data_18509 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18509 _Entry.PDB_ID 2LU5 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 18509 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 THR C C 2 170.139 170.139 174.299 -4.160 18509 2 1 1 . 1 1 3 3 LYS N N 3 123.998 123.998 118.172 5.826 18509 3 1 1 . 1 1 3 3 LYS C C 3 171.607 171.607 173.710 -2.103 18509 4 1 1 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.367 -3.189 18509 5 1 1 . 1 1 3 3 LYS H H 3 8.666 8.666 7.449 1.217 18509 6 1 1 . 1 1 4 4 ALA N N 4 123.295 123.295 120.616 2.679 18509 7 1 1 . 1 1 4 4 ALA C C 4 172.145 172.145 175.104 -2.959 18509 8 1 1 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.546 -3.042 18509 9 1 1 . 1 1 4 4 ALA H H 4 9.116 9.116 8.115 1.001 18509 10 1 1 . 1 1 5 5 VAL N N 5 121.466 121.466 115.971 5.495 18509 11 1 1 . 1 1 5 5 VAL C C 5 167.836 167.836 173.899 -6.063 18509 12 1 1 . 1 1 5 5 VAL CA C 5 56.875 56.875 60.364 -3.489 18509 13 1 1 . 1 1 5 5 VAL H H 5 9.545 9.545 8.721 0.824 18509 14 1 1 . 1 1 6 6 ALA N N 6 125.984 125.984 128.410 -2.426 18509 15 1 1 . 1 1 6 6 ALA C C 6 171.607 171.607 175.741 -4.134 18509 16 1 1 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.261 -2.790 18509 17 1 1 . 1 1 6 6 ALA H H 6 9.177 9.177 8.299 0.878 18509 18 1 1 . 1 1 7 7 VAL N N 7 123.600 123.600 125.110 -1.510 18509 19 1 1 . 1 1 7 7 VAL C C 7 172.244 172.244 173.834 -1.590 18509 20 1 1 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.614 -2.138 18509 21 1 1 . 1 1 7 7 VAL H H 7 9.116 9.116 7.856 1.260 18509 22 1 1 . 1 1 8 8 LEU N N 8 126.455 126.455 125.919 0.536 18509 23 1 1 . 1 1 8 8 LEU C C 8 172.557 172.557 175.257 -2.700 18509 24 1 1 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.334 -2.282 18509 25 1 1 . 1 1 8 8 LEU H H 8 8.916 8.916 8.559 0.357 18509 26 1 1 . 1 1 9 9 LYS N N 9 120.820 120.820 120.480 0.340 18509 27 1 1 . 1 1 9 9 LYS C C 9 172.509 172.509 175.555 -3.046 18509 28 1 1 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.687 -3.790 18509 29 1 1 . 1 1 9 9 LYS H H 9 8.315 8.315 8.055 0.260 18509 30 1 1 . 1 1 10 10 GLY N N 10 111.249 111.249 110.869 0.380 18509 31 1 1 . 1 1 10 10 GLY C C 10 169.847 169.847 174.070 -4.223 18509 32 1 1 . 1 1 10 10 GLY CA C 10 42.275 42.275 44.292 -2.017 18509 33 1 1 . 1 1 10 10 GLY H H 10 8.968 8.968 8.396 0.572 18509 34 1 1 . 1 1 11 11 ASP N N 11 120.904 120.904 120.448 0.456 18509 35 1 1 . 1 1 11 11 ASP C C 11 173.132 173.132 177.145 -4.013 18509 36 1 1 . 1 1 11 11 ASP CA C 11 51.317 51.317 56.127 -4.810 18509 37 1 1 . 1 1 11 11 ASP H H 11 8.745 8.745 8.706 0.039 18509 38 1 1 . 1 1 12 12 GLY N N 12 109.862 109.862 108.995 0.867 18509 39 1 1 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.089 -1.889 18509 40 1 1 . 1 1 12 12 GLY H H 12 7.985 7.985 8.070 -0.085 18509 41 1 1 . 1 1 13 13 PRO C C 13 173.640 173.640 175.640 -2.000 18509 42 1 1 . 1 1 14 14 VAL N N 14 120.414 120.414 117.727 2.687 18509 43 1 1 . 