.696 25342 16318 1 20 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.659 0.266 25342 16319 1 20 . 1 1 75 75 ASN C C 75 172.570 172.570 175.247 -2.677 25342 16320 1 20 . 1 1 75 75 ASN CA C 75 52.618 52.618 55.913 -3.295 25342 16321 1 20 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.911 -3.377 25342 16322 1 20 . 1 1 75 75 ASN H H 75 8.040 8.040 8.205 -0.165 25342 16323 1 20 . 1 1 76 76 ASN N N 76 117.411 117.411 114.458 2.953 25342 16324 1 20 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.586 -0.132 25342 16325 1 20 . 1 1 76 76 ASN C C 76 171.155 171.155 175.443 -4.288 25342 16326 1 20 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.595 -2.661 25342 16327 1 20 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.336 -2.678 25342 16328 1 20 . 1 1 76 76 ASN H H 76 7.750 7.750 8.166 -0.416 25342 16329 1 20 . 1 1 77 77 TYR N N 77 116.878 116.878 119.823 -2.945 25342 16330 1 20 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.465 -0.111 25342 16331 1 20 . 1 1 77 77 TYR C C 77 172.224 172.224 175.786 -3.562 25342 16332 1 20 . 1 1 77 77 TYR CA C 77 55.240 55.240 59.489 -4.249 25342 16333 1 20 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.144 -2.031 25342 16334 1 20 . 1 1 77 77 TYR H H 77 7.789 7.789 7.801 -0.012 25342 16335 1 20 . 1 1 78 78 ASP N N 78 121.352 121.352 122.362 -1.010 25342 16336 1 20 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.575 0.222 25342 16337 1 20 . 1 1 78 78 ASP C C 78 172.623 172.623 176.188 -3.565 25342 16338 1 20 . 1 1 78 78 ASP CA C 78 53.190 53.190 57.260 -4.070 25342 16339 1 20 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.234 -1.199 25342 16340 1 20 . 1 1 78 78 ASP H H 78 9.036 9.036 8.619 0.417 25342 16341 1 20 . 1 1 79 79 LEU N N 79 123.073 123.073 118.804 4.269 25342 16342 1 20 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.343 -0.235 25342 16343 1 20 . 1 1 79 79 LEU C C 79 170.730 170.730 174.608 -3.878 25342 16344 1 20 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.160 -2.902 25342 16345 1 20 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.131 -3.847 25342 16346 1 20 . 1 1 79 79 LEU H H 79 7.877 7.877 8.139 -0.262 25342 16347 1 20 . 1 1 80 80 ILE N N 80 126.348 126.348 124.275 2.073 25342 16348 1 20 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.619 0.450 25342 16349 1 20 . 1 1 80 80 ILE C C 80 171.584 171.584 174.492 -2.908 25342 16350 1 20 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.254 -2.839 25342 16351 1 20 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.108 -2.110 25342 16352 1 20 . 1 1 80 80 ILE H H 80 8.704 8.704 8.650 0.054 25342 16353 1 20 . 1 1 81 81 LEU N N 81 126.303 126.303 128.556 -2.253 25342 16354 1 20 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.525 0.598 25342 16355 1 20 . 1 1 81 81 LEU C C 81 172.779 172.779 175.552 -2.773 25342 16356 1 20 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.941 -5.433 25342 16357 1 20 . 1 1 81 81 LEU CB C 81 41.715 41.715 43.232 -1.517 25342 16358 1 20 . 1 1 81 81 LEU H H 81 9.202 9.202 8.045 1.157 25342 16359 1 20 . 1 1 82 82 ILE N N 82 120.931 120.931 121.646 -0.715 25342 16360 1 20 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.965 -0.118 25342 16361 1 20 . 1 1 82 82 ILE C C 82 172.796 172.796 175.512 -2.716 25342 16362 1 20 . 1 1 82 82 ILE CA C 82 56.881 56.881 60.059 -3.178 25342 16363 1 20 . 1 1 82 82 ILE CB C 82 37.797 37.797 40.729 -2.932 25342 16364 1 20 . 1 1 82 82 ILE H H 82 8.846 8.846 8.842 0.004 25342 16365 1 20 . 1 1 83 83 GLY N N 83 120.905 120.905 114.339 6.566 25342 16366 1 20 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.522 -2.965 25342 16367 1 20 . 1 1 83 83 GLY H H 83 9.558 9.558 9.093 0.465 25342 16368 1 20 . 1 1 84 84 SER N N 84 116.601 116.601 113.505 3.096 25342 16369 1 20 . 1 1 84 84 SER HA H 84 5.476 5.476 5.034 0.442 25342 16370 1 20 . 1 1 84 84 SER CA C 84 51.324 51.324 56.298 -4.974 25342 16371 1 20 . 1 1 84 84 SER CB C 84 64.271 64.271 64.515 -0.244 25342 16372 1 20 . 1 1 84 84 SER H H 84 7.533 7.533 7.723 -0.190 25342 16373 1 20 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.327 0.836 25342 16374 1 20 . 1 1 85 85 PRO C C 85 175.590 175.590 175.942 -0.352 25342 16375 1 20 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.524 -3.641 25342 16376 1 20 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.255 -1.781 25342 16377 1 20 . 1 1 86 86 VAL N N 86 116.295 116.295 119.573 -3.278 25342 16378 1 20 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.345 -0.524 25342 16379 1 20 . 1 1 86 86 VAL C C 86 172.692 172.692 175.358 -2.666 25342 16380 1 20 . 1 1 86 86 VAL CA C 86 59.812 59.812 62.020 -2.208 25342 16381 1 20 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.325 -2.242 25342 16382 1 20 . 1 1 86 86 VAL H H 86 7.246 7.246 8.087 -0.841 25342 16383 1 20 . 1 1 87 87 TRP N N 87 131.042 131.042 127.127 3.915 25342 16384 1 20 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.627 -0.316 25342 16385 1 20 . 1 1 87 87 TRP C C 87 173.323 173.323 176.282 -2.959 25342 16386 1 20 . 1 1 87 87 TRP CA C 87 50.887 50.887 56.562 -5.675 25342 16387 1 20 . 1 1 87 87 TRP CB C 87 27.310 27.310 32.853 -5.543 25342 16388 1 20 . 1 1 87 87 TRP H H 87 9.555 9.555 7.947 1.608 25342 16389 1 20 . 1 1 88 88 SER N N 88 122.660 122.660 115.888 6.772 25342 16390 1 20 . 1 1 88 88 SER HA H 88 4.582 4.582 4.274 0.308 25342 16391 1 20 . 1 1 88 88 SER C C 88 172.096 172.096 175.424 -3.328 25342 16392 1 20 . 1 1 88 88 SER CA C 88 55.391 55.391 59.661 -4.271 25342 16393 1 20 . 1 1 88 88 SER CB C 88 57.813 57.813 62.078 -4.265 25342 16394 1 20 . 1 1 88 88 SER H H 88 10.257 10.257 9.028 1.229 25342 16395 1 20 . 1 1 89 89 GLY N N 89 128.381 128.381 112.867 15.514 25342 16396 1 20 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.370 -2.741 25342 16397 1 20 . 1 1 89 89 GLY H H 89 6.372 6.372 8.636 -2.264 25342 16398 1 20 . 1 1 90 90 TYR N N 90 120.345 120.345 116.643 3.702 25342 16399 1 20 . 1 1 90 90 TYR HA H 90 4.189 4.189 5.189 -1.000 25342 16400 1 20 . 1 1 90 90 TYR CA C 90 53.549 53.549 52.931 0.618 25342 16401 1 20 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.463 -1.268 25342 16402 1 20 . 1 1 90 90 TYR H H 90 8.113 8.113 7.355 0.758 25342 16403 1 20 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.770 0.064 25342 16404 1 20 . 1 1 91 91 PRO C C 91 170.911 170.911 177.357 -6.446 25342 16405 1 20 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.614 -3.779 25342 16406 1 20 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.881 -6.811 25342 16407 1 20 . 1 1 92 92 ALA N N 92 120.629 120.629 122.829 -2.200 25342 16408 1 20 . 1 1 92 92 ALA HA H 92 3.619 3.619 4.019 -0.400 25342 16409 1 20 . 1 1 92 92 ALA C C 92 176.782 176.782 176.853 -0.071 25342 16410 1 20 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.670 -2.253 25342 16411 1 20 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.357 -1.841 25342 16412 1 20 . 1 1 92 92 ALA H H 92 7.554 7.554 8.762 -1.208 25342 16413 1 20 . 1 1 93 93 THR N N 93 112.558 112.558 110.268 2.290 25342 16414 1 20 . 1 1 93 93 THR CB C 93 64.173 64.173 67.001 -2.828 25342 16415 1 20 . 1 1 93 93 THR H H 93 6.730 6.730 7.739 -1.009 25342 16416 1 20 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.311 -0.452 25342 16417 1 20 . 1 1 94 94 PRO C C 94 173.309 173.309 178.428 -5.119 25342 16418 1 20 . 1 1 94 94 PRO CA C 94 63.063 63.063 65.127 -2.064 25342 16419 1 20 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.040 -2.761 25342 16420 1 20 . 1 1 95 95 ILE N N 95 111.014 111.014 115.548 -4.534 25342 16421 1 20 . 1 1 95 95 ILE HA H 95 3.605 3.605 3.882 -0.277 25342 16422 1 20 . 1 1 95 95 ILE C C 95 174.302 174.302 177.846 -3.544 25342 16423 1 20 . 1 1 95 95 ILE CA C 95 57.181 57.181 61.172 -3.991 25342 16424 1 20 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.727 -4.944 25342 16425 1 20 . 1 1 95 95 ILE H H 95 7.995 7.995 8.483 -0.488 25342 16426 1 20 . 1 1 96 96 LYS N N 96 123.208 123.208 122.004 1.204 25342 16427 1 20 . 1 1 96 96 LYS HA H 96 3.092 3.092 3.836 -0.744 25342 16428 1 20 . 1 1 96 96 LYS C C 96 174.451 174.451 178.587 -4.136 25342 16429 1 20 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.110 -2.069 25342 16430 1 20 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.276 -2.530 25342 16431 1 20 . 1 1 96 96 LYS H H 96 6.928 6.928 8.306 -1.378 25342 16432 1 20 . 1 1 97 97 THR N N 97 113.320 113.320 114.647 -1.327 25342 16433 1 20 . 1 1 97 97 THR HA H 97 3.436 3.436 3.957 -0.521 25342 16434 1 20 . 1 1 97 97 THR C C 97 173.221 173.221 177.022 -3.801 25342 16435 1 20 . 1 1 97 97 THR CA C 97 62.710 62.710 65.726 -3.016 25342 16436 1 20 . 1 1 97 97 THR CB C 97 65.562 65.562 68.496 -2.934 25342 16437 1 20 . 1 1 97 97 THR H H 97 6.325 6.325 7.421 -1.096 25342 16438 1 20 . 1 1 98 98 LEU N N 98 120.963 120.963 123.455 -2.492 25342 16439 1 20 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.020 -0.395 25342 16440 1 20 . 1 1 98 98 LEU C C 98 174.713 174.713 177.839 -3.126 25342 16441 1 20 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.625 -2.111 25342 16442 1 20 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.531 -1.803 25342 16443 1 20 . 1 1 98 98 LEU H H 98 7.536 7.536 7.778 -0.242 25342 16444 1 20 . 1 1 99 99 LEU N N 99 118.859 118.859 118.006 0.853 25342 16445 1 20 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.804 -0.132 25342 16446 1 20 . 1 1 99 99 LEU C C 99 177.458 177.458 178.534 -1.076 25342 16447 1 20 . 1 1 99 99 LEU CA C 99 55.145 55.145 57.934 -2.788 25342 16448 1 20 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.353 -2.497 25342 16449 1 20 . 1 1 99 99 LEU H H 99 8.179 8.179 8.096 0.083 25342 16450 1 20 . 1 1 100 100 ASP N N 100 118.703 118.703 116.888 1.815 25342 16451 1 20 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.371 -0.150 25342 16452 1 20 . 1 1 100 100 ASP C C 100 176.472 176.472 177.582 -1.110 25342 16453 1 20 . 1 1 100 100 ASP CA C 100 54.307 54.307 56.595 -2.288 25342 16454 1 20 . 1 1 100 100 ASP CB C 100 37.358 37.358 41.038 -3.680 25342 16455 1 20 . 1 1 100 100 ASP H H 100 7.867 7.867 7.702 0.165 25342 16456 1 20 . 1 1 101 101 GLN N N 101 117.829 117.829 117.300 0.529 25342 16457 1 20 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.282 -0.082 25342 16458 1 20 . 1 1 101 101 GLN C C 101 174.508 174.508 178.544 -4.036 25342 16459 1 20 . 1 1 101 101 GLN CA C 101 54.688 54.688 58.040 -3.352 25342 16460 1 20 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.579 -3.982 25342 16461 1 20 . 1 1 101 101 GLN H H 101 7.597 7.597 7.602 -0.005 25342 16462 1 20 . 1 1 102 102 MET N N 102 118.406 118.406 116.915 1.491 25342 16463 1 20 . 1 1 102 102 MET HA H 102 3.864 3.864 4.593 -0.729 25342 16464 1 20 . 1 1 102 102 MET C C 102 172.820 172.820 177.449 -4.629 25342 16465 1 20 . 1 1 102 102 MET CA C 102 53.298 53.298 56.315 -3.017 25342 16466 1 20 . 1 1 102 102 MET CB C 102 31.207 31.207 31.568 -0.361 25342 16467 1 20 . 1 1 102 102 MET H H 102 7.434 7.434 8.337 -0.903 25342 16468 1 20 . 1 1 103 103 LYS N N 103 115.889 115.889 121.686 -5.797 25342 16469 1 20 . 1 1 103 103 LYS HA H 103 3.919 3.919 3.934 -0.016 25342 16470 1 20 . 1 1 103 103 LYS C C 103 173.938 173.938 177.498 -3.560 25342 16471 1 20 . 1 1 103 103 LYS CA C 103 56.437 56.437 59.161 -2.724 25342 16472 1 20 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.877 -2.614 25342 16473 1 20 . 1 1 103 103 LYS H H 103 6.881 6.881 8.102 -1.221 25342 16474 1 20 . 1 1 104 104 ASN N N 104 114.951 114.951 114.634 0.317 25342 16475 1 20 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.557 0.174 25342 16476 1 20 . 