1 1 14 14 VAL C C 14 172.804 172.804 174.212 -1.408 18509 44 1 1 . 1 1 14 14 VAL CA C 14 59.884 59.884 59.623 0.261 18509 45 1 1 . 1 1 14 14 VAL H H 14 7.476 7.476 8.010 -0.534 18509 46 1 1 . 1 1 15 15 GLN N N 15 122.664 122.664 125.466 -2.802 18509 47 1 1 . 1 1 15 15 GLN C C 15 171.168 171.168 173.917 -2.749 18509 48 1 1 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.796 -4.117 18509 49 1 1 . 1 1 15 15 GLN H H 15 7.938 7.938 8.762 -0.824 18509 50 1 1 . 1 1 16 16 GLY N N 16 107.018 107.018 109.576 -2.558 18509 51 1 1 . 1 1 16 16 GLY C C 16 167.726 167.726 171.902 -4.176 18509 52 1 1 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.251 -1.626 18509 53 1 1 . 1 1 16 16 GLY H H 16 8.288 8.288 8.528 -0.240 18509 54 1 1 . 1 1 17 17 ILE N N 17 120.248 120.248 116.114 4.134 18509 55 1 1 . 1 1 17 17 ILE C C 17 171.194 171.194 174.434 -3.240 18509 56 1 1 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.878 -1.381 18509 57 1 1 . 1 1 17 17 ILE H H 17 7.948 7.948 7.956 -0.008 18509 58 1 1 . 1 1 18 18 ILE N N 18 125.851 125.851 127.672 -1.821 18509 59 1 1 . 1 1 18 18 ILE C C 18 168.889 168.889 175.016 -6.127 18509 60 1 1 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.681 -6.250 18509 61 1 1 . 1 1 18 18 ILE H H 18 8.725 8.725 8.652 0.073 18509 62 1 1 . 1 1 19 19 ASN N N 19 123.256 123.256 123.308 -0.052 18509 63 1 1 . 1 1 19 19 ASN C C 19 168.903 168.903 173.732 -4.829 18509 64 1 1 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.502 -2.414 18509 65 1 1 . 1 1 19 19 ASN H H 19 8.727 8.727 8.998 -0.271 18509 66 1 1 . 1 1 20 20 PHE N N 20 113.849 113.849 116.849 -3.000 18509 67 1 1 . 1 1 20 20 PHE C C 20 173.219 173.219 175.014 -1.795 18509 68 1 1 . 1 1 20 20 PHE CA C 20 52.058 52.058 55.239 -3.181 18509 69 1 1 . 1 1 20 20 PHE H H 20 8.399 8.399 7.869 0.530 18509 70 1 1 . 1 1 21 21 GLU N N 21 121.454 121.454 123.012 -1.558 18509 71 1 1 . 1 1 21 21 GLU C C 21 170.280 170.280 175.854 -5.574 18509 72 1 1 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.756 -1.712 18509 73 1 1 . 1 1 21 21 GLU H H 21 9.526 9.526 8.554 0.972 18509 74 1 1 . 1 1 22 22 GLN N N 22 130.340 130.340 122.697 7.643 18509 75 1 1 . 1 1 22 22 GLN CA C 22 51.180 51.180 53.527 -2.347 18509 76 1 1 . 1 1 22 22 GLN H H 22 9.305 9.305 8.816 0.489 18509 77 1 1 . 1 1 23 23 LYS N N 23 128.657 128.657 119.890 8.767 18509 78 1 1 . 1 1 23 23 LYS CA C 23 57.241 57.241 55.462 1.779 18509 79 1 1 . 1 1 23 23 LYS H H 23 9.088 9.088 8.780 0.308 18509 80 1 1 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.093 -6.701 18509 81 1 1 . 1 1 25 25 SER CA C 25 58.078 58.078 59.010 -0.932 18509 82 1 1 . 1 1 27 27 GLY N N 27 108.125 108.125 112.645 -4.520 18509 83 1 1 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.809 -1.884 18509 84 1 1 . 1 1 27 27 GLY H H 27 8.032 8.032 8.130 -0.098 18509 85 1 1 . 1 1 28 28 PRO C C 28 173.128 173.128 176.668 -3.540 18509 86 1 1 . 1 1 29 29 VAL N N 29 121.267 121.267 121.063 0.204 18509 87 1 1 . 