1 1 104 104 ASN C C 104 172.617 172.617 176.275 -3.658 25342 16477 1 20 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.905 -3.639 25342 16478 1 20 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.175 -2.392 25342 16479 1 20 . 1 1 104 104 ASN H H 104 8.493 8.493 8.109 0.384 25342 16480 1 20 . 1 1 105 105 TYR N N 105 122.680 122.680 122.068 0.612 25342 16481 1 20 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.351 0.210 25342 16482 1 20 . 1 1 105 105 TYR CA C 105 55.433 55.433 59.683 -4.250 25342 16483 1 20 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.213 -3.381 25342 16484 1 20 . 1 1 105 105 TYR H H 105 8.217 8.217 7.982 0.235 25342 16485 1 20 . 1 1 106 106 ARG N N 106 128.872 128.872 122.555 6.317 25342 16486 1 20 . 1 1 106 106 ARG HA H 106 4.265 4.265 3.940 0.325 25342 16487 1 20 . 1 1 106 106 ARG CA C 106 52.982 52.982 56.357 -3.375 25342 16488 1 20 . 1 1 106 106 ARG CB C 106 28.130 28.130 30.420 -2.290 25342 16489 1 20 . 1 1 106 106 ARG H H 106 8.801 8.801 7.726 1.075 25342 16490 1 20 . 1 1 107 107 GLY CA C 107 42.401 42.401 45.319 -2.918 25342 16491 1 20 . 1 1 108 108 GLU N N 108 117.000 117.000 123.587 -6.587 25342 16492 1 20 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.579 0.047 25342 16493 1 20 . 1 1 108 108 GLU C C 108 174.125 174.125 174.837 -0.712 25342 16494 1 20 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.633 -1.845 25342 16495 1 20 . 1 1 108 108 GLU CB C 108 30.440 30.440 32.533 -2.093 25342 16496 1 20 . 1 1 108 108 GLU H H 108 7.514 7.514 8.493 -0.979 25342 16497 1 20 . 1 1 109 109 VAL N N 109 123.398 123.398 122.656 0.742 25342 16498 1 20 . 1 1 109 109 VAL HA H 109 5.337 5.337 4.621 0.716 25342 16499 1 20 . 1 1 109 109 VAL C C 109 170.606 170.606 174.110 -3.504 25342 16500 1 20 . 1 1 109 109 VAL CA C 109 57.280 57.280 61.310 -4.030 25342 16501 1 20 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.598 -2.941 25342 16502 1 20 . 1 1 109 109 VAL H H 109 8.942 8.942 8.337 0.605 25342 16503 1 20 . 1 1 110 110 ALA N N 110 127.905 127.905 129.445 -1.540 25342 16504 1 20 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.718 -0.091 25342 16505 1 20 . 1 1 110 110 ALA C C 110 173.195 173.195 175.364 -2.169 25342 16506 1 20 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.277 -1.931 25342 16507 1 20 . 1 1 110 110 ALA CB C 110 18.325 18.325 21.224 -2.899 25342 16508 1 20 . 1 1 110 110 ALA H H 110 8.776 8.776 8.252 0.524 25342 16509 1 20 . 1 1 111 111 SER N N 111 110.523 110.523 114.099 -3.576 25342 16510 1 20 . 1 1 111 111 SER HA H 111 5.562 5.562 5.509 0.053 25342 16511 1 20 . 1 1 111 111 SER C C 111 170.719 170.719 172.658 -1.939 25342 16512 1 20 . 1 1 111 111 SER CA C 111 51.314 51.314 56.654 -5.340 25342 16513 1 20 . 1 1 111 111 SER CB C 111 61.907 61.907 65.193 -3.286 25342 16514 1 20 . 1 1 111 111 SER H H 111 7.480 7.480 8.026 -0.546 25342 16515 1 20 . 1 1 112 112 PHE N N 112 125.567 125.567 123.329 2.238 25342 16516 1 20 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.247 1.109 25342 16517 1 20 . 1 1 112 112 PHE C C 112 169.536 169.536 171.499 -1.963 25342 16518 1 20 . 1 1 112 112 PHE CA C 112 50.371 50.371 54.953 -4.582 25342 16519 1 20 . 1 1 112 112 PHE CB C 112 39.788 39.788 42.213 -2.425 25342 16520 1 20 . 1 1 112 112 PHE H H 112 7.848 7.848 7.505 0.343 25342 16521 1 20 . 1 1 113 113 PHE N N 113 115.065 115.065 114.996 0.069 25342 16522 1 20 . 1 1 113 113 PHE HA H 113 6.104 6.104 4.878 1.226 25342 16523 1 20 . 1 1 113 113 PHE C C 113 173.006 173.006 175.515 -2.509 25342 16524 1 20 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.803 -5.541 25342 16525 1 20 . 1 1 113 113 PHE CB C 113 38.749 38.749 42.822 -4.073 25342 16526 1 20 . 1 1 113 113 PHE H H 113 7.361 7.361 7.410 -0.049 25342 16527 1 20 . 1 1 114 114 THR N N 114 108.014 108.014 115.054 -7.040 25342 16528 1 20 . 1 1 114 114 THR HA H 114 4.999 4.999 4.656 0.343 25342 16529 1 20 . 1 1 114 114 THR C C 114 169.874 169.874 174.327 -4.453 25342 16530 1 20 . 1 1 114 114 THR CA C 114 56.500 56.500 61.265 -4.765 25342 16531 1 20 . 1 1 114 114 THR CB C 114 68.809 68.809 69.201 -0.393 25342 16532 1 20 . 1 1 114 114 THR H H 114 7.867 7.867 8.577 -0.710 25342 16533 1 20 . 1 1 115 115 SER N N 115 115.049 115.049 116.851 -1.802 25342 16534 1 20 . 1 1 115 115 SER HA H 115 5.613 5.613 4.227 1.386 25342 16535 1 20 . 1 1 115 115 SER C C 115 171.247 171.247 175.449 -4.202 25342 16536 1 20 . 1 1 115 115 SER CA C 115 54.830 54.830 58.733 -3.903 25342 16537 1 20 . 1 1 115 115 SER CB C 115 63.992 63.992 64.048 -0.056 25342 16538 1 20 . 1 1 115 115 SER H H 115 8.970 8.970 7.538 1.432 25342 16539 1 20 . 1 1 116 116 ALA N N 116 122.671 122.671 123.773 -1.102 25342 16540 1 20 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.359 0.626 25342 16541 1 20 . 1 1 116 116 ALA C C 116 176.180 176.180 177.504 -1.324 25342 16542 1 20 . 1 1 116 116 ALA CA C 116 49.200 49.200 52.121 -2.921 25342 16543 1 20 . 1 1 116 116 ALA CB C 116 15.995 15.995 18.118 -2.123 25342 16544 1 20 . 1 1 116 116 ALA H H 116 8.963 8.963 8.368 0.595 25342 16545 1 20 . 1 1 117 117 GLY N N 117 107.387 107.387 105.972 1.415 25342 16546 1 20 . 1 1 117 117 GLY C C 117 172.528 172.528 174.706 -2.178 25342 16547 1 20 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.205 -1.473 25342 16548 1 20 . 1 1 117 117 GLY H H 117 9.340 9.340 8.284 1.056 25342 16549 1 20 . 1 1 118 118 THR N N 118 113.481 113.481 112.880 0.601 25342 16550 1 20 . 1 1 118 118 THR HA H 118 4.651 4.651 4.418 0.233 25342 16551 1 20 . 1 1 118 118 THR C C 118 172.067 172.067 174.960 -2.893 25342 16552 1 20 . 1 1 118 118 THR CA C 118 57.357 57.357 61.875 -4.518 25342 16553 1 20 . 1 1 118 118 THR CB C 118 69.475 69.475 69.558 -0.083 25342 16554 1 20 . 1 1 118 118 THR H H 118 9.373 9.373 7.721 1.652 25342 16555 1 20 . 1 1 119 119 ASN N N 119 113.202 113.202 117.339 -4.137 25342 16556 1 20 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.278 0.340 25342 16557 1 20 . 1 1 119 119 ASN C C 119 173.114 173.114 176.551 -3.437 25342 16558 1 20 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.944 -3.260 25342 16559 1 20 . 1 1 119 119 ASN CB C 119 33.730 33.730 36.660 -2.930 25342 16560 1 20 . 1 1 119 119 ASN H H 119 8.908 8.908 8.917 -0.009 25342 16561 1 20 . 1 1 120 120 HIS N N 120 117.315 117.315 117.254 0.061 25342 16562 1 20 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.000 -0.214 25342 16563 1 20 . 1 1 120 120 HIS C C 120 174.381 174.381 176.591 -2.210 25342 16564 1 20 . 1 1 120 120 HIS CA C 120 54.516 54.516 59.339 -4.823 25342 16565 1 20 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.210 -2.706 25342 16566 1 20 . 1 1 120 120 HIS H H 120 8.074 8.074 7.800 0.274 25342 16567 1 20 . 1 1 121 121 LYS N N 121 118.678 118.678 119.913 -1.235 25342 16568 1 20 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.776 0.058 25342 16569 1 20 . 1 1 121 121 LYS C C 121 176.564 176.564 177.737 -1.173 25342 16570 1 20 . 1 1 121 121 LYS CA C 121 57.295 57.295 59.370 -2.075 25342 16571 1 20 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.597 -2.655 25342 16572 1 20 . 1 1 121 121 LYS H H 121 8.336 8.336 7.529 0.807 25342 16573 1 20 . 1 1 122 122 ALA N N 122 122.146 122.146 121.087 1.059 25342 16574 1 20 . 1 1 122 122 ALA HA H 122 3.695 3.695 3.606 0.089 25342 16575 1 20 . 1 1 122 122 ALA C C 122 175.163 175.163 178.959 -3.796 25342 16576 1 20 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.157 -2.466 25342 16577 1 20 . 1 1 122 122 ALA CB C 122 15.718 15.718 17.722 -2.004 25342 16578 1 20 . 1 1 122 122 ALA H H 122 7.584 7.584 7.698 -0.114 25342 16579 1 20 . 1 1 123 123 TYR N N 123 119.730 119.730 119.976 -0.246 25342 16580 1 20 . 1 1 123 123 TYR HA H 123 3.153 3.153 3.979 -0.826 25342 16581 1 20 . 1 1 123 123 TYR C C 123 174.340 174.340 177.732 -3.392 25342 16582 1 20 . 1 1 123 123 TYR CA C 123 60.398 60.398 62.122 -1.724 25342 16583 1 20 . 1 1 123 123 TYR CB C 123 34.663 34.663 38.083 -3.420 25342 16584 1 20 . 1 1 123 123 TYR H H 123 7.317 7.317 7.963 -0.646 25342 16585 1 20 . 1 1 124 124 VAL N N 124 118.649 118.649 117.706 0.943 25342 16586 1 20 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.491 -0.289 25342 16587 1 20 . 1 1 124 124 VAL C C 124 175.603 175.603 178.274 -2.671 25342 16588 1 20 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.837 -2.157 25342 16589 1 20 . 1 1 124 124 VAL CB C 124 29.289 29.289 31.239 -1.950 25342 16590 1 20 . 1 1 124 124 VAL H H 124 7.799 7.799 7.591 0.208 25342 16591 1 20 . 1 1 125 125 SER N N 125 114.475 114.475 114.807 -0.332 25342 16592 1 20 . 1 1 125 125 SER HA H 125 4.032 4.032 4.042 -0.010 25342 16593 1 20 . 1 1 125 125 SER C C 125 174.849 174.849 176.875 -2.026 25342 16594 1 20 . 1 1 125 125 SER CA C 125 59.002 59.002 61.768 -2.766 25342 16595 1 20 . 1 1 125 125 SER CB C 125 59.613 59.613 62.781 -3.168 25342 16596 1 20 . 1 1 125 125 SER H H 125 7.766 7.766 7.667 0.099 25342 16597 1 20 . 1 1 126 126 HIS N N 126 119.326 119.326 120.014 -0.688 25342 16598 1 20 . 1 1 126 126 HIS HA H 126 4.127 4.127 3.720 0.407 25342 16599 1 20 . 1 1 126 126 HIS C C 126 172.865 172.865 177.335 -4.470 25342 16600 1 20 . 1 1 126 126 HIS CA C 126 55.706 55.706 57.846 -2.140 25342 16601 1 20 . 1 1 126 126 HIS CB C 126 25.993 25.993 29.461 -3.468 25342 16602 1 20 . 1 1 126 126 HIS H H 126 8.569 8.569 7.525 1.044 25342 16603 1 20 . 1 1 127 127 PHE N N 127 121.044 121.044 120.169 0.875 25342 16604 1 20 . 1 1 127 127 PHE HA H 127 3.174 3.174 3.970 -0.796 25342 16605 1 20 . 1 1 127 127 PHE C C 127 173.378 173.378 176.646 -3.268 25342 16606 1 20 . 1 1 127 127 PHE CA C 127 60.867 60.867 61.173 -0.306 25342 16607 1 20 . 1 1 127 127 PHE CB C 127 36.054 36.054 38.960 -2.906 25342 16608 1 20 . 1 1 127 127 PHE H H 127 9.139 9.139 8.334 0.805 25342 16609 1 20 . 1 1 128 128 ASN N N 128 114.893 114.893 117.673 -2.780 25342 16610 1 20 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.198 -0.158 25342 16611 1 20 . 1 1 128 128 ASN C C 128 175.230 175.230 177.358 -2.128 25342 16612 1 20 . 1 1 128 128 ASN CA C 128 54.300 54.300 57.046 -2.746 25342 16613 1 20 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.264 -2.093 25342 16614 1 20 . 1 1 128 128 ASN H H 128 7.774 7.774 7.846 -0.072 25342 16615 1 20 . 1 1 129 129 GLU N N 129 119.804 119.804 119.257 0.547 25342 16616 1 20 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.951 0.089 25342 16617 1 20 . 1 1 129 129 GLU C C 129 177.052 177.052 177.938 -0.886 25342 16618 1 20 . 1 1 129 129 GLU CA C 129 56.730 56.730 59.184 -2.454 25342 16619 1 20 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.435 -2.239 25342 16620 1 20 . 1 1 129 129 GLU H H 129 7.577 7.577 7.476 0.101 25342 16621 1 20 . 1 1 130 130 TRP N N 130 120.979 120.979 115.359 5.620 25342 16622 1 20 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.584 -0.127 25342 16623 1 20 . 1 1 130 130 TRP C C 130 174.329 174.329 176.533 -2.204 25342 16624 1 20 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.285 -1.597 25342 16625 1 20 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.252 -2.261 25342 16626 1 20 . 1 1 130 130 TRP H H 130 8.225 8.225 7.178 1.047 25342 16627 1 20 . 1 1 131 131 ALA N N 131 120.450 120.450 120.074 0.376 25342 16628 1 20 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.316 -0.380 25342 16629 1 20 . 1 1 131 131 ALA C C 131 172.487 172.487 175.677 -3.190 25342 16630 1 20 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.409 -2.975 25342 16631 1 20 . 1 1 131 131 ALA CB C 131 16.288 16.288 20.086 -3.798 25342 16632 1 20 . 1 1 131 131 ALA H H 131 8.081 8.081 7.609 0.472 25342 16633 1 20 . 1 1 132 132 ASP N N 132 117.813 117.813 120.575 -2.762 25342 16634 1 20 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.402 -0.194 25342 16635 1 20 . 1 1 132 132 ASP C C 132 173.804 173.804 176.409 -2.605 25342 16636 1 20 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.871 -1.690 25342 16637 1 20 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.966 -1.645 25342 16638 1 20 . 1 1 132 132 ASP H H 132 6.772 6.772 7.812 -1.040 25342 16639 1 20 . 1 1 133 133 GLY N N 133 115.052 115.052 113.006 2.046 25342 16640 1 20 . 1 1 133 133 GLY C C 133 172.078 172.078 174.095 -2.017 25342 16641 1 20 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.783 -2.363 25342 16642 1 20 . 1 1 133 133 GLY H H 133 8.626 8.626 8.366 0.260 25342 16643 1 20 . 1 1 134 134 LEU N N 134 120.063 120.063 125.977 -5.914 25342 16644 1 20 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.499 -0.027 25342 16645 1 20 . 1 1 134 134 LEU C C 134 174.079 174.079 177.153 -3.074 25342 16646 1 20 . 1 1 134 134 LEU CA C 134 50.964 50.964 54.155 -3.191 25342 16647 1 20 . 1 1 134 134 LEU CB C 134 40.370 40.370 40.858 -0.488 25342 16648 1 20 . 1 1 134 134 LEU H H 134 8.094 8.094 7.937 0.157 25342 16649 1 20 . 1 1 135 135 ASN N N 135 119.292 119.292 122.552 -3.260 25342 16650 1 20 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.596 0.027 25342 16651 1 20 . 1 1 135 135 ASN C C 135 170.527 170.527 174.876 -4.349 25342 16652 1 20 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.742 -4.740 25342 16653 1 20 . 1 1 135 135 ASN CB C 135 33.560 33.560 39.300 -5.740 25342 16654 1 20 . 1 1 135 135 ASN H H 135 8.513 8.513 8.611 -0.098 25342 16655 1 20 . 1 1 136 136 VAL N N 136 125.412 125.412 122.345 3.067 25342 16656 1 20 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.557 0.049 25342 16657 1 20 . 1 1 136 136 VAL C C 136 175.420 175.420 175.643 -0.223 25342 16658 1 20 . 1 1 136 136 VAL CA C 136 58.382 58.382 61.183 -2.801 25342 16659 1 20 . 1 1 136 136 VAL CB C 136 29.247 29.247 33.544 -4.298 25342 16660 1 20 . 1 1 136 136 VAL H H 136 7.648 7.648 8.384 -0.736 25342 16661 1 20 . 1 1 137 137 ILE N N 137 121.881 121.881 120.191 1.690 25342 16662 1 20 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.113 0.320 25342 16663 1 20 . 1 1 137 137 ILE C C 137 173.906 173.906 175.509 -1.603 25342 16664 1 20 . 1 1 137 137 ILE CA C 137 58.978 58.978 61.878 -2.900 25342 16665 1 20 . 1 1 137 137 ILE CB C 137 36.196 36.196 37.816 -1.620 25342 16666 1 20 . 1 1 137 137 ILE H H 137 9.139 9.139 8.577 0.562 25342 16667 1 20 . 1 1 138 138 GLY N N 138 108.226 108.226 106.453 1.773 25342 16668 1 20 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.114 -1.723 25342 16669 1 20 . 1 1 138 138 GLY H H 138 6.645 6.645 7.134 -0.489 25342 16670 1 20 . 1 1 139 139 VAL N N 139 119.408 119.408 121.573 -2.165 25342 16671 1 20 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.208 0.149 25342 16672 1 20 . 1 1 139 139 VAL C C 139 172.327 172.327 174.967 -2.640 25342 16673 1 20 . 1 1 139 139 VAL CA C 139 58.267 58.267 61.234 -2.967 25342 16674 1 20 . 1 1 139 139 VAL CB C 139 32.743 32.743 33.186 -0.443 25342 16675 1 20 . 1 1 139 139 VAL H H 139 8.092 8.092 8.695 -0.603 25342 16676 1 20 . 1 1 140 140 ALA N N 140 127.415 127.415 130.342 -2.927 25342 16677 1 20 . 1 1 140 140 ALA HA H 140 4.445 4.445 4.974 -0.529 25342 16678 1 20 . 1 1 140 140 ALA C C 140 170.718 170.718 175.399 -4.681 25342 16679 1 20 . 1 1 140 140 ALA CA C 140 48.900 48.900 50.859 -1.960 25342 16680 1 20 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.060 -1.001 25342 16681 1 20 . 1 1 140 140 ALA H H 140 9.093 9.093 8.878 0.215 25342 16682 1 20 . 1 1 141 141 ARG N N 141 119.287 119.287 118.464 0.823 25342 16683 1 20 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.198 -2.711 25342 16684 1 20 . 1 1 141 141 ARG C C 141 173.375 173.375 175.909 -2.534 25342 16685 1 20 . 1 1 141 141 ARG CA C 141 51.884 51.884 54.956 -3.071 25342 16686 1 20 . 1 1 141 141 ARG CB C 141 28.684 28.684 33.036 -4.352 25342 16687 1 20 . 1 1 141 141 ARG H H 141 7.620 7.620 8.425 -0.805 25342 16688 1 20 . 1 1 142 142 ASP N N 142 125.999 125.999 119.823 6.176 25342 16689 1 20 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.407 -0.683 25342 16690 1 20 . 1 1 142 142 ASP C C 142 169.292 169.292 175.779 -6.487 25342 16691 1 20 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.550 -3.212 25342 16692 1 20 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.509 -3.832 25342 16693 1 20 . 1 1 142 142 ASP H H 142 9.482 9.482 8.809 0.673 25342 16694 1 20 . 1 1 143 143 ASP N N 143 119.293 119.293 120.128 -0.835 25342 16695 1 20 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.463 -0.157 25342 16696 1 20 . 1 1 143 143 ASP C C 143 175.686 175.686 176.951 -1.265 25342 16697 1 20 . 1 1 143 143 ASP CA C 143 48.905 48.905 53.525 -4.620 25342 16698 1 20 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.197 -3.885 25342 16699 1 20 . 1 1 143 143 ASP H H 143 8.108 8.108 8.567 -0.459 25342 16700 1 20 . 1 1 144 144 SER N N 144 115.303 115.303 117.778 -2.475 25342 16701 1 20 . 1 1 144 144 SER HA H 144 3.740 3.740 4.193 -0.453 25342 16702 1 20 . 1 1 144 144 SER C C 144 172.925 172.925 175.111 -2.186 25342 16703 1 20 . 1 1 144 144 SER CA C 144 59.213 59.213 60.773 -1.560 25342 16704 1 20 . 1 1 144 144 SER CB C 144 60.806 60.806 63.115 -2.309 25342 16705 1 20 . 1 1 144 144 SER H H 144 7.642 7.642 7.537 0.105 25342 16706 1 20 . 1 1 145 145 GLU N N 145 119.523 119.523 118.417 1.106 25342 16707 1 20 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.146 0.160 25342 16708 1 20 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.148 -3.109 25342 16709 1 20 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.129 -2.329 25342 16710 1 20 . 1 1 145 145 GLU H H 145 7.771 7.771 7.900 -0.129 25342 16711 1 20 . 1 1 146 146 VAL N N 146 118.683 118.683 119.895 -1.212 25342 16712 1 20 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.442 -0.501 25342 16713 1 20 . 1 1 146 146 VAL C C 146 174.591 174.591 177.259 -2.668 25342 16714 1 20 . 1 1 146 146 VAL CA C 146 63.932 63.932 67.576 -3.644 25342 16715 1 20 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.555 -2.509 25342 16716 1 20 . 1 1 146 146 VAL H H 146 6.352 6.352 7.008 -0.656 25342 16717 1 20 . 1 1 147 147 ASP N N 147 119.312 119.312 116.636 2.676 25342 16718 1 20 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.311 -0.256 25342 16719 1 20 . 1 1 147 147 ASP C C 147 174.783 174.783 177.975 -3.192 25342 16720 1 20 . 1 1 147 147 ASP CA C 147 54.241 54.241 57.243 -3.002 25342 16721 1 20 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.743 -3.510 25342 16722 1 20 . 1 1 147 147 ASP H H 147 8.370 8.370 8.719 -0.349 25342 16723 1 20 . 1 1 148 148 LYS N N 148 119.342 119.342 117.914 1.428 25342 16724 1 20 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.301 -0.364 25342 16725 1 20 . 1 1 148 148 LYS C C 148 176.384 176.384 178.237 -1.853 25342 16726 1 20 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.890 -2.184 25342 16727 1 20 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.117 -2.606 25342 16728 1 20 . 1 1 148 148 LYS H H 148 7.040 7.040 7.453 -0.413 25342 16729 1 20 . 1 1 149 149 TRP N N 149 118.258 118.258 119.829 -1.571 25342 16730 1 20 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.800 -0.209 25342 16731 1 20 . 1 1 149 149 TRP C C 149 174.212 174.212 176.797 -2.585 25342 16732 1 20 . 1 1 149 149 TRP CA C 149 53.745 53.745 56.271 -2.526 25342 16733 1 20 . 1 1 149 149 TRP CB C 149 26.940 26.940 29.325 -2.385 25342 16734 1 20 . 1 1 149 149 TRP H H 149 7.811 7.811 7.468 0.344 25342 16735 1 20 . 1 1 150 150 SER N N 150 109.618 109.618 112.811 -3.193 25342 16736 1 20 . 1 1 150 150 SER HA H 150 4.234 4.234 4.699 -0.465 25342 16737 1 20 . 1 1 150 150 SER C C 150 170.189 170.189 173.144 -2.955 25342 16738 1 20 . 1 1 150 150 SER CA C 150 56.695 56.695 57.556 -0.861 25342 16739 1 20 . 1 1 150 150 SER CB C 150 61.935 61.935 63.315 -1.380 25342 16740 1 20 . 1 1 150 150 SER H H 150 7.793 7.793 7.680 0.113 25342 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 143 3.861 -0.774 3.796 25342 2 1 1 "Average Difference" HA 138 0.524 0.163 0.500 25342 3 1 1 "Average Difference" C 127 2.952 2.653 1.298 25342 4 1 1 "Average Difference" CA 147 2.810 2.445 1.390 25342 5 1 1 "Average Difference" CB 139 3.076 2.775 1.333 25342 6 1 1 "Average Difference" HN 143 0.811 -0.078 0.810 25342 7 1 2 "Average Difference" N 143 3.790 -0.946 3.683 25342 8 1 2 "Average Difference" HA 138 0.489 0.176 0.458 25342 9 1 2 "Average Difference" C 127 2.949 2.668 1.260 25342 10 1 2 "Average Difference" CA 147 2.814 2.444 1.399 25342 11 1 2 "Average Difference" CB 139 3.183 2.843 1.436 25342 12 1 2 "Average Difference" HN 143 0.797 -0.021 0.800 25342 13 1 3 "Average Difference" N 143 4.123 -0.986 4.017 25342 14 1 3 "Average Difference" HA 138 0.545 0.176 0.517 25342 15 1 3 "Average Difference" C 127 2.974 2.628 1.399 25342 16 1 3 "Average Difference" CA 147 2.810 2.443 1.395 25342 17 1 3 "Average Difference" CB 139 3.165 2.838 1.406 25342 18 1 3 "Average Difference" HN 143 0.802 -0.068 0.802 25342 19 1 4 "Average Difference" N 143 3.687 -0.936 3.579 25342 20 1 4 "Average Difference" HA 138 0.520 0.125 0.506 25342 21 1 4 "Average Difference" C 127 3.085 2.833 1.227 25342 22 1 4 "Average Difference" CA 147 2.909 2.609 1.290 25342 23 1 4 "Average Difference" CB 139 3.046 2.663 1.484 25342 24 1 4 "Average Difference" HN 143 0.795 -0.076 0.795 25342 25 1 5 "Average Difference" N 143 4.015 -1.020 3.897 25342 26 1 5 "Average Difference" HA 138 0.536 0.138 0.520 25342 27 1 5 "Average Difference" C 127 2.963 2.666 1.299 25342 28 1 5 "Average Difference" CA 147 2.853 2.490 1.397 25342 29 1 5 "Average Difference" CB 139 3.025 2.682 1.403 25342 30 1 5 "Average Difference" HN 143 0.828 -0.085 0.826 25342 31 1 6 "Average Difference" N 143 3.705 -0.811 3.627 25342 32 1 6 "Average Difference" HA 138 0.530 0.151 0.510 25342 33 1 6 "Average Difference" C 127 3.048 2.797 1.215 25342 34 1 6 "Average Difference" CA 147 2.920 2.628 1.278 25342 35 1 6 "Average Difference" CB 139 3.057 2.741 1.358 25342 36 1 6 "Average Difference" HN 143 0.766 -0.050 0.767 25342 37 1 7 "Average Difference" N 143 3.642 -0.855 3.553 25342 38 1 7 "Average Difference" HA 138 0.537 0.135 0.522 25342 39 1 7 "Average Difference" C 127 2.996 2.689 1.326 25342 40 1 7 "Average Difference" CA 147 2.852 2.516 1.349 25342 41 1 7 "Average Difference" CB 139 3.079 2.698 1.488 25342 42 1 7 "Average Difference" HN 143 0.825 -0.082 0.824 25342 43 1 8 "Average Difference" N 143 3.817 -0.797 3.746 25342 44 1 8 "Average Difference" HA 138 0.546 0.156 0.525 25342 45 1 8 "Average Difference" C 127 2.968 2.679 1.282 25342 46 1 8 "Average Difference" CA 147 2.820 2.533 1.243 25342 47 1 8 "Average Difference" CB 139 3.087 2.715 1.474 25342 48 1 8 "Average Difference" HN 143 0.811 -0.091 0.809 25342 49 1 9 "Average Difference" N 143 4.242 -1.019 4.132 25342 50 1 9 "Average Difference" HA 138 0.533 0.136 0.518 25342 51 1 9 "Average Difference" C 127 2.905 2.637 1.224 25342 52 1 9 "Average Difference" CA 147 2.824 2.523 1.273 25342 53 1 9 "Average Difference" CB 139 3.063 2.744 1.365 25342 54 1 9 "Average Difference" HN 143 0.789 -0.093 0.786 25342 55 1 10 "Average Difference" N 143 3.978 -0.950 3.876 25342 56 1 10 "Average Difference" HA 138 0.538 0.155 0.517 25342 57 1 10 "Average Difference" C 127 2.980 2.688 1.292 25342 58 1 10 "Average Difference" CA 147 2.795 2.431 