1 1 29 29 VAL C C 29 172.198 172.198 175.738 -3.540 18509 88 1 1 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.166 -3.446 18509 89 1 1 . 1 1 29 29 VAL H H 29 9.089 9.089 8.694 0.395 18509 90 1 1 . 1 1 30 30 LYS N N 30 127.589 127.589 128.233 -0.644 18509 91 1 1 . 1 1 30 30 LYS C C 30 172.098 172.098 175.106 -3.008 18509 92 1 1 . 1 1 30 30 LYS CA C 30 52.642 52.642 56.010 -3.368 18509 93 1 1 . 1 1 30 30 LYS H H 30 9.200 9.200 8.158 1.042 18509 94 1 1 . 1 1 31 31 VAL N N 31 126.037 126.037 123.416 2.621 18509 95 1 1 . 1 1 31 31 VAL C C 31 172.244 172.244 174.509 -2.265 18509 96 1 1 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.334 -2.196 18509 97 1 1 . 1 1 31 31 VAL H H 31 9.282 9.282 8.410 0.872 18509 98 1 1 . 1 1 32 32 TRP N N 32 125.414 125.414 129.655 -4.241 18509 99 1 1 . 1 1 32 32 TRP C C 32 170.156 170.156 173.799 -3.643 18509 100 1 1 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.474 -3.337 18509 101 1 1 . 1 1 32 32 TRP H H 32 8.983 8.983 9.056 -0.073 18509 102 1 1 . 1 1 33 33 GLY N N 33 107.848 107.848 112.236 -4.388 18509 103 1 1 . 1 1 33 33 GLY C C 33 168.400 168.400 172.335 -3.935 18509 104 1 1 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.652 -3.085 18509 105 1 1 . 1 1 33 33 GLY H H 33 8.360 8.360 7.879 0.481 18509 106 1 1 . 1 1 34 34 SER N N 34 114.377 114.377 117.262 -2.885 18509 107 1 1 . 1 1 34 34 SER C C 34 169.618 169.618 173.526 -3.908 18509 108 1 1 . 1 1 34 34 SER CA C 34 53.875 53.875 56.513 -2.638 18509 109 1 1 . 1 1 34 34 SER H H 34 7.838 7.838 8.064 -0.226 18509 110 1 1 . 1 1 35 35 ILE N N 35 123.149 123.149 122.775 0.374 18509 111 1 1 . 1 1 35 35 ILE C C 35 169.713 169.713 174.405 -4.692 18509 112 1 1 . 1 1 35 35 ILE CA C 35 56.769 56.769 60.184 -3.415 18509 113 1 1 . 1 1 35 35 ILE H H 35 8.496 8.496 8.173 0.323 18509 114 1 1 . 1 1 36 36 LYS N N 36 123.803 123.803 123.822 -0.019 18509 115 1 1 . 1 1 36 36 LYS C C 36 172.260 172.260 175.536 -3.276 18509 116 1 1 . 1 1 36 36 LYS CA C 36 51.150 51.150 53.679 -2.529 18509 117 1 1 . 1 1 36 36 LYS H H 36 9.091 9.091 9.153 -0.062 18509 118 1 1 . 1 1 37 37 GLY N N 37 105.495 105.495 108.738 -3.243 18509 119 1 1 . 1 1 37 37 GLY C C 37 171.641 171.641 173.161 -1.520 18509 120 1 1 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.608 -2.247 18509 121 1 1 . 1 1 37 37 GLY H H 37 8.237 8.237 7.917 0.320 18509 122 1 1 . 1 1 38 38 LEU N N 38 120.966 120.966 119.654 1.312 18509 123 1 1 . 1 1 38 38 LEU C C 38 174.112 174.112 177.084 -2.972 18509 124 1 1 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.456 -3.985 18509 125 1 1 . 1 1 38 38 LEU H H 38 8.156 8.156 8.732 -0.576 18509 126 1 1 . 1 1 39 39 THR N N 39 110.363 110.363 115.565 -5.202 18509 127 1 1 . 1 1 39 39 THR C C 39 173.102 173.102 173.879 -0.777 18509 128 1 1 . 1 1 39 39 THR CA C 39 58.194 58.194 63.164 -4.970 18509 129 1 1 . 1 1 39 39 THR H H 39 8.660 8.660 8.171 0.489 18509 130 1 1 . 