1.384 25342 59 1 10 "Average Difference" CB 139 3.012 2.679 1.382 25342 60 1 10 "Average Difference" HN 143 0.794 -0.059 0.795 25342 61 1 11 "Average Difference" N 143 4.169 -0.812 4.103 25342 62 1 11 "Average Difference" HA 138 0.527 0.160 0.504 25342 63 1 11 "Average Difference" C 127 2.995 2.689 1.322 25342 64 1 11 "Average Difference" CA 147 2.809 2.474 1.335 25342 65 1 11 "Average Difference" CB 139 3.067 2.731 1.400 25342 66 1 11 "Average Difference" HN 143 0.790 -0.072 0.790 25342 67 1 12 "Average Difference" N 143 3.874 -0.917 3.777 25342 68 1 12 "Average Difference" HA 138 0.547 0.165 0.523 25342 69 1 12 "Average Difference" C 127 2.949 2.641 1.318 25342 70 1 12 "Average Difference" CA 147 2.739 2.400 1.323 25342 71 1 12 "Average Difference" CB 139 3.141 2.803 1.422 25342 72 1 12 "Average Difference" HN 143 0.822 -0.089 0.820 25342 73 1 13 "Average Difference" N 143 3.796 -1.064 3.657 25342 74 1 13 "Average Difference" HA 138 0.528 0.141 0.511 25342 75 1 13 "Average Difference" C 127 2.998 2.658 1.394 25342 76 1 13 "Average Difference" CA 147 2.730 2.465 1.178 25342 77 1 13 "Average Difference" CB 139 3.122 2.776 1.434 25342 78 1 13 "Average Difference" HN 143 0.779 -0.076 0.778 25342 79 1 14 "Average Difference" N 143 3.993 -0.789 3.928 25342 80 1 14 "Average Difference" HA 138 0.525 0.138 0.509 25342 81 1 14 "Average Difference" C 127 2.995 2.705 1.291 25342 82 1 14 "Average Difference" CA 147 2.887 2.544 1.368 25342 83 1 14 "Average Difference" CB 139 3.135 2.801 1.414 25342 84 1 14 "Average Difference" HN 143 0.800 -0.058 0.801 25342 85 1 15 "Average Difference" N 143 3.839 -0.859 3.755 25342 86 1 15 "Average Difference" HA 138 0.510 0.155 0.488 25342 87 1 15 "Average Difference" C 127 2.871 2.612 1.197 25342 88 1 15 "Average Difference" CA 147 2.758 2.374 1.409 25342 89 1 15 "Average Difference" CB 139 3.099 2.772 1.390 25342 90 1 15 "Average Difference" HN 143 0.783 -0.074 0.782 25342 91 1 16 "Average Difference" N 143 4.066 -0.959 3.965 25342 92 1 16 "Average Difference" HA 138 0.538 0.167 0.513 25342 93 1 16 "Average Difference" C 127 2.956 2.674 1.264 25342 94 1 16 "Average Difference" CA 147 2.845 2.490 1.381 25342 95 1 16 "Average Difference" CB 139 3.112 2.800 1.362 25342 96 1 16 "Average Difference" HN 143 0.786 -0.056 0.787 25342 97 1 17 "Average Difference" N 143 3.980 -0.835 3.905 25342 98 1 17 "Average Difference" HA 138 0.554 0.140 0.538 25342 99 1 17 "Average Difference" C 127 3.053 2.788 1.249 25342 100 1 17 "Average Difference" CA 147 2.921 2.583 1.368 25342 101 1 17 "Average Difference" CB 139 3.056 2.691 1.453 25342 102 1 17 "Average Difference" HN 143 0.748 -0.051 0.749 25342 103 1 18 "Average Difference" N 143 3.833 -1.009 3.711 25342 104 1 18 "Average Difference" HA 138 0.515 0.147 0.496 25342 105 1 18 "Average Difference" C 127 2.948 2.666 1.264 25342 106 1 18 "Average Difference" CA 147 2.854 2.534 1.318 25342 107 1 18 "Average Difference" CB 139 3.027 2.799 1.158 25342 108 1 18 "Average Difference" HN 143 0.791 -0.052 0.792 25342 109 1 19 "Average Difference" N 143 3.932 -0.902 3.840 25342 110 1 19 "Average Difference" HA 138 0.566 0.179 0.539 25342 111 1 19 "Average Difference" C 127 2.933 2.630 1.302 25342 112 1 19 "Average Difference" CA 147 2.824 2.441 1.425 25342 113 1 19 "Average Difference" CB 139 3.123 2.811 1.366 25342 114 1 19 "Average Difference" HN 143 0.762 -0.069 0.761 25342 115 1 20 "Average Difference" N 143 4.017 -1.085 3.882 25342 116 1 20 "Average Difference" HA 138 0.513 0.101 0.504 25342 117 1 20 "Average Difference" C 127 3.023 2.737 1.288 25342 118 1 20 "Average Difference" CA 147 2.906 2.603 1.296 25342 119 1 20 "Average Difference" CB 139 3.021 2.681 1.397 25342 120 1 20 "Average Difference" HN 143 0.800 -0.108 0.795 25342 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 25342 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 3 3 ALA N N 3 125.638 125.638 125.648 -0.010 25342 2 1 . 1 1 3 3 ALA HA H 3 4.365 4.365 4.560 -0.195 25342 3 1 . 1 1 3 3 ALA CA C 3 49.298 49.298 52.145 -2.847 25342 4 1 . 1 1 3 3 ALA CB C 3 16.859 16.859 19.565 -2.706 25342 5 1 . 1 1 3 3 ALA H H 3 8.325 8.325 8.262 0.063 25342 6 1 . 1 1 4 4 LYS N N 4 121.813 121.813 120.151 1.662 25342 7 1 . 1 1 4 4 LYS HA H 4 4.227 4.227 4.538 -0.311 25342 8 1 . 1 1 4 4 LYS C C 4 174.574 174.574 174.707 -0.133 25342 9 1 . 1 1 4 4 LYS CA C 4 53.781 53.781 55.567 -1.786 25342 10 1 . 1 1 4 4 LYS CB C 4 31.490 31.490 33.451 -1.961 25342 11 1 . 1 1 4 4 LYS H H 4 8.486 8.486 7.947 0.539 25342 12 1 . 1 1 5 5 LYS N N 5 129.722 129.722 121.456 8.266 25342 13 1 . 1 1 5 5 LYS HA H 5 4.518 4.518 4.579 -0.061 25342 14 1 . 1 1 5 5 LYS C C 5 174.720 174.720 174.994 -0.274 25342 15 1 . 1 1 5 5 LYS CA C 5 54.722 54.722 55.769 -1.047 25342 16 1 . 1 1 5 5 LYS CB C 5 29.785 29.785 35.721 -5.936 25342 17 1 . 1 1 5 5 LYS H H 5 10.015 10.015 8.275 1.740 25342 18 1 . 1 1 6 6 THR N N 6 126.254 126.254 116.466 9.788 25342 19 1 . 1 1 6 6 THR HA H 6 5.654 5.654 5.196 0.458 25342 20 1 . 1 1 6 6 THR C C 6 169.926 169.926 173.053 -3.127 25342 21 1 . 1 1 6 6 THR CA C 6 60.598 60.598 62.093 -1.495 25342 22 1 . 1 1 6 6 THR CB C 6 68.041 68.041 70.432 -2.391 25342 23 1 . 1 1 6 6 THR H H 6 8.538 8.538 8.654 -0.116 25342 24 1 . 1 1 7 7 LEU N N 7 130.775 130.775 128.142 2.633 25342 25 1 . 1 1 7 7 LEU HA H 7 4.594 4.594 4.650 -0.056 25342 26 1 . 1 1 7 7 LEU C C 7 170.404 170.404 174.348 -3.944 25342 27 1 . 1 1 7 7 LEU CA C 7 49.933 49.933 53.359 -3.426 25342 28 1 . 1 1 7 7 LEU CB C 7 40.728 40.728 44.393 -3.665 25342 29 1 . 1 1 7 7 LEU H H 7 8.575 8.575 8.516 0.059 25342 30 1 . 1 1 8 8 ILE N N 8 127.242 127.242 124.088 3.154 25342 31 1 . 1 1 8 8 ILE HA H 8 4.848 4.848 4.557 0.291 25342 32 1 . 1 1 8 8 ILE C C 8 170.936 170.936 174.457 -3.521 25342 33 1 . 1 1 8 8 ILE CA C 8 57.252 57.252 60.614 -3.362 25342 34 1 . 1 1 8 8 ILE CB C 8 36.935 36.935 39.567 -2.632 25342 35 1 . 1 1 8 8 ILE H H 8 9.217 9.217 8.098 1.119 25342 36 1 . 1 1 9 9 LEU N N 9 127.183 127.183 127.626 -0.443 25342 37 1 . 1 1 9 9 LEU HA H 9 5.694 5.694 4.894 0.800 25342 38 1 . 1 1 9 9 LEU C C 9 173.824 173.824 175.372 -1.548 25342 39 1 . 1 1 9 9 LEU CA C 9 49.839 49.839 53.854 -4.015 25342 40 1 . 1 1 9 9 LEU CB C 9 43.963 43.963 43.355 0.608 25342 41 1 . 1 1 9 9 LEU H H 9 9.248 9.248 8.735 0.513 25342 42 1 . 1 1 10 10 TYR N N 10 113.330 113.330 120.215 -6.885 25342 43 1 . 1 1 10 10 TYR HA H 10 5.514 5.514 5.251 0.263 25342 44 1 . 1 1 10 10 TYR C C 10 167.898 167.898 173.869 -5.971 25342 45 1 . 1 1 10 10 TYR CA C 10 52.875 52.875 54.343 -1.468 25342 46 1 . 1 1 10 10 TYR CB C 10 38.436 38.436 40.800 -2.364 25342 47 1 . 1 1 10 10 TYR H H 10 7.306 7.306 8.285 -0.979 25342 48 1 . 1 1 11 11 TYR N N 11 121.297 121.297 123.289 -1.992 25342 49 1 . 1 1 11 11 TYR HA H 11 4.762 4.762 5.055 -0.293 25342 50 1 . 1 1 11 11 TYR C C 11 169.698 169.698 174.807 -5.109 25342 51 1 . 1 1 11 11 TYR CA C 11 54.047 54.047 55.396 -1.349 25342 52 1 . 1 1 11 11 TYR CB C 11 40.538 40.538 40.068 0.470 25342 53 1 . 1 1 11 11 TYR H H 11 7.891 7.891 8.398 -0.507 25342 54 1 . 1 1 12 12 SER N N 12 117.763 117.763 122.370 -4.607 25342 55 1 . 1 1 12 12 SER HA H 12 4.679 4.679 4.236 0.443 25342 56 1 . 1 1 12 12 SER C C 12 170.075 170.075 173.664 -3.589 25342 57 1 . 1 1 12 12 SER CA C 12 53.619 53.619 57.172 -3.553 25342 58 1 . 1 1 12 12 SER CB C 12 62.847 62.847 63.304 -0.457 25342 59 1 . 1 1 12 12 SER H H 12 7.557 7.557 8.203 -0.646 25342 60 1 . 1 1 13 13 TRP N N 13 135.232 135.232 128.713 6.520 25342 61 1 . 1 1 13 13 TRP HA H 13 4.636 4.636 3.959 0.677 25342 62 1 . 1 1 13 13 TRP C C 13 175.708 175.708 176.028 -0.320 25342 63 1 . 1 1 13 13 TRP CA C 13 58.116 58.116 59.728 -1.612 25342 64 1 . 1 1 13 13 TRP CB C 13 27.635 27.635 29.744 -2.109 25342 65 1 . 1 1 13 13 TRP H H 13 9.755 9.755 7.951 1.804 25342 66 1 . 1 1 14 14 SER N N 14 113.789 113.789 112.360 1.429 25342 67 1 . 1 1 14 14 SER HA H 14 4.223 4.223 4.462 -0.239 25342 68 1 . 1 1 14 14 SER C C 14 172.747 172.747 174.137 -1.390 25342 69 1 . 1 1 14 14 SER CA C 14 53.828 53.828 58.156 -4.328 25342 70 1 . 1 1 14 14 SER CB C 14 60.037 60.037 63.161 -3.124 25342 71 1 . 1 1 14 14 SER H H 14 10.026 10.026 8.322 1.704 25342 72 1 . 1 1 15 15 GLY N N 15 110.489 110.489 109.750 0.739 25342 73 1 . 1 1 15 15 GLY CA C 15 44.659 44.659 45.665 -1.006 25342 74 1 . 1 1 15 15 GLY H H 15 7.391 7.391 8.277 -0.886 25342 75 1 . 1 1 16 16 GLU N N 16 129.005 129.005 120.748 8.257 25342 76 1 . 1 1 16 16 GLU HA H 16 4.063 4.063 4.215 -0.152 25342 77 1 . 1 1 16 16 GLU CA C 16 56.761 56.761 58.269 -1.508 25342 78 1 . 1 1 16 16 GLU CB C 16 26.412 26.412 29.728 -3.316 25342 79 1 . 1 1 16 16 GLU H H 16 11.550 11.550 8.457 3.093 25342 80 1 . 1 1 17 17 THR N N 17 123.016 123.016 114.639 8.377 25342 81 1 . 1 1 17 17 THR HA H 17 4.035 4.035 4.085 -0.050 25342 82 1 . 1 1 17 17 THR C C 17 173.360 173.360 176.256 -2.896 25342 83 1 . 1 1 17 17 THR CA C 17 64.303 64.303 65.354 -1.052 25342 84 1 . 1 1 17 17 THR CB C 17 63.999 63.999 68.339 -4.340 25342 85 1 . 1 1 17 17 THR H H 17 11.293 11.293 8.374 2.919 25342 86 1 . 1 1 18 18 LYS N N 18 120.156 120.156 121.483 -1.327 25342 87 1 . 1 1 18 18 LYS HA H 18 2.856 2.856 4.122 -1.266 25342 88 1 . 1 1 18 18 LYS C C 18 173.901 173.901 178.426 -4.525 25342 89 1 . 1 1 18 18 LYS CA C 18 56.834 56.834 59.097 -2.263 25342 90 1 . 1 1 18 18 LYS CB C 18 29.481 29.481 32.144 -2.663 25342 91 1 . 1 1 18 18 LYS H H 18 6.940 6.940 8.061 -1.121 25342 92 1 . 1 1 19 19 LYS N N 19 117.237 117.237 118.642 -1.405 25342 93 1 . 1 1 19 19 LYS HA H 19 3.923 3.923 4.079 -0.156 25342 94 1 . 1 1 19 19 LYS CA C 19 56.324 56.324 58.770 -2.446 25342 95 1 . 1 1 19 19 LYS CB C 19 29.361 29.361 32.208 -2.847 25342 96 1 . 1 1 19 19 LYS H H 19 7.212 7.212 7.821 -0.609 25342 97 1 . 1 1 20 20 MET N N 20 119.268 119.268 116.770 2.498 25342 98 1 . 1 1 20 20 MET HA H 20 4.413 4.413 4.280 0.133 25342 99 1 . 1 1 20 20 MET C C 20 173.625 173.625 176.292 -2.667 25342 100 1 . 1 1 20 20 MET CA C 20 52.261 52.261 55.646 -3.385 25342 101 1 . 1 1 20 20 MET CB C 20 26.680 26.680 31.730 -5.049 25342 102 1 . 1 1 20 20 MET H H 20 7.600 7.600 7.778 -0.178 25342 103 1 . 1 1 21 21 ALA N N 21 123.669 123.669 121.691 1.978 25342 104 1 . 1 1 21 21 ALA HA H 21 3.482 3.482 4.105 -0.623 25342 105 1 . 1 1 21 21 ALA C C 21 176.628 176.628 178.932 -2.305 25342 106 1 . 1 1 21 21 ALA CA C 21 52.374 52.374 54.274 -1.900 25342 107 1 . 1 1 21 21 ALA CB C 21 16.495 16.495 18.682 -2.187 25342 108 1 . 1 1 21 21 ALA H H 21 8.738 8.738 7.768 0.971 25342 109 1 . 1 1 22 22 GLU N N 22 117.242 117.242 118.808 -1.566 25342 110 1 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.900 -0.227 25342 111 1 . 1 1 22 22 GLU C C 22 176.698 176.698 178.860 -2.162 25342 112 1 . 1 1 22 22 GLU CA C 22 56.540 56.540 59.195 -2.655 25342 113 1 . 1 1 22 22 GLU CB C 22 26.434 26.434 29.271 -2.837 25342 114 1 . 1 1 22 22 GLU H H 22 7.959 7.959 7.901 0.058 25342 115 1 . 1 1 23 23 LYS N N 23 123.302 123.302 120.072 3.230 25342 116 1 . 1 1 23 23 LYS HA H 23 3.821 3.821 4.031 -0.210 25342 117 1 . 1 1 23 23 LYS C C 23 177.389 177.389 178.857 -1.468 25342 118 1 . 1 1 23 23 LYS CA C 23 56.922 56.922 59.225 -2.303 25342 119 1 . 1 1 23 23 LYS CB C 23 29.514 29.514 32.266 -2.752 25342 120 1 . 1 1 23 23 LYS H H 23 7.703 7.703 7.475 0.227 25342 121 1 . 1 1 24 24 ILE N N 24 122.208 122.208 118.327 3.881 25342 122 1 . 1 1 24 24 ILE HA H 24 3.283 3.283 3.665 -0.382 25342 123 1 . 1 1 24 24 ILE C C 24 174.934 174.934 177.675 -2.741 25342 124 1 . 1 1 24 24 ILE CA C 24 63.292 63.292 64.735 -1.443 25342 125 1 . 1 1 24 24 ILE CB C 24 34.738 34.738 37.709 -2.971 25342 126 1 . 1 1 24 24 ILE H H 24 8.535 8.535 7.733 0.802 25342 127 1 . 1 1 25 25 ASN N N 25 118.640 118.640 118.043 0.597 25342 128 1 . 1 1 25 25 ASN HA H 25 4.227 4.227 4.375 -0.148 25342 129 1 . 1 1 25 25 ASN C C 25 173.530 173.530 177.166 -3.636 25342 130 1 . 1 1 25 25 ASN CA C 25 52.211 52.211 56.192 -3.981 25342 131 1 . 1 1 25 25 ASN CB C 25 38.104 38.104 38.644 -0.540 25342 132 1 . 1 1 25 25 ASN H H 25 8.317 8.317 8.356 -0.039 25342 133 1 . 1 1 26 26 SER N N 26 111.990 111.990 114.439 -2.449 25342 134 1 . 1 1 26 26 SER HA H 26 4.153 4.153 4.347 -0.194 25342 135 1 . 1 1 26 26 SER C C 26 172.110 172.110 175.266 -3.156 25342 136 1 . 1 1 26 26 SER CA C 26 57.905 57.905 60.520 -2.615 25342 137 1 . 1 1 26 26 SER CB C 26 60.655 60.655 63.301 -2.646 25342 138 1 . 1 1 26 26 SER H H 26 7.369 7.369 7.909 -0.540 25342 139 1 . 1 1 27 27 GLU N N 27 120.201 120.201 119.235 0.966 25342 140 1 . 1 1 27 27 GLU HA H 27 4.101 4.101 4.330 -0.229 25342 141 1 . 1 1 27 27 GLU C C 27 173.673 173.673 176.595 -2.922 25342 142 1 . 1 1 27 27 GLU CA C 27 54.235 54.235 56.544 -2.309 25342 143 1 . 1 1 27 27 GLU CB C 27 26.601 26.601 30.323 -3.723 25342 144 1 . 1 1 27 27 GLU H H 27 7.451 7.451 7.755 -0.304 25342 145 1 . 1 1 28 28 ILE N N 28 118.762 118.762 119.329 -0.567 25342 146 1 . 1 1 28 28 ILE HA H 28 4.199 4.199 4.173 0.026 25342 147 1 . 1 1 28 28 ILE C C 28 172.487 172.487 175.819 -3.332 25342 148 1 . 1 1 28 28 ILE CA C 28 57.732 57.732 60.592 -2.860 25342 149 1 . 1 1 28 28 ILE CB C 28 35.738 35.738 39.769 -4.031 25342 150 1 . 1 1 28 28 ILE H H 28 7.255 7.255 7.410 -0.155 25342 151 1 . 1 1 29 29 LYS N N 29 130.563 130.563 123.618 6.945 25342 152 1 . 1 1 29 29 LYS HA H 29 4.002 4.002 4.208 -0.206 25342 153 1 . 1 1 29 29 LYS C C 29 174.386 174.386 176.936 -2.550 25342 154 1 . 1 1 29 29 LYS CA C 29 55.535 55.535 56.914 -1.379 25342 155 1 . 1 1 29 29 LYS CB C 29 29.586 29.586 33.049 -3.463 25342 156 1 . 1 1 29 29 LYS H H 29 8.564 8.564 8.626 -0.062 25342 157 1 . 1 1 30 30 ASP N N 30 119.357 119.357 119.925 -0.568 25342 158 1 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.486 -0.084 25342 159 1 . 1 1 30 30 ASP C C 30 172.570 172.570 175.780 -3.210 25342 160 1 . 1 1 30 30 ASP CA C 30 53.436 53.436 54.809 -1.373 25342 161 1 . 1 1 30 30 ASP CB C 30 36.744 36.744 39.449 -2.705 25342 162 1 . 1 1 30 30 ASP H H 30 8.920 8.920 8.680 0.240 25342 163 1 . 1 1 31 31 SER N N 31 114.019 114.019 115.462 -1.443 25342 164 1 . 1 1 31 31 SER HA H 31 4.782 4.782 4.700 0.082 25342 165 1 . 1 1 31 31 SER C C 31 171.150 171.150 174.471 -3.321 25342 166 1 . 1 1 31 31 SER CA C 31 55.551 55.551 58.312 -2.761 25342 167 1 . 1 1 31 31 SER CB C 31 62.259 62.259 64.972 -2.713 25342 168 1 . 1 1 31 31 SER H H 31 8.006 8.006 7.991 0.015 25342 169 1 . 1 1 32 32 GLU N N 32 121.455 121.455 120.195 1.260 25342 170 1 . 1 1 32 32 GLU HA H 32 4.740 4.740 4.544 0.196 25342 171 1 . 1 1 32 32 GLU C C 32 171.185 171.185 174.763 -3.578 25342 172 1 . 1 1 32 32 GLU CA C 32 52.081 52.081 55.372 -3.292 25342 173 1 . 1 1 32 32 GLU CB C 32 30.827 30.827 32.475 -1.648 25342 174 1 . 1 1 32 32 GLU H H 32 8.145 8.145 8.466 -0.321 25342 175 1 . 1 1 33 33 LEU N N 33 126.176 126.176 122.051 4.125 25342 176 1 . 1 1 33 33 LEU HA H 33 5.306 5.306 4.629 0.677 25342 177 1 . 1 1 33 33 LEU C C 33 173.365 173.365 175.537 -2.172 25342 178 1 . 1 1 33 33 LEU CA C 33 51.440 51.440 54.204 -2.764 25342 179 1 . 1 1 33 33 LEU CB C 33 43.635 43.635 43.919 -0.284 25342 180 1 . 1 1 33 33 LEU H H 33 8.589 8.589 8.446 0.143 25342 181 1 . 1 1 34 34 LYS N N 34 127.200 127.200 124.827 2.373 25342 182 1 . 1 1 34 34 LYS HA H 34 4.596 4.596 4.797 -0.201 25342 183 1 . 1 1 34 34 LYS C C 34 169.622 169.622 174.609 -4.987 25342 184 1 . 1 1 34 34 LYS CA C 34 52.329 52.329 54.275 -1.946 25342 185 1 . 1 1 34 34 LYS CB C 34 34.200 34.200 36.224 -2.024 25342 186 1 . 1 1 34 34 LYS H H 34 9.380 9.380 8.800 0.580 25342 187 1 . 1 1 35 35 GLU N N 35 122.324 122.324 119.451 2.873 25342 188 1 . 1 1 35 35 GLU HA H 35 3.333 3.333 5.314 -1.981 25342 189 1 . 1 1 35 35 GLU C C 35 172.734 172.734 175.123 -2.389 25342 190 1 . 1 1 35 35 GLU CA C 35 52.612 52.612 54.889 -2.277 25342 191 1 . 1 1 35 35 GLU CB C 35 29.319 29.319 32.952 -3.633 25342 192 1 . 1 1 35 35 GLU H H 35 8.094 8.094 8.473 -0.379 25342 193 1 . 1 1 36 36 VAL N N 36 126.781 126.781 120.151 6.630 25342 194 1 . 1 1 36 36 VAL HA H 36 3.839 3.839 4.474 -0.635 25342 195 1 . 1 1 36 36 VAL C C 36 171.482 171.482 174.947 -3.465 25342 196 1 . 1 1 36 36 VAL CA C 36 59.405 59.405 60.868 -1.463 25342 197 1 . 1 1 36 36 VAL CB C 36 29.348 29.348 34.464 -5.116 25342 198 1 . 1 1 36 36 VAL H H 36 8.660 8.660 8.687 -0.027 25342 199 1 . 1 1 37 37 LYS N N 37 126.065 126.065 121.732 4.333 25342 200 1 . 1 1 37 37 LYS HA H 37 4.965 4.965 4.630 0.335 25342 201 1 . 1 1 37 37 LYS C C 37 173.187 173.187 174.763 -1.576 25342 202 1 . 1 1 37 37 LYS CA C 37 52.280 52.280 54.817 -2.537 25342 203 1 . 1 1 37 37 LYS CB C 37 32.921 32.921 35.324 -2.403 25342 204 1 . 1 1 37 37 LYS H H 37 7.809 7.809 8.237 -0.428 25342 205 1 . 1 1 38 38 VAL N N 38 111.020 111.020 115.353 -4.333 25342 206 1 . 1 1 38 38 VAL HA H 38 4.824 4.824 4.784 0.040 25342 207 1 . 1 1 38 38 VAL C C 38 173.604 173.604 175.709 -2.105 25342 208 1 . 1 1 38 38 VAL CA C 38 56.383 56.383 59.253 -2.870 25342 209 1 . 1 1 38 38 VAL CB C 38 32.376 32.376 33.905 -1.529 25342 210 1 . 1 1 38 38 VAL H H 38 8.305 8.305 8.086 0.219 25342 211 1 . 1 1 39 39 SER N N 39 117.887 117.887 115.606 2.281 25342 212 1 . 1 1 39 39 SER HA H 39 4.183 4.183 4.434 -0.251 25342 213 1 . 1 1 39 39 SER C C 39 173.538 173.538 174.449 -0.911 25342 214 1 . 1 1 39 39 SER CA C 39 56.279 56.279 58.600 -2.321 25342 215 1 . 1 1 39 39 SER CB C 39 60.537 60.537 63.866 -3.329 25342 216 1 . 1 1 39 39 SER H H 39 8.847 8.847 8.423 0.424 25342 217 1 . 1 1 40 40 GLU N N 40 126.316 126.316 121.077 5.239 25342 218 1 . 1 1 40 40 GLU HA H 40 4.154 4.154 4.301 -0.147 25342 219 1 . 1 1 40 40 GLU C C 40 174.586 174.586 177.092 -2.506 25342 220 1 . 1 1 40 40 GLU CA C 40 55.812 55.812 56.973 -1.161 25342 221 1 . 1 1 40 40 GLU CB C 40 26.720 26.720 29.888 -3.168 25342 222 1 . 1 1 40 40 GLU H H 40 9.049 9.049 8.534 0.515 25342 223 1 . 1 1 41 41 GLY N N 41 112.494 112.494 112.386 0.108 25342 224 1 . 1 1 41 41 GLY C C 41 171.994 171.994 175.274 -3.280 25342 225 1 . 1 1 41 41 GLY CA C 41 42.462 42.462 45.837 -3.375 25342 226 1 . 1 1 41 41 GLY H H 41 8.780 8.780 8.797 -0.017 25342 227 1 . 1 1 42 42 THR N N 42 118.631 118.631 115.272 3.359 25342 228 1 . 1 1 42 42 THR HA H 42 3.582 3.582 3.894 -0.312 25342 229 1 . 1 1 42 42 THR C C 42 171.225 171.225 173.734 -2.509 25342 230 1 . 1 1 42 42 THR CA C 42 64.104 64.104 64.432 -0.328 25342 231 1 . 1 1 42 42 THR CB C 42 65.914 65.914 69.181 -3.267 25342 232 1 . 1 1 42 42 THR H H 42 7.737 7.737 7.870 -0.133 25342 233 1 . 1 1 43 43 PHE N N 43 116.279 116.279 115.546 0.733 25342 234 1 . 1 1 43 43 PHE HA H 43 5.020 5.020 4.682 0.338 25342 235 1 . 1 1 43 43 PHE C C 43 170.141 170.141 173.697 -3.556 25342 236 1 . 1 1 43 43 PHE CA C 43 52.472 52.472 56.394 -3.922 25342 237 1 . 1 1 43 43 PHE CB C 43 37.385 37.385 41.295 -3.910 25342 238 1 . 1 1 43 43 PHE H H 43 8.114 8.114 7.489 0.625 25342 239 1 . 1 1 44 44 ASP N N 44 121.513 121.513 119.750 1.763 25342 240 1 . 1 1 44 44 ASP HA H 44 4.851 4.851 4.917 -0.066 25342 241 1 . 1 1 44 44 ASP CA C 44 50.212 50.212 53.028 -2.816 25342 242 1 . 1 1 44 44 ASP CB C 44 44.385 44.385 43.578 0.807 25342 243 1 . 1 1 44 44 ASP H H 44 7.774 7.774 8.582 -0.808 25342 244 1 . 1 1 45 45 ALA N N 45 125.663 125.663 121.721 3.942 25342 245 1 . 1 1 45 45 ALA HA H 45 4.211 4.211 4.660 -0.449 25342 246 1 . 1 1 45 45 ALA C C 45 175.139 175.139 176.773 -1.634 25342 247 1 . 1 1 45 45 ALA CA C 45 51.436 51.436 52.431 -0.995 25342 248 1 . 1 1 45 45 ALA CB C 45 16.232 16.232 18.987 -2.755 25342 249 1 . 1 1 45 45 ALA H H 45 8.324 8.324 8.362 -0.038 25342 250 1 . 1 1 46 46 ASP N N 46 119.288 119.288 119.265 0.023 25342 251 1 . 1 1 46 46 ASP HA H 46 4.825 4.825 4.633 0.192 25342 252 1 . 1 1 46 46 ASP C C 46 175.013 175.013 176.816 -1.803 25342 253 1 . 1 1 46 46 ASP CA C 46 51.161 51.161 53.717 -2.556 25342 254 1 . 1 1 46 46 ASP CB C 46 41.233 41.233 42.322 -1.089 25342 255 1 . 1 1 46 46 ASP H H 46 9.618 9.618 7.973 1.645 25342 256 1 . 1 1 47 47 MET N N 47 127.347 127.347 118.349 8.998 25342 257 1 . 1 1 47 47 MET HA H 47 3.456 3.456 4.503 -1.047 25342 258 1 . 1 1 47 47 MET C C 47 173.605 173.605 176.555 -2.950 25342 259 1 . 1 1 47 47 MET CA C 47 56.699 56.699 57.344 -0.645 25342 260 1 . 1 1 47 47 MET CB C 47 29.930 29.930 33.869 -3.939 25342 261 1 . 1 1 47 47 MET H H 47 9.178 9.178 8.150 1.028 25342 262 1 . 1 1 48 48 TYR N N 48 121.040 121.040 116.494 4.546 25342 263 1 . 1 1 48 48 TYR HA H 48 3.872 3.872 4.630 -0.758 25342 264 1 . 1 1 48 48 TYR CA C 48 58.712 58.712 58.886 -0.174 25342 265 1 . 1 1 48 48 TYR CB C 48 33.638 33.638 37.595 -3.957 25342 266 1 . 1 1 48 48 TYR H H 48 7.881 7.881 7.992 -0.111 25342 267 1 . 1 1 49 49 LYS N N 49 121.754 121.754 120.529 1.225 25342 268 1 . 1 1 49 49 LYS HA H 49 4.105 4.105 4.087 0.018 25342 269 1 . 1 1 49 49 LYS CA C 49 56.385 56.385 59.588 -3.202 25342 270 1 . 1 1 49 49 LYS CB C 49 29.164 29.164 32.112 -2.948 25342 271 1 . 1 1 49 49 LYS H H 49 8.365 8.365 7.929 0.436 25342 272 1 . 1 1 50 50 THR N N 50 117.557 117.557 109.877 7.680 25342 273 1 . 1 1 50 50 THR HA H 50 3.586 3.586 4.135 -0.549 25342 274 1 . 1 1 50 50 THR CA C 50 65.634 65.634 65.405 0.229 25342 275 1 . 1 1 50 50 THR CB C 50 65.904 65.904 67.994 -2.090 25342 276 1 . 1 1 50 50 THR H H 50 8.007 8.007 8.181 -0.174 25342 277 1 . 1 1 51 51 SER N N 51 115.110 115.110 117.705 -2.595 25342 278 1 . 1 1 51 51 SER HA H 51 3.974 3.974 4.275 -0.301 25342 279 1 . 1 1 51 51 SER CA C 51 59.042 59.042 61.800 -2.758 25342 280 1 . 1 1 51 51 SER CB C 51 59.835 59.835 62.970 -3.135 25342 281 1 . 1 1 51 51 SER H H 51 7.606 7.606 8.019 -0.413 25342 282 1 . 1 1 52 52 ASP N N 52 119.713 119.713 121.936 -2.223 25342 283 1 . 1 1 52 52 ASP HA H 52 4.308 4.308 4.545 -0.237 25342 284 1 . 1 1 52 52 ASP CA C 52 54.526 54.526 56.958 -2.432 25342 285 1 . 1 1 52 52 ASP CB C 52 37.688 37.688 41.210 -3.522 25342 286 1 . 1 1 52 52 ASP H H 52 7.552 7.552 7.720 -0.168 25342 287 1 . 1 1 53 53 ILE N N 53 121.982 121.982 120.185 1.797 25342 288 1 . 1 1 53 53 ILE HA H 53 3.722 3.722 3.665 0.057 25342 289 1 . 1 1 53 53 ILE C C 53 175.325 175.325 177.907 -2.582 25342 290 1 . 1 1 53 53 ILE CA C 53 62.544 62.544 65.463 -2.919 25342 291 1 . 1 1 53 53 ILE CB C 53 36.699 36.699 37.918 -1.219 25342 292 1 . 1 1 53 53 ILE H H 53 7.815 7.815 7.786 0.029 25342 293 1 . 1 1 54 54 ALA N N 54 121.552 121.552 120.834 0.718 25342 294 1 . 1 1 54 54 ALA HA H 54 4.317 4.317 4.180 0.137 25342 295 1 . 1 1 54 54 ALA C C 54 177.475 177.475 179.029 -1.554 25342 296 1 . 1 1 54 54 ALA CA C 54 52.022 52.022 54.561 -2.539 25342 297 1 . 1 1 54 54 ALA CB C 54 15.984 15.984 18.642 -2.658 25342 298 1 . 1 1 54 54 ALA H H 54 8.332 8.332 7.788 0.544 25342 299 1 . 1 1 55 55 LEU N N 55 117.176 117.176 119.333 -2.157 25342 300 1 . 1 1 55 55 LEU HA H 55 3.934 3.934 4.033 -0.099 25342 301 1 . 1 1 55 55 LEU C C 55 176.532 176.532 178.204 -1.672 25342 302 1 . 1 1 55 55 LEU CA C 55 55.331 55.331 57.326 -1.995 25342 303 1 . 1 1 55 55 LEU CB C 55 38.428 38.428 41.828 -3.400 25342 304 1 . 1 1 55 55 LEU H H 55 8.195 8.195 7.730 0.465 25342 305 1 . 1 1 56 56 ASP N N 56 120.056 120.056 119.362 0.694 25342 306 1 . 1 1 56 56 ASP HA H 56 4.467 4.467 4.291 0.176 25342 307 1 . 