1 1 40 40 GLU N N 40 125.818 125.818 127.441 -1.623 18509 131 1 1 . 1 1 40 40 GLU C C 40 173.134 173.134 174.706 -1.572 18509 132 1 1 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.645 -1.289 18509 133 1 1 . 1 1 40 40 GLU H H 40 8.804 8.804 7.686 1.118 18509 134 1 1 . 1 1 41 41 GLY N N 41 113.875 113.875 106.799 7.076 18509 135 1 1 . 1 1 41 41 GLY C C 41 170.046 170.046 172.508 -2.462 18509 136 1 1 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.340 -4.285 18509 137 1 1 . 1 1 41 41 GLY H H 41 8.763 8.763 8.434 0.329 18509 138 1 1 . 1 1 42 42 LEU N N 42 120.137 120.137 118.374 1.763 18509 139 1 1 . 1 1 42 42 LEU C C 42 174.218 174.218 174.135 0.083 18509 140 1 1 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.647 -2.492 18509 141 1 1 . 1 1 42 42 LEU H H 42 8.313 8.313 7.955 0.358 18509 142 1 1 . 1 1 43 43 HIS N N 43 114.385 114.385 123.612 -9.227 18509 143 1 1 . 1 1 43 43 HIS C C 43 171.504 171.504 174.374 -2.870 18509 144 1 1 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.539 -4.554 18509 145 1 1 . 1 1 43 43 HIS H H 43 8.712 8.712 8.751 -0.039 18509 146 1 1 . 1 1 44 44 GLY N N 44 108.872 108.872 114.417 -5.545 18509 147 1 1 . 1 1 44 44 GLY C C 44 168.656 168.656 172.369 -3.713 18509 148 1 1 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.072 -0.877 18509 149 1 1 . 1 1 44 44 GLY H H 44 8.875 8.875 9.279 -0.404 18509 150 1 1 . 1 1 45 45 PHE N N 45 126.439 126.439 124.583 1.856 18509 151 1 1 . 1 1 45 45 PHE CA C 45 53.098 53.098 56.456 -3.358 18509 152 1 1 . 1 1 45 45 PHE H H 45 8.111 8.111 7.993 0.118 18509 153 1 1 . 1 1 46 46 HIS N N 46 115.353 115.353 128.103 -12.750 18509 154 1 1 . 1 1 46 46 HIS C C 46 172.415 172.415 172.875 -0.460 18509 155 1 1 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.650 -5.444 18509 156 1 1 . 1 1 46 46 HIS H H 46 8.107 8.107 8.451 -0.344 18509 157 1 1 . 1 1 47 47 VAL N N 47 120.548 120.548 123.258 -2.710 18509 158 1 1 . 1 1 47 47 VAL C C 47 173.900 173.900 174.899 -0.999 18509 159 1 1 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.107 -2.315 18509 160 1 1 . 1 1 47 47 VAL H H 47 9.366 9.366 8.369 0.997 18509 161 1 1 . 1 1 48 48 HIS N N 48 129.236 129.236 119.179 10.057 18509 162 1 1 . 1 1 48 48 HIS C C 48 171.084 171.084 173.566 -2.482 18509 163 1 1 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.337 -1.581 18509 164 1 1 . 1 1 48 48 HIS H H 48 10.210 10.210 8.900 1.310 18509 165 1 1 . 1 1 49 49 GLU N N 49 118.119 118.119 122.773 -4.654 18509 166 1 1 . 1 1 49 49 GLU C C 49 171.635 171.635 174.076 -2.441 18509 167 1 1 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.094 2.665 18509 168 1 1 . 1 1 49 49 GLU H H 49 8.492 8.492 7.989 0.503 18509 169 1 1 . 1 1 50 50 PHE N N 50 110.329 110.329 115.210 -4.881 18509 170 1 1 . 1 1 50 50 PHE C C 50 175.252 175.252 174.383 0.869 18509 171 1 1 . 1 1 50 50 PHE CA C 50 52.900 52.900 56.142 -3.242 18509 172 1 1 . 1 1 50 50 PHE H H 50 8.580 8.580 8.091 0.489 18509 173 1 1 . 