1 1 56 56 ASP C C 56 176.585 176.585 178.405 -1.820 25342 308 1 . 1 1 56 56 ASP CA C 56 54.550 54.550 57.556 -3.006 25342 309 1 . 1 1 56 56 ASP CB C 56 38.305 38.305 40.581 -2.276 25342 310 1 . 1 1 56 56 ASP H H 56 7.806 7.806 8.311 -0.505 25342 311 1 . 1 1 57 57 GLN N N 57 120.020 120.020 116.781 3.239 25342 312 1 . 1 1 57 57 GLN HA H 57 4.123 4.123 4.277 -0.154 25342 313 1 . 1 1 57 57 GLN C C 57 175.689 175.689 177.348 -1.659 25342 314 1 . 1 1 57 57 GLN CA C 57 54.405 54.405 57.126 -2.721 25342 315 1 . 1 1 57 57 GLN CB C 57 23.769 23.769 28.814 -5.045 25342 316 1 . 1 1 57 57 GLN H H 57 7.661 7.661 7.625 0.036 25342 317 1 . 1 1 58 58 ILE N N 58 120.644 120.644 119.449 1.195 25342 318 1 . 1 1 58 58 ILE HA H 58 3.576 3.576 4.027 -0.451 25342 319 1 . 1 1 58 58 ILE C C 58 176.237 176.237 177.422 -1.184 25342 320 1 . 1 1 58 58 ILE CA C 58 62.506 62.506 62.982 -0.476 25342 321 1 . 1 1 58 58 ILE CB C 58 36.029 36.029 38.775 -2.746 25342 322 1 . 1 1 58 58 ILE H H 58 8.228 8.228 7.745 0.483 25342 323 1 . 1 1 59 59 GLN N N 59 115.498 115.498 118.276 -2.778 25342 324 1 . 1 1 59 59 GLN HA H 59 4.142 4.142 4.217 -0.074 25342 325 1 . 1 1 59 59 GLN C C 59 173.781 173.781 176.933 -3.151 25342 326 1 . 1 1 59 59 GLN CA C 59 53.982 53.982 57.044 -3.062 25342 327 1 . 1 1 59 59 GLN CB C 59 26.611 26.611 29.234 -2.623 25342 328 1 . 1 1 59 59 GLN H H 59 8.331 8.331 8.224 0.107 25342 329 1 . 1 1 60 60 GLY N N 60 106.623 106.623 106.026 0.597 25342 330 1 . 1 1 60 60 GLY C C 60 172.068 172.068 175.074 -3.006 25342 331 1 . 1 1 60 60 GLY CA C 60 42.873 42.873 45.347 -2.474 25342 332 1 . 1 1 60 60 GLY H H 60 7.611 7.611 8.143 -0.532 25342 333 1 . 1 1 61 61 ASN N N 61 117.691 117.691 118.068 -0.377 25342 334 1 . 1 1 61 61 ASN HA H 61 4.544 4.544 4.659 -0.115 25342 335 1 . 1 1 61 61 ASN C C 61 171.946 171.946 175.789 -3.843 25342 336 1 . 1 1 61 61 ASN CA C 61 51.569 51.569 54.276 -2.707 25342 337 1 . 1 1 61 61 ASN CB C 61 36.360 36.360 39.062 -2.702 25342 338 1 . 1 1 61 61 ASN H H 61 8.151 8.151 8.299 -0.148 25342 339 1 . 1 1 62 62 LYS N N 62 118.289 118.289 119.123 -0.834 25342 340 1 . 1 1 62 62 LYS HA H 62 4.328 4.328 4.589 -0.261 25342 341 1 . 1 1 62 62 LYS C C 62 171.773 171.773 174.979 -3.206 25342 342 1 . 1 1 62 62 LYS CA C 62 51.296 51.296 54.611 -3.315 25342 343 1 . 1 1 62 62 LYS CB C 62 34.683 34.683 35.105 -0.422 25342 344 1 . 1 1 62 62 LYS H H 62 7.242 7.242 7.764 -0.521 25342 345 1 . 1 1 63 63 ASP N N 63 119.888 119.888 119.516 0.372 25342 346 1 . 1 1 63 63 ASP HA H 63 4.416 4.416 4.483 -0.067 25342 347 1 . 1 1 63 63 ASP C C 63 174.476 174.476 175.702 -1.226 25342 348 1 . 1 1 63 63 ASP CA C 63 51.461 51.461 53.391 -1.930 25342 349 1 . 1 1 63 63 ASP CB C 63 38.515 38.515 41.742 -3.227 25342 350 1 . 1 1 63 63 ASP H H 63 8.230 8.230 8.248 -0.019 25342 351 1 . 1 1 64 64 PHE N N 64 119.789 119.789 115.751 4.038 25342 352 1 . 1 1 64 64 PHE HA H 64 3.816 3.816 4.734 -0.918 25342 353 1 . 1 1 64 64 PHE CA C 64 56.250 56.250 54.738 1.512 25342 354 1 . 1 1 64 64 PHE CB C 64 35.034 35.034 38.309 -3.275 25342 355 1 . 1 1 64 64 PHE H H 64 8.428 8.428 7.554 0.874 25342 356 1 . 1 1 65 65 PRO HA H 65 4.313 4.313 4.541 -0.228 25342 357 1 . 1 1 65 65 PRO C C 65 173.975 173.975 175.970 -1.995 25342 358 1 . 1 1 65 65 PRO CA C 65 60.056 60.056 62.623 -2.567 25342 359 1 . 1 1 65 65 PRO CB C 65 29.520 29.520 32.742 -3.222 25342 360 1 . 1 1 66 66 GLU N N 66 121.326 121.326 119.856 1.470 25342 361 1 . 1 1 66 66 GLU HA H 66 4.233 4.233 4.529 -0.296 25342 362 1 . 1 1 66 66 GLU C C 66 173.978 173.978 175.736 -1.758 25342 363 1 . 1 1 66 66 GLU CA C 66 53.531 53.531 55.690 -2.159 25342 364 1 . 1 1 66 66 GLU CB C 66 27.700 27.700 31.438 -3.738 25342 365 1 . 1 1 66 66 GLU H H 66 8.225 8.225 8.522 -0.297 25342 366 1 . 1 1 67 67 ILE N N 67 113.897 113.897 115.585 -1.688 25342 367 1 . 1 1 67 67 ILE HA H 67 5.169 5.169 4.765 0.404 25342 368 1 . 1 1 67 67 ILE C C 67 172.791 172.791 175.640 -2.849 25342 369 1 . 1 1 67 67 ILE CA C 67 56.275 56.275 59.238 -2.963 25342 370 1 . 1 1 67 67 ILE CB C 67 39.016 39.016 41.001 -1.985 25342 371 1 . 1 1 67 67 ILE H H 67 8.366 8.366 8.181 0.185 25342 372 1 . 1 1 68 68 GLN N N 68 121.654 121.654 121.172 0.482 25342 373 1 . 1 1 68 68 GLN HA H 68 4.519 4.519 4.570 -0.051 25342 374 1 . 1 1 68 68 GLN C C 68 171.562 171.562 174.691 -3.129 25342 375 1 . 1 1 68 68 GLN CA C 68 52.313 52.313 54.806 -2.493 25342 376 1 . 1 1 68 68 GLN CB C 68 26.785 26.785 28.869 -2.084 25342 377 1 . 1 1 68 68 GLN H H 68 8.763 8.763 8.478 0.285 25342 378 1 . 1 1 69 69 LEU N N 69 125.289 125.289 121.272 4.017 25342 379 1 . 1 1 69 69 LEU HA H 69 4.519 4.519 4.540 -0.021 25342 380 1 . 1 1 69 69 LEU C C 69 172.567 172.567 176.069 -3.502 25342 381 1 . 1 1 69 69 LEU CA C 69 51.797 51.797 54.546 -2.749 25342 382 1 . 1 1 69 69 LEU CB C 69 42.742 42.742 43.693 -0.951 25342 383 1 . 1 1 69 69 LEU H H 69 7.996 7.996 7.764 0.232 25342 384 1 . 1 1 70 70 ASP N N 70 123.170 123.170 121.662 1.508 25342 385 1 . 1 1 70 70 ASP HA H 70 4.406 4.406 4.712 -0.306 25342 386 1 . 1 1 70 70 ASP C C 70 171.978 171.978 175.240 -3.262 25342 387 1 . 1 1 70 70 ASP CA C 70 51.682 51.682 53.934 -2.252 25342 388 1 . 1 1 70 70 ASP CB C 70 38.729 38.729 42.079 -3.351 25342 389 1 . 1 1 70 70 ASP H H 70 8.278 8.278 8.393 -0.115 25342 390 1 . 1 1 71 71 ASN N N 71 117.524 117.524 118.667 -1.143 25342 391 1 . 1 1 71 71 ASN HA H 71 4.327 4.327 4.692 -0.365 25342 392 1 . 1 1 71 71 ASN C C 71 171.825 171.825 174.519 -2.694 25342 393 1 . 1 1 71 71 ASN CA C 71 51.657 51.657 53.342 -1.685 25342 394 1 . 1 1 71 71 ASN CB C 71 35.230 35.230 38.871 -3.641 25342 395 1 . 1 1 71 71 ASN H H 71 8.372 8.372 8.443 -0.071 25342 396 1 . 1 1 72 72 ILE N N 72 124.515 124.515 123.804 0.711 25342 397 1 . 1 1 72 72 ILE HA H 72 3.929 3.929 4.123 -0.194 25342 398 1 . 1 1 72 72 ILE C C 72 171.607 171.607 174.237 -2.630 25342 399 1 . 1 1 72 72 ILE CA C 72 57.289 57.289 59.977 -2.688 25342 400 1 . 1 1 72 72 ILE CB C 72 38.760 38.760 41.367 -2.608 25342 401 1 . 1 1 72 72 ILE H H 72 7.653 7.653 8.073 -0.420 25342 402 1 . 1 1 73 73 ASP N N 73 125.182 125.182 125.867 -0.685 25342 403 1 . 1 1 73 73 ASP HA H 73 4.628 4.628 4.539 0.089 25342 404 1 . 1 1 73 73 ASP C C 73 173.980 173.980 176.029 -2.049 25342 405 1 . 1 1 73 73 ASP CA C 73 49.214 49.214 54.039 -4.825 25342 406 1 . 1 1 73 73 ASP CB C 73 36.902 36.902 40.768 -3.866 25342 407 1 . 1 1 73 73 ASP H H 73 8.382 8.382 8.548 -0.166 25342 408 1 . 1 1 74 74 TYR N N 74 123.092 123.092 123.530 -0.438 25342 409 1 . 1 1 74 74 TYR HA H 74 3.865 3.865 4.594 -0.729 25342 410 1 . 1 1 74 74 TYR C C 74 173.582 173.582 176.764 -3.182 25342 411 1 . 1 1 74 74 TYR CA C 74 59.486 59.486 58.350 1.136 25342 412 1 . 1 1 74 74 TYR CB C 74 34.808 34.808 38.043 -3.235 25342 413 1 . 1 1 74 74 TYR H H 74 7.348 7.348 8.136 -0.788 25342 414 1 . 1 1 75 75 ASN N N 75 109.447 109.447 117.507 -8.060 25342 415 1 . 1 1 75 75 ASN HA H 75 4.925 4.925 4.727 0.198 25342 416 1 . 1 1 75 75 ASN C C 75 172.570 172.570 175.628 -3.058 25342 417 1 . 1 1 75 75 ASN CA C 75 52.618 52.618 54.886 -2.268 25342 418 1 . 1 1 75 75 ASN CB C 75 35.534 35.534 38.581 -3.047 25342 419 1 . 1 1 75 75 ASN H H 75 8.040 8.040 8.374 -0.334 25342 420 1 . 1 1 76 76 ASN N N 76 117.411 117.411 116.092 1.319 25342 421 1 . 1 1 76 76 ASN HA H 76 4.454 4.454 4.638 -0.184 25342 422 1 . 1 1 76 76 ASN C C 76 171.155 171.155 174.577 -3.422 25342 423 1 . 1 1 76 76 ASN CA C 76 50.934 50.934 53.459 -2.525 25342 424 1 . 1 1 76 76 ASN CB C 76 35.658 35.658 38.849 -3.191 25342 425 1 . 1 1 76 76 ASN H H 76 7.750 7.750 7.949 -0.199 25342 426 1 . 1 1 77 77 TYR N N 77 116.878 116.878 118.971 -2.093 25342 427 1 . 1 1 77 77 TYR HA H 77 4.354 4.354 4.600 -0.246 25342 428 1 . 1 1 77 77 TYR C C 77 172.224 172.224 175.206 -2.982 25342 429 1 . 1 1 77 77 TYR CA C 77 55.240 55.240 58.107 -2.867 25342 430 1 . 1 1 77 77 TYR CB C 77 37.113 37.113 39.941 -2.828 25342 431 1 . 1 1 77 77 TYR H H 77 7.789 7.789 7.600 0.189 25342 432 1 . 1 1 78 78 ASP N N 78 121.352 121.352 122.053 -0.701 25342 433 1 . 1 1 78 78 ASP HA H 78 4.797 4.797 4.687 0.110 25342 434 1 . 1 1 78 78 ASP C C 78 172.623 172.623 175.528 -2.905 25342 435 1 . 1 1 78 78 ASP CA C 78 53.190 53.190 56.020 -2.830 25342 436 1 . 1 1 78 78 ASP CB C 78 41.035 41.035 42.726 -1.691 25342 437 1 . 1 1 78 78 ASP H H 78 9.036 9.036 8.722 0.314 25342 438 1 . 1 1 79 79 LEU N N 79 123.073 123.073 117.879 5.195 25342 439 1 . 1 1 79 79 LEU HA H 79 5.108 5.108 5.282 -0.174 25342 440 1 . 1 1 79 79 LEU C C 79 170.730 170.730 174.476 -3.746 25342 441 1 . 1 1 79 79 LEU CA C 79 51.257 51.257 54.029 -2.772 25342 442 1 . 1 1 79 79 LEU CB C 79 42.284 42.284 46.125 -3.841 25342 443 1 . 1 1 79 79 LEU H H 79 7.877 7.877 7.900 -0.023 25342 444 1 . 1 1 80 80 ILE N N 80 126.348 126.348 123.322 3.026 25342 445 1 . 1 1 80 80 ILE HA H 80 5.069 5.069 4.803 0.266 25342 446 1 . 1 1 80 80 ILE C C 80 171.584 171.584 174.410 -2.826 25342 447 1 . 1 1 80 80 ILE CA C 80 57.415 57.415 60.078 -2.663 25342 448 1 . 1 1 80 80 ILE CB C 80 37.998 37.998 40.591 -2.593 25342 449 1 . 1 1 80 80 ILE H H 80 8.704 8.704 8.570 0.134 25342 450 1 . 1 1 81 81 LEU N N 81 126.303 126.303 127.616 -1.313 25342 451 1 . 1 1 81 81 LEU HA H 81 5.123 5.123 4.849 0.274 25342 452 1 . 1 1 81 81 LEU C C 81 172.779 172.779 175.538 -2.759 25342 453 1 . 1 1 81 81 LEU CA C 81 49.509 49.509 54.213 -4.704 25342 454 1 . 1 1 81 81 LEU CB C 81 41.715 41.715 44.050 -2.335 25342 455 1 . 1 1 81 81 LEU H H 81 9.202 9.202 8.551 0.651 25342 456 1 . 1 1 82 82 ILE N N 82 120.931 120.931 121.077 -0.146 25342 457 1 . 1 1 82 82 ILE HA H 82 4.847 4.847 4.988 -0.141 25342 458 1 . 1 1 82 82 ILE C C 82 172.796 172.796 174.717 -1.921 25342 459 1 . 1 1 82 82 ILE CA C 82 56.881 56.881 59.708 -2.827 25342 460 1 . 1 1 82 82 ILE CB C 82 37.797 37.797 42.147 -4.350 25342 461 1 . 1 1 82 82 ILE H H 82 8.846 8.846 8.468 0.378 25342 462 1 . 1 1 83 83 GLY N N 83 120.905 120.905 111.529 9.376 25342 463 1 . 1 1 83 83 GLY CA C 83 40.557 40.557 43.379 -2.822 25342 464 1 . 1 1 83 83 GLY H H 83 9.558 9.558 8.213 1.345 25342 465 1 . 1 1 84 84 SER N N 84 116.601 116.601 114.860 1.741 25342 466 1 . 1 1 84 84 SER HA H 84 5.476 5.476 5.066 0.411 25342 467 1 . 1 1 84 84 SER CA C 84 51.324 51.324 55.795 -4.471 25342 468 1 . 1 1 84 84 SER CB C 84 64.271 64.271 64.730 -0.459 25342 469 1 . 1 1 84 84 SER H H 84 7.533 7.533 7.734 -0.201 25342 470 1 . 1 1 85 85 PRO HA H 85 5.163 5.163 4.449 0.714 25342 471 1 . 1 1 85 85 PRO C C 85 175.590 175.590 176.251 -0.661 25342 472 1 . 1 1 85 85 PRO CA C 85 58.883 58.883 62.475 -3.592 25342 473 1 . 1 1 85 85 PRO CB C 85 30.474 30.474 32.407 -1.933 25342 474 1 . 1 1 86 86 VAL N N 86 116.295 116.295 119.087 -2.792 25342 475 1 . 1 1 86 86 VAL HA H 86 3.821 3.821 4.297 -0.476 25342 476 1 . 1 1 86 86 VAL C C 86 172.692 172.692 175.568 -2.876 25342 477 1 . 1 1 86 86 VAL CA C 86 59.812 59.812 61.804 -1.992 25342 478 1 . 1 1 86 86 VAL CB C 86 30.083 30.083 32.970 -2.887 25342 479 1 . 1 1 86 86 VAL H H 86 7.246 7.246 7.870 -0.623 25342 480 1 . 1 1 87 87 TRP N N 87 131.042 131.042 126.507 4.535 25342 481 1 . 1 1 87 87 TRP HA H 87 4.311 4.311 4.637 -0.326 25342 482 1 . 1 1 87 87 TRP C C 87 173.323 173.323 176.659 -3.336 25342 483 1 . 1 1 87 87 TRP CA C 87 50.887 50.887 56.459 -5.572 25342 484 1 . 1 1 87 87 TRP CB C 87 27.310 27.310 31.686 -4.376 25342 485 1 . 1 1 87 87 TRP H H 87 9.555 9.555 8.358 1.197 25342 486 1 . 1 1 88 88 SER N N 88 122.660 122.660 116.627 6.033 25342 487 1 . 1 1 88 88 SER HA H 88 4.582 4.582 4.212 0.370 25342 488 1 . 1 1 88 88 SER C C 88 172.096 172.096 175.044 -2.948 25342 489 1 . 