1 1 51 51 GLY N N 51 119.251 119.251 109.061 10.190 18509 174 1 1 . 1 1 51 51 GLY C C 51 168.248 168.248 172.951 -4.703 18509 175 1 1 . 1 1 51 51 GLY H H 51 10.208 10.208 7.546 2.662 18509 176 1 1 . 1 1 52 52 ASP N N 52 114.958 114.958 125.021 -10.063 18509 177 1 1 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.513 -5.622 18509 178 1 1 . 1 1 52 52 ASP H H 52 5.834 5.834 8.166 -2.332 18509 179 1 1 . 1 1 53 53 ASN N N 53 128.224 128.224 115.289 12.935 18509 180 1 1 . 1 1 53 53 ASN CA C 53 48.233 48.233 53.090 -4.857 18509 181 1 1 . 1 1 53 53 ASN H H 53 9.360 9.360 8.095 1.265 18509 182 1 1 . 1 1 54 54 THR C C 54 168.656 168.656 174.536 -5.880 18509 183 1 1 . 1 1 55 55 ALA N N 55 126.661 126.661 121.465 5.196 18509 184 1 1 . 1 1 55 55 ALA C C 55 174.185 174.185 176.313 -2.128 18509 185 1 1 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.278 -5.123 18509 186 1 1 . 1 1 55 55 ALA H H 55 8.390 8.390 7.983 0.407 18509 187 1 1 . 1 1 56 56 GLY N N 56 107.903 107.903 105.819 2.084 18509 188 1 1 . 1 1 56 56 GLY C C 56 171.578 171.578 172.851 -1.273 18509 189 1 1 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.514 -2.934 18509 190 1 1 . 1 1 56 56 GLY H H 56 7.282 7.282 7.554 -0.272 18509 191 1 1 . 1 1 57 57 CYS N N 57 117.952 117.952 122.598 -4.646 18509 192 1 1 . 1 1 57 57 CYS C C 57 175.209 175.209 175.922 -0.713 18509 193 1 1 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.082 -6.994 18509 194 1 1 . 1 1 57 57 CYS H H 57 8.900 8.900 8.566 0.334 18509 195 1 1 . 1 1 58 58 THR N N 58 119.852 119.852 119.421 0.431 18509 196 1 1 . 1 1 58 58 THR CA C 58 58.239 58.239 65.946 -7.707 18509 197 1 1 . 1 1 58 58 THR H H 58 8.505 8.505 9.567 -1.062 18509 198 1 1 . 1 1 59 59 SER C C 59 170.763 170.763 174.877 -4.114 18509 199 1 1 . 1 1 59 59 SER CA C 59 55.609 55.609 60.532 -4.923 18509 200 1 1 . 1 1 60 60 ALA N N 60 119.753 119.753 123.128 -3.375 18509 201 1 1 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.584 -2.644 18509 202 1 1 . 1 1 60 60 ALA H H 60 6.898 6.898 7.933 -1.035 18509 203 1 1 . 1 1 61 61 GLY N N 61 101.351 101.351 108.188 -6.837 18509 204 1 1 . 1 1 61 61 GLY CA C 61 42.805 42.805 46.509 -3.704 18509 205 1 1 . 1 1 61 61 GLY H H 61 7.730 7.730 7.805 -0.075 18509 206 1 1 . 1 1 62 62 PRO C C 62 172.276 172.276 175.128 -2.852 18509 207 1 1 . 1 1 63 63 HIS N N 63 115.023 115.023 120.930 -5.907 18509 208 1 1 . 1 1 63 63 HIS CA C 63 52.119 52.119 54.942 -2.823 18509 209 1 1 . 1 1 63 63 HIS H H 63 7.474 7.474 7.402 0.072 18509 210 1 1 . 1 1 64 64 PHE C C 64 171.731 171.731 174.425 -2.694 18509 211 1 1 . 1 1 65 65 ASN N N 65 126.978 126.978 121.892 5.086 18509 212 1 1 . 1 1 65 65 ASN CA C 65 47.753 47.753 50.525 -2.772 18509 213 1 1 . 1 1 65 65 ASN H H 65 9.426 9.426 8.950 0.476 18509 214 1 1 . 1 1 67 67 LEU N N 67 117.937 117.937 117.924 0.013 18509 215 1 1 . 1 1 67 67 LEU C C 67 172.580 172.580 178.672 -6.092 18509 216 1 1 . 