1 1 88 88 SER CA C 88 55.391 55.391 60.047 -4.657 25342 490 1 . 1 1 88 88 SER CB C 88 57.813 57.813 61.994 -4.181 25342 491 1 . 1 1 88 88 SER H H 88 10.257 10.257 8.916 1.341 25342 492 1 . 1 1 89 89 GLY N N 89 128.381 128.381 110.909 17.472 25342 493 1 . 1 1 89 89 GLY CA C 89 42.629 42.629 45.247 -2.618 25342 494 1 . 1 1 89 89 GLY H H 89 6.372 6.372 8.281 -1.909 25342 495 1 . 1 1 90 90 TYR N N 90 120.345 120.345 117.715 2.630 25342 496 1 . 1 1 90 90 TYR HA H 90 4.189 4.189 4.954 -0.765 25342 497 1 . 1 1 90 90 TYR CA C 90 53.549 53.549 53.926 -0.377 25342 498 1 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.815 -1.620 25342 499 1 . 1 1 90 90 TYR H H 90 8.113 8.113 7.301 0.812 25342 500 1 . 1 1 91 91 PRO HA H 91 4.834 4.834 4.634 0.200 25342 501 1 . 1 1 91 91 PRO C C 91 170.911 170.911 177.031 -6.120 25342 502 1 . 1 1 91 91 PRO CA C 91 58.835 58.835 62.437 -3.602 25342 503 1 . 1 1 91 91 PRO CB C 91 26.070 26.070 32.566 -6.496 25342 504 1 . 1 1 92 92 ALA N N 92 120.629 120.629 123.256 -2.627 25342 505 1 . 1 1 92 92 ALA HA H 92 3.619 3.619 3.775 -0.156 25342 506 1 . 1 1 92 92 ALA C C 92 176.782 176.782 176.667 0.115 25342 507 1 . 1 1 92 92 ALA CA C 92 49.417 49.417 51.148 -1.731 25342 508 1 . 1 1 92 92 ALA CB C 92 15.516 15.516 17.184 -1.668 25342 509 1 . 1 1 92 92 ALA H H 92 7.554 7.554 8.634 -1.080 25342 510 1 . 1 1 93 93 THR N N 93 112.558 112.558 110.031 2.527 25342 511 1 . 1 1 93 93 THR CB C 93 64.173 64.173 67.440 -3.267 25342 512 1 . 1 1 93 93 THR H H 93 6.730 6.730 7.725 -0.995 25342 513 1 . 1 1 94 94 PRO HA H 94 3.859 3.859 4.454 -0.595 25342 514 1 . 1 1 94 94 PRO C C 94 173.309 173.309 177.151 -3.842 25342 515 1 . 1 1 94 94 PRO CA C 94 63.063 63.063 64.550 -1.487 25342 516 1 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.109 -2.830 25342 517 1 . 1 1 95 95 ILE N N 95 111.014 111.014 117.109 -6.095 25342 518 1 . 1 1 95 95 ILE HA H 95 3.605 3.605 4.224 -0.619 25342 519 1 . 1 1 95 95 ILE C C 95 174.302 174.302 177.249 -2.947 25342 520 1 . 1 1 95 95 ILE CA C 95 57.181 57.181 60.214 -3.033 25342 521 1 . 1 1 95 95 ILE CB C 95 31.783 31.783 36.703 -4.920 25342 522 1 . 1 1 95 95 ILE H H 95 7.995 7.995 8.134 -0.139 25342 523 1 . 1 1 96 96 LYS N N 96 123.208 123.208 122.217 0.991 25342 524 1 . 1 1 96 96 LYS HA H 96 3.092 3.092 4.043 -0.951 25342 525 1 . 1 1 96 96 LYS C C 96 174.451 174.451 178.318 -3.867 25342 526 1 . 1 1 96 96 LYS CA C 96 57.041 57.041 59.444 -2.403 25342 527 1 . 1 1 96 96 LYS CB C 96 28.747 28.747 31.897 -3.150 25342 528 1 . 1 1 96 96 LYS H H 96 6.928 6.928 7.786 -0.858 25342 529 1 . 1 1 97 97 THR N N 97 113.320 113.320 114.464 -1.144 25342 530 1 . 1 1 97 97 THR HA H 97 3.436 3.436 3.823 -0.387 25342 531 1 . 1 1 97 97 THR C C 97 173.221 173.221 176.302 -3.081 25342 532 1 . 1 1 97 97 THR CA C 97 62.710 62.710 65.554 -2.844 25342 533 1 . 1 1 97 97 THR CB C 97 65.562 65.562 68.510 -2.948 25342 534 1 . 1 1 97 97 THR H H 97 6.325 6.325 7.936 -1.611 25342 535 1 . 1 1 98 98 LEU N N 98 120.963 120.963 122.306 -1.343 25342 536 1 . 1 1 98 98 LEU HA H 98 3.625 3.625 4.148 -0.523 25342 537 1 . 1 1 98 98 LEU C C 98 174.713 174.713 178.036 -3.323 25342 538 1 . 1 1 98 98 LEU CA C 98 55.514 55.514 57.463 -1.949 25342 539 1 . 1 1 98 98 LEU CB C 98 39.728 39.728 41.843 -2.114 25342 540 1 . 1 1 98 98 LEU H H 98 7.536 7.536 7.605 -0.069 25342 541 1 . 1 1 99 99 LEU N N 99 118.859 118.859 118.653 0.206 25342 542 1 . 1 1 99 99 LEU HA H 99 3.672 3.672 3.863 -0.191 25342 543 1 . 1 1 99 99 LEU C C 99 177.458 177.458 178.603 -1.145 25342 544 1 . 1 1 99 99 LEU CA C 99 55.145 55.145 58.209 -3.064 25342 545 1 . 1 1 99 99 LEU CB C 99 38.857 38.857 41.119 -2.262 25342 546 1 . 1 1 99 99 LEU H H 99 8.179 8.179 8.206 -0.027 25342 547 1 . 1 1 100 100 ASP N N 100 118.703 118.703 117.907 0.796 25342 548 1 . 1 1 100 100 ASP HA H 100 4.221 4.221 4.335 -0.114 25342 549 1 . 1 1 100 100 ASP C C 100 176.472 176.472 178.293 -1.821 25342 550 1 . 1 1 100 100 ASP CA C 100 54.307 54.307 57.081 -2.774 25342 551 1 . 1 1 100 100 ASP CB C 100 37.358 37.358 40.835 -3.477 25342 552 1 . 1 1 100 100 ASP H H 100 7.867 7.867 7.903 -0.036 25342 553 1 . 1 1 101 101 GLN N N 101 117.829 117.829 117.169 0.660 25342 554 1 . 1 1 101 101 GLN HA H 101 4.200 4.200 4.246 -0.046 25342 555 1 . 1 1 101 101 GLN C C 101 174.508 174.508 177.584 -3.076 25342 556 1 . 1 1 101 101 GLN CA C 101 54.688 54.688 57.617 -2.929 25342 557 1 . 1 1 101 101 GLN CB C 101 25.597 25.597 29.151 -3.554 25342 558 1 . 1 1 101 101 GLN H H 101 7.597 7.597 7.649 -0.052 25342 559 1 . 1 1 102 102 MET N N 102 118.406 118.406 115.015 3.391 25342 560 1 . 1 1 102 102 MET HA H 102 3.864 3.864 4.774 -0.910 25342 561 1 . 1 1 102 102 MET C C 102 172.820 172.820 176.998 -4.178 25342 562 1 . 1 1 102 102 MET CA C 102 53.298 53.298 56.101 -2.803 25342 563 1 . 1 1 102 102 MET CB C 102 31.207 31.207 32.743 -1.536 25342 564 1 . 1 1 102 102 MET H H 102 7.434 7.434 7.907 -0.473 25342 565 1 . 1 1 103 103 LYS N N 103 115.889 115.889 121.016 -5.127 25342 566 1 . 1 1 103 103 LYS HA H 103 3.919 3.919 4.019 -0.100 25342 567 1 . 1 1 103 103 LYS C C 103 173.938 173.938 177.418 -3.480 25342 568 1 . 1 1 103 103 LYS CA C 103 56.437 56.437 58.915 -2.478 25342 569 1 . 1 1 103 103 LYS CB C 103 29.263 29.263 31.782 -2.519 25342 570 1 . 1 1 103 103 LYS H H 103 6.881 6.881 7.859 -0.978 25342 571 1 . 1 1 104 104 ASN N N 104 114.951 114.951 114.984 -0.034 25342 572 1 . 1 1 104 104 ASN HA H 104 4.731 4.731 4.705 0.026 25342 573 1 . 1 1 104 104 ASN C C 104 172.617 172.617 175.410 -2.793 25342 574 1 . 1 1 104 104 ASN CA C 104 50.266 50.266 53.418 -3.152 25342 575 1 . 1 1 104 104 ASN CB C 104 35.783 35.783 38.828 -3.045 25342 576 1 . 1 1 104 104 ASN H H 104 8.493 8.493 8.119 0.374 25342 577 1 . 1 1 105 105 TYR N N 105 122.680 122.680 121.778 0.902 25342 578 1 . 1 1 105 105 TYR HA H 105 4.562 4.562 4.477 0.085 25342 579 1 . 1 1 105 105 TYR CA C 105 55.433 55.433 58.805 -3.372 25342 580 1 . 1 1 105 105 TYR CB C 105 35.832 35.832 39.269 -3.437 25342 581 1 . 1 1 105 105 TYR H H 105 8.217 8.217 7.849 0.368 25342 582 1 . 1 1 106 106 ARG N N 106 128.872 128.872 123.177 5.695 25342 583 1 . 1 1 106 106 ARG HA H 106 4.265 4.265 4.311 -0.046 25342 584 1 . 1 1 106 106 ARG CA C 106 52.982 52.982 55.069 -2.087 25342 585 1 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.591 -4.461 25342 586 1 . 1 1 106 106 ARG H H 106 8.801 8.801 8.219 0.582 25342 587 1 . 1 1 107 107 GLY CA C 107 42.401 42.401 44.618 -2.217 25342 588 1 . 1 1 108 108 GLU N N 108 117.000 117.000 120.987 -3.987 25342 589 1 . 1 1 108 108 GLU HA H 108 4.626 4.626 4.772 -0.146 25342 590 1 . 1 1 108 108 GLU C C 108 174.125 174.125 175.495 -1.370 25342 591 1 . 1 1 108 108 GLU CA C 108 53.788 53.788 55.776 -1.988 25342 592 1 . 1 1 108 108 GLU CB C 108 30.440 30.440 32.438 -1.998 25342 593 1 . 1 1 108 108 GLU H H 108 7.514 7.514 8.346 -0.832 25342 594 1 . 1 1 109 109 VAL N N 109 123.398 123.398 121.685 1.713 25342 595 1 . 1 1 109 109 VAL HA H 109 5.337 5.337 5.000 0.337 25342 596 1 . 1 1 109 109 VAL C C 109 170.606 170.606 174.007 -3.401 25342 597 1 . 1 1 109 109 VAL CA C 109 57.280 57.280 60.741 -3.461 25342 598 1 . 1 1 109 109 VAL CB C 109 32.657 32.657 35.140 -2.483 25342 599 1 . 1 1 109 109 VAL H H 109 8.942 8.942 8.320 0.622 25342 600 1 . 1 1 110 110 ALA N N 110 127.905 127.905 128.141 -0.236 25342 601 1 . 1 1 110 110 ALA HA H 110 4.627 4.627 4.874 -0.247 25342 602 1 . 1 1 110 110 ALA C C 110 173.195 173.195 175.246 -2.051 25342 603 1 . 1 1 110 110 ALA CA C 110 47.346 47.346 49.675 -2.329 25342 604 1 . 1 1 110 110 ALA CB C 110 18.325 18.325 21.817 -3.492 25342 605 1 . 1 1 110 110 ALA H H 110 8.776 8.776 8.305 0.471 25342 606 1 . 1 1 111 111 SER N N 111 110.523 110.523 115.259 -4.736 25342 607 1 . 1 1 111 111 SER HA H 111 5.562 5.562 5.148 0.414 25342 608 1 . 1 1 111 111 SER C C 111 170.719 170.719 173.149 -2.429 25342 609 1 . 1 1 111 111 SER CA C 111 51.314 51.314 56.504 -5.190 25342 610 1 . 1 1 111 111 SER CB C 111 61.907 61.907 64.256 -2.349 25342 611 1 . 1 1 111 111 SER H H 111 7.480 7.480 7.940 -0.460 25342 612 1 . 1 1 112 112 PHE N N 112 125.567 125.567 122.424 3.143 25342 613 1 . 1 1 112 112 PHE HA H 112 6.356 6.356 5.609 0.747 25342 614 1 . 1 1 112 112 PHE C C 112 169.536 169.536 173.697 -4.161 25342 615 1 . 1 1 112 112 PHE CA C 112 50.371 50.371 55.649 -5.278 25342 616 1 . 1 1 112 112 PHE CB C 112 39.788 39.788 41.409 -1.621 25342 617 1 . 1 1 112 112 PHE H H 112 7.848 7.848 8.128 -0.280 25342 618 1 . 1 1 113 113 PHE N N 113 115.065 115.065 116.116 -1.051 25342 619 1 . 1 1 113 113 PHE HA H 113 6.104 6.104 5.233 0.871 25342 620 1 . 1 1 113 113 PHE C C 113 173.006 173.006 174.588 -1.582 25342 621 1 . 1 1 113 113 PHE CA C 113 50.262 50.262 55.997 -5.735 25342 622 1 . 1 1 113 113 PHE CB C 113 38.749 38.749 42.405 -3.656 25342 623 1 . 1 1 113 113 PHE H H 113 7.361 7.361 8.214 -0.853 25342 624 1 . 1 1 114 114 THR N N 114 108.014 108.014 112.231 -4.217 25342 625 1 . 1 1 114 114 THR HA H 114 4.999 4.999 4.689 0.310 25342 626 1 . 1 1 114 114 THR C C 114 169.874 169.874 173.697 -3.823 25342 627 1 . 1 1 114 114 THR CA C 114 56.500 56.500 60.830 -4.330 25342 628 1 . 1 1 114 114 THR CB C 114 68.809 68.809 70.226 -1.417 25342 629 1 . 1 1 114 114 THR H H 114 7.867 7.867 8.343 -0.476 25342 630 1 . 1 1 115 115 SER N N 115 115.049 115.049 118.819 -3.770 25342 631 1 . 1 1 115 115 SER HA H 115 5.613 5.613 4.454 1.159 25342 632 1 . 1 1 115 115 SER C C 115 171.247 171.247 174.701 -3.454 25342 633 1 . 1 1 115 115 SER CA C 115 54.830 54.830 57.542 -2.712 25342 634 1 . 1 1 115 115 SER CB C 115 63.992 63.992 64.743 -0.751 25342 635 1 . 1 1 115 115 SER H H 115 8.970 8.970 8.092 0.878 25342 636 1 . 1 1 116 116 ALA N N 116 122.671 122.671 123.755 -1.084 25342 637 1 . 1 1 116 116 ALA HA H 116 4.985 4.985 4.394 0.591 25342 638 1 . 1 1 116 116 ALA C C 116 176.180 176.180 177.723 -1.543 25342 639 1 . 1 1 116 116 ALA CA C 116 49.200 49.200 51.798 -2.598 25342 640 1 . 1 1 116 116 ALA CB C 116 15.995 15.995 17.998 -2.003 25342 641 1 . 1 1 116 116 ALA H H 116 8.963 8.963 8.695 0.268 25342 642 1 . 1 1 117 117 GLY N N 117 107.387 107.387 107.342 0.045 25342 643 1 . 1 1 117 117 GLY C C 117 172.528 172.528 174.097 -1.569 25342 644 1 . 1 1 117 117 GLY CA C 117 43.732 43.732 45.415 -1.683 25342 645 1 . 1 1 117 117 GLY H H 117 9.340 9.340 8.083 1.257 25342 646 1 . 1 1 118 118 THR N N 118 113.481 113.481 111.303 2.178 25342 647 1 . 1 1 118 118 THR HA H 118 4.651 4.651 4.496 0.155 25342 648 1 . 1 1 118 118 THR C C 118 172.067 172.067 174.217 -2.150 25342 649 1 . 1 1 118 118 THR CA C 118 57.357 57.357 60.337 -2.979 25342 650 1 . 1 1 118 118 THR CB C 118 69.475 69.475 70.578 -1.104 25342 651 1 . 1 1 118 118 THR H H 118 9.373 9.373 7.472 1.901 25342 652 1 . 1 1 119 119 ASN N N 119 113.202 113.202 117.113 -3.911 25342 653 1 . 1 1 119 119 ASN HA H 119 4.618 4.618 4.296 0.322 25342 654 1 . 1 1 119 119 ASN C C 119 173.114 173.114 176.053 -2.939 25342 655 1 . 1 1 119 119 ASN CA C 119 51.684 51.684 54.356 -2.673 25342 656 1 . 1 1 119 119 ASN CB C 119 33.730 33.730 37.088 -3.358 25342 657 1 . 1 1 119 119 ASN H H 119 8.908 8.908 8.853 0.055 25342 658 1 . 1 1 120 120 HIS N N 120 117.315 117.315 117.156 0.159 25342 659 1 . 1 1 120 120 HIS HA H 120 3.786 3.786 4.269 -0.483 25342 660 1 . 1 1 120 120 HIS C C 120 174.381 174.381 176.475 -2.094 25342 661 1 . 1 1 120 120 HIS CA C 120 54.516 54.516 58.903 -4.387 25342 662 1 . 1 1 120 120 HIS CB C 120 26.504 26.504 29.719 -3.215 25342 663 1 . 1 1 120 120 HIS H H 120 8.074 8.074 8.476 -0.402 25342 664 1 . 1 1 121 121 LYS N N 121 118.678 118.678 119.075 -0.397 25342 665 1 . 1 1 121 121 LYS HA H 121 3.834 3.834 3.950 -0.116 25342 666 1 . 1 1 121 121 LYS C C 121 176.564 176.564 178.272 -1.708 25342 667 1 . 1 1 121 121 LYS CA C 121 57.295 57.295 58.700 -1.405 25342 668 1 . 1 1 121 121 LYS CB C 121 28.942 28.942 31.943 -3.001 25342 669 1 . 1 1 121 121 LYS H H 121 8.336 8.336 8.002 0.334 25342 670 1 . 1 1 122 122 ALA N N 122 122.146 122.146 122.285 -0.139 25342 671 1 . 1 1 122 122 ALA HA H 122 3.695 3.695 4.056 -0.360 25342 672 1 . 1 1 122 122 ALA C C 122 175.163 175.163 179.464 -4.301 25342 673 1 . 1 1 122 122 ALA CA C 122 51.692 51.692 54.839 -3.147 25342 674 1 . 1 1 122 122 ALA CB C 122 15.718 15.718 18.043 -2.325 25342 675 1 . 1 1 122 122 ALA H H 122 7.584 7.584 7.799 -0.215 25342 676 1 . 1 1 123 123 TYR N N 123 119.730 119.730 118.347 1.383 25342 677 1 . 1 1 123 123 TYR HA H 123 3.153 3.153 4.109 -0.956 25342 678 1 . 1 1 123 123 TYR C C 123 174.340 174.340 177.776 -3.437 25342 679 1 . 1 1 123 123 TYR CA C 123 60.398 60.398 60.749 -0.351 25342 680 1 . 1 1 123 123 TYR CB C 123 34.663 34.663 37.591 -2.928 25342 681 1 . 1 1 123 123 TYR H H 123 7.317 7.317 7.932 -0.615 25342 682 1 . 1 1 124 124 VAL N N 124 118.649 118.649 118.505 0.144 25342 683 1 . 1 1 124 124 VAL HA H 124 3.202 3.202 3.463 -0.261 25342 684 1 . 1 1 124 124 VAL C C 124 175.603 175.603 178.176 -2.573 25342 685 1 . 1 1 124 124 VAL CA C 124 64.680 64.680 66.174 -1.494 25342 686 1 . 1 1 124 124 VAL CB C 124 29.289 29.289 30.964 -1.676 25342 687 1 . 1 1 124 124 VAL H H 124 7.799 7.799 7.415 0.384 25342 688 1 . 1 1 125 125 SER N N 125 114.475 114.475 115.274 -0.799 25342 689 1 . 1 1 125 125 SER HA H 125 4.032 4.032 4.138 -0.106 25342 690 1 . 1 1 125 125 SER C C 125 174.849 174.849 176.646 -1.797 25342 691 1 . 1 1 125 125 SER CA C 125 59.002 59.002 62.008 -3.006 25342 692 1 . 1 1 125 125 SER CB C 125 59.613 59.613 63.153 -3.540 25342 693 1 . 1 1 125 125 SER H H 125 7.766 7.766 7.864 -0.098 25342 694 1 . 1 1 126 126 HIS N N 126 119.326 119.326 120.978 -1.652 25342 695 1 . 1 1 126 126 HIS HA H 126 4.127 4.127 4.251 -0.124 25342 696 1 . 1 1 126 126 HIS C C 126 172.865 172.865 177.447 -4.582 25342 697 1 . 1 1 126 126 HIS CA C 126 55.706 55.706 59.177 -3.471 25342 698 1 . 1 1 126 126 HIS CB C 126 25.993 25.993 30.123 -4.130 25342 699 1 . 1 1 126 126 HIS H H 126 8.569 8.569 8.301 0.268 25342 700 1 . 1 1 127 127 PHE N N 127 121.044 121.044 120.301 0.743 25342 701 1 . 1 1 127 127 PHE HA H 127 3.174 3.174 4.241 -1.067 25342 702 1 . 1 1 127 127 PHE C C 127 173.378 173.378 176.741 -3.363 25342 703 1 . 1 1 127 127 PHE CA C 127 60.867 60.867 60.996 -0.129 25342 704 1 . 1 1 127 127 PHE CB C 127 36.054 36.054 39.175 -3.121 25342 705 1 . 1 1 127 127 PHE H H 127 9.139 9.139 8.496 0.643 25342 706 1 . 1 1 128 128 ASN N N 128 114.893 114.893 117.375 -2.482 25342 707 1 . 1 1 128 128 ASN HA H 128 4.040 4.040 4.148 -0.108 25342 708 1 . 1 1 128 128 ASN C C 128 175.230 175.230 177.511 -2.281 25342 709 1 . 1 1 128 128 ASN CA C 128 54.300 54.300 56.375 -2.075 25342 710 1 . 1 1 128 128 ASN CB C 128 36.171 36.171 38.258 -2.087 25342 711 1 . 1 1 128 128 ASN H H 128 7.774 7.774 7.956 -0.182 25342 712 1 . 1 1 129 129 GLU N N 129 119.804 119.804 119.529 0.275 25342 713 1 . 1 1 129 129 GLU HA H 129 4.040 4.040 3.877 0.163 25342 714 1 . 1 1 129 129 GLU C C 129 177.052 177.052 177.941 -0.889 25342 715 1 . 1 1 129 129 GLU CA C 129 56.730 56.730 58.818 -2.088 25342 716 1 . 1 1 129 129 GLU CB C 129 27.196 27.196 29.358 -2.162 25342 717 1 . 1 1 129 129 GLU H H 129 7.577 7.577 7.773 -0.196 25342 718 1 . 1 1 130 130 TRP N N 130 120.979 120.979 117.201 3.778 25342 719 1 . 1 1 130 130 TRP HA H 130 4.457 4.457 4.547 -0.090 25342 720 1 . 1 1 130 130 TRP C C 130 174.329 174.329 175.097 -0.768 25342 721 1 . 1 1 130 130 TRP CA C 130 54.688 54.688 56.630 -1.942 25342 722 1 . 1 1 130 130 TRP CB C 130 26.991 26.991 29.340 -2.349 25342 723 1 . 1 1 130 130 TRP H H 130 8.225 8.225 7.452 0.773 25342 724 1 . 1 1 131 131 ALA N N 131 120.450 120.450 119.106 1.344 25342 725 1 . 1 1 131 131 ALA HA H 131 3.936 3.936 4.332 -0.396 25342 726 1 . 1 1 131 131 ALA C C 131 172.487 172.487 175.759 -3.272 25342 727 1 . 1 1 131 131 ALA CA C 131 48.434 48.434 51.564 -3.130 25342 728 1 . 1 1 131 131 ALA CB C 131 16.288 16.288 19.698 -3.410 25342 729 1 . 1 1 131 131 ALA H H 131 8.081 8.081 7.367 0.714 25342 730 1 . 1 1 132 132 ASP N N 132 117.813 117.813 120.556 -2.743 25342 731 1 . 1 1 132 132 ASP HA H 132 4.208 4.208 4.448 -0.240 25342 732 1 . 1 1 132 132 ASP C C 132 173.804 173.804 176.646 -2.842 25342 733 1 . 1 1 132 132 ASP CA C 132 54.181 54.181 55.232 -1.051 25342 734 1 . 1 1 132 132 ASP CB C 132 39.321 39.321 40.583 -1.262 25342 735 1 . 1 1 132 132 ASP H H 132 6.772 6.772 7.820 -1.048 25342 736 1 . 1 1 133 133 GLY N N 133 115.052 115.052 111.132 3.920 25342 737 1 . 1 1 133 133 GLY C C 133 172.078 172.078 173.922 -1.844 25342 738 1 . 1 1 133 133 GLY CA C 133 42.420 42.420 44.986 -2.566 25342 739 1 . 1 1 133 133 GLY H H 133 8.626 8.626 8.178 0.448 25342 740 1 . 1 1 134 134 LEU N N 134 120.063 120.063 121.510 -1.447 25342 741 1 . 1 1 134 134 LEU HA H 134 4.472 4.472 4.598 -0.126 25342 742 1 . 1 1 134 134 LEU C C 134 174.079 174.079 175.986 -1.907 25342 743 1 . 1 1 134 134 LEU CA C 134 50.964 50.964 53.813 -2.849 25342 744 1 . 1 1 134 134 LEU CB C 134 40.370 40.370 43.536 -3.166 25342 745 1 . 1 1 134 134 LEU H H 134 8.094 8.094 7.721 0.373 25342 746 1 . 1 1 135 135 ASN N N 135 119.292 119.292 121.040 -1.748 25342 747 1 . 1 1 135 135 ASN HA H 135 4.623 4.623 4.677 -0.054 25342 748 1 . 1 1 135 135 ASN C C 135 170.527 170.527 174.430 -3.903 25342 749 1 . 1 1 135 135 ASN CA C 135 49.002 49.002 53.193 -4.191 25342 750 1 . 1 1 135 135 ASN CB C 135 33.560 33.560 38.757 -5.197 25342 751 1 . 1 1 135 135 ASN H H 135 8.513 8.513 8.652 -0.139 25342 752 1 . 1 1 136 136 VAL N N 136 125.412 125.412 124.551 0.861 25342 753 1 . 1 1 136 136 VAL HA H 136 4.606 4.606 4.491 0.115 25342 754 1 . 1 1 136 136 VAL C C 136 175.420 175.420 176.362 -0.942 25342 755 1 . 1 1 136 136 VAL CA C 136 58.382 58.382 61.853 -3.471 25342 756 1 . 1 1 136 136 VAL CB C 136 29.247 29.247 33.193 -3.946 25342 757 1 . 1 1 136 136 VAL H H 136 7.648 7.648 8.202 -0.554 25342 758 1 . 1 1 137 137 ILE N N 137 121.881 121.881 121.527 0.354 25342 759 1 . 1 1 137 137 ILE HA H 137 4.433 4.433 4.478 -0.045 25342 760 1 . 1 1 137 137 ILE C C 137 173.906 173.906 175.350 -1.444 25342 761 1 . 1 1 137 137 ILE CA C 137 58.978 58.978 60.991 -2.013 25342 762 1 . 1 1 137 137 ILE CB C 137 36.196 36.196 38.466 -2.271 25342 763 1 . 1 1 137 137 ILE H H 137 9.139 9.139 8.694 0.445 25342 764 1 . 1 1 138 138 GLY N N 138 108.226 108.226 106.968 1.258 25342 765 1 . 1 1 138 138 GLY CA C 138 43.391 43.391 45.314 -1.923 25342 766 1 . 1 1 138 138 GLY H H 138 6.645 6.645 7.355 -0.710 25342 767 1 . 1 1 139 139 VAL N N 139 119.408 119.408 120.337 -0.929 25342 768 1 . 1 1 139 139 VAL HA H 139 5.357 5.357 5.000 0.357 25342 769 1 . 1 1 139 139 VAL C C 139 172.327 172.327 174.803 -2.476 25342 770 1 . 1 1 139 139 VAL CA C 139 58.267 58.267 60.911 -2.644 25342 771 1 . 1 1 139 139 VAL CB C 139 32.743 32.743 33.552 -0.809 25342 772 1 . 1 1 139 139 VAL H H 139 8.092 8.092 8.613 -0.521 25342 773 1 . 1 1 140 140 ALA N N 140 127.415 127.415 130.109 -2.694 25342 774 1 . 1 1 140 140 ALA HA H 140 4.445 4.445 5.079 -0.634 25342 775 1 . 1 1 140 140 ALA C C 140 170.718 170.718 175.791 -5.073 25342 776 1 . 1 1 140 140 ALA CA C 140 48.900 48.900 51.040 -2.140 25342 777 1 . 1 1 140 140 ALA CB C 140 21.059 21.059 22.311 -1.252 25342 778 1 . 1 1 140 140 ALA H H 140 9.093 9.093 8.695 0.398 25342 779 1 . 1 1 141 141 ARG N N 141 119.287 119.287 119.287 0.000 25342 780 1 . 1 1 141 141 ARG HA H 141 2.487 2.487 5.043 -2.556 25342 781 1 . 1 1 141 141 ARG C C 141 173.375 173.375 175.945 -2.570 25342 782 1 . 1 1 141 141 ARG CA C 141 51.884 51.884 55.193 -3.309 25342 783 1 . 1 1 141 141 ARG CB C 141 28.684 28.684 32.407 -3.723 25342 784 1 . 1 1 141 141 ARG H H 141 7.620 7.620 8.583 -0.963 25342 785 1 . 1 1 142 142 ASP N N 142 125.999 125.999 120.425 5.574 25342 786 1 . 1 1 142 142 ASP HA H 142 3.724 3.724 4.344 -0.620 25342 787 1 . 1 1 142 142 ASP C C 142 169.292 169.292 175.977 -6.685 25342 788 1 . 1 1 142 142 ASP CA C 142 53.338 53.338 56.138 -2.800 25342 789 1 . 1 1 142 142 ASP CB C 142 36.677 36.677 40.875 -4.198 25342 790 1 . 1 1 142 142 ASP H H 142 9.482 9.482 8.707 0.774 25342 791 1 . 1 1 143 143 ASP N N 143 119.293 119.293 119.585 -0.292 25342 792 1 . 1 1 143 143 ASP HA H 143 4.306 4.306 4.502 -0.196 25342 793 1 . 1 1 143 143 ASP C C 143 175.686 175.686 176.858 -1.172 25342 794 1 . 1 1 143 143 ASP CA C 143 48.905 48.905 54.148 -5.243 25342 795 1 . 1 1 143 143 ASP CB C 143 36.312 36.312 40.059 -3.747 25342 796 1 . 1 1 143 143 ASP H H 143 8.108 8.108 8.549 -0.441 25342 797 1 . 1 1 144 144 SER N N 144 115.303 115.303 116.006 -0.703 25342 798 1 . 1 1 144 144 SER HA H 144 3.740 3.740 4.268 -0.528 25342 799 1 . 1 1 144 144 SER C C 144 172.925 172.925 174.916 -1.991 25342 800 1 . 1 1 144 144 SER CA C 144 59.213 59.213 60.248 -1.035 25342 801 1 . 1 1 144 144 SER CB C 144 60.806 60.806 63.295 -2.489 25342 802 1 . 1 1 144 144 SER H H 144 7.642 7.642 7.967 -0.325 25342 803 1 . 1 1 145 145 GLU N N 145 119.523 119.523 119.410 0.113 25342 804 1 . 1 1 145 145 GLU HA H 145 4.306 4.306 4.142 0.164 25342 805 1 . 1 1 145 145 GLU CA C 145 52.039 52.039 55.461 -3.422 25342 806 1 . 1 1 145 145 GLU CB C 145 26.800 26.800 29.359 -2.559 25342 807 1 . 1 1 145 145 GLU H H 145 7.771 7.771 7.950 -0.179 25342 808 1 . 1 1 146 146 VAL N N 146 118.683 118.683 120.751 -2.068 25342 809 1 . 1 1 146 146 VAL HA H 146 2.941 2.941 3.597 -0.656 25342 810 1 . 1 1 146 146 VAL C C 146 174.591 174.591 176.833 -2.242 25342 811 1 . 1 1 146 146 VAL CA C 146 63.932 63.932 66.303 -2.371 25342 812 1 . 1 1 146 146 VAL CB C 146 29.047 29.047 31.526 -2.479 25342 813 1 . 1 1 146 146 VAL H H 146 6.352 6.352 7.371 -1.019 25342 814 1 . 1 1 147 147 ASP N N 147 119.312 119.312 117.040 2.272 25342 815 1 . 1 1 147 147 ASP HA H 147 4.055 4.055 4.352 -0.297 25342 816 1 . 1 1 147 147 ASP C C 147 174.783 174.783 177.154 -2.371 25342 817 1 . 1 1 147 147 ASP CA C 147 54.241 54.241 56.642 -2.401 25342 818 1 . 1 1 147 147 ASP CB C 147 37.233 37.233 40.662 -3.429 25342 819 1 . 1 1 147 147 ASP H H 147 8.370 8.370 8.581 -0.211 25342 820 1 . 1 1 148 148 LYS N N 148 119.342 119.342 116.524 2.818 25342 821 1 . 1 1 148 148 LYS HA H 148 3.937 3.937 4.427 -0.490 25342 822 1 . 1 1 148 148 LYS C C 148 176.384 176.384 178.421 -2.037 25342 823 1 . 1 1 148 148 LYS CA C 148 55.706 55.706 57.213 -1.507 25342 824 1 . 1 1 148 148 LYS CB C 148 29.511 29.511 32.650 -3.139 25342 825 1 . 1 1 148 148 LYS H H 148 7.040 7.040 7.494 -0.454 25342 826 1 . 1 1 149 149 TRP N N 149 118.258 118.258 120.434 -2.176 25342 827 1 . 1 1 149 149 TRP HA H 149 4.591 4.591 4.850 -0.259 25342 828 1 . 1 1 149 149 TRP C C 149 174.212 174.212 176.442 -2.230 25342 829 1 . 1 1 149 149 TRP CA C 149 53.745 53.745 56.143 -2.398 25342 830 1 . 1 1 149 149 TRP CB C 149 26.940 26.940 28.706 -1.766 25342 831 1 . 1 1 149 149 TRP H H 149 7.811 7.811 7.670 0.141 25342 832 1 . 1 1 150 150 SER N N 150 109.618 109.618 113.159 -3.541 25342 833 1 . 1 1 150 150 SER HA H 150 4.234 4.234 4.690 -0.456 25342 834 1 . 1 1 150 150 SER C C 150 170.189 170.189 173.982 -3.793 25342 835 1 . 1 1 150 150 SER CA C 150 56.695 56.695 57.580 -0.885 25342 836 1 . 1 1 150 150 SER CB C 150 61.935 61.935 63.610 -1.675 25342 837 1 . 1 1 150 150 SER H H 150 7.793 7.793 7.776 0.017 25342 stop_ save_