1 1 67 67 LEU CA C 67 50.911 50.911 56.036 -5.125 18509 217 1 1 . 1 1 67 67 LEU H H 67 7.720 7.720 8.152 -0.432 18509 218 1 1 . 1 1 68 68 SER N N 68 110.842 110.842 115.007 -4.165 18509 219 1 1 . 1 1 68 68 SER CA C 68 55.953 55.953 61.272 -5.319 18509 220 1 1 . 1 1 68 68 SER H H 68 7.428 7.428 7.571 -0.143 18509 221 1 1 . 1 1 69 69 ARG N N 69 120.782 120.782 120.175 0.607 18509 222 1 1 . 1 1 69 69 ARG C C 69 173.381 173.381 176.540 -3.159 18509 223 1 1 . 1 1 69 69 ARG CA C 69 50.543 50.543 54.777 -4.234 18509 224 1 1 . 1 1 69 69 ARG H H 69 8.508 8.508 8.669 -0.161 18509 225 1 1 . 1 1 70 70 LYS N N 70 118.055 118.055 117.598 0.457 18509 226 1 1 . 1 1 70 70 LYS C C 70 169.994 169.994 176.634 -6.640 18509 227 1 1 . 1 1 70 70 LYS CA C 70 52.596 52.596 59.579 -6.983 18509 228 1 1 . 1 1 70 70 LYS H H 70 8.745 8.745 8.279 0.466 18509 229 1 1 . 1 1 71 71 HIS N N 71 111.871 111.871 118.392 -6.521 18509 230 1 1 . 1 1 71 71 HIS C C 71 171.534 171.534 175.319 -3.785 18509 231 1 1 . 1 1 71 71 HIS CA C 71 52.549 52.549 56.422 -3.873 18509 232 1 1 . 1 1 71 71 HIS H H 71 7.152 7.152 8.163 -1.011 18509 233 1 1 . 1 1 72 72 GLY N N 72 112.910 112.910 106.272 6.638 18509 234 1 1 . 1 1 72 72 GLY C C 72 168.634 168.634 174.802 -6.168 18509 235 1 1 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.685 -3.411 18509 236 1 1 . 1 1 72 72 GLY H H 72 7.209 7.209 8.349 -1.140 18509 237 1 1 . 1 1 73 73 GLY N N 73 105.207 105.207 108.724 -3.517 18509 238 1 1 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.506 -3.285 18509 239 1 1 . 1 1 73 73 GLY H H 73 8.789 8.789 8.176 0.613 18509 240 1 1 . 1 1 74 74 PRO C C 74 175.753 175.753 176.867 -1.114 18509 241 1 1 . 1 1 75 75 LYS N N 75 114.868 114.868 115.350 -0.482 18509 242 1 1 . 1 1 75 75 LYS C C 75 173.640 173.640 175.728 -2.088 18509 243 1 1 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.133 -5.030 18509 244 1 1 . 1 1 75 75 LYS H H 75 8.651 8.651 7.866 0.785 18509 245 1 1 . 1 1 76 76 ASP N N 76 120.414 120.414 117.427 2.987 18509 246 1 1 . 1 1 76 76 ASP C C 76 172.557 172.557 175.879 -3.322 18509 247 1 1 . 1 1 76 76 ASP CA C 76 51.309 51.309 55.600 -4.291 18509 248 1 1 . 1 1 76 76 ASP H H 76 7.461 7.461 7.741 -0.280 18509 249 1 1 . 1 1 77 77 GLU N N 77 120.820 120.820 121.065 -0.245 18509 250 1 1 . 1 1 77 77 GLU C C 77 174.101 174.101 175.829 -1.728 18509 251 1 1 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.480 -1.967 18509 252 1 1 . 1 1 77 77 GLU H H 77 8.315 8.315 8.760 -0.445 18509 253 1 1 . 1 1 78 78 GLU N N 78 119.251 119.251 118.971 0.280 18509 254 1 1 . 1 1 78 78 GLU C C 78 168.285 168.285 175.102 -6.817 18509 255 1 1 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.441 -5.363 18509 256 1 1 . 1 1 78 78 GLU H H 78 8.109 8.109 8.477 -0.368 18509 257 1 1 . 1 1 79 79 ARG N N 79 118.991 118.991 116.258 2.733 18509 258 1 1 . 1 1 79 79 ARG C C 79 172.123 172.123 174.973 -2.850 18509 259 1 1 . 1 1 79 79 ARG CA C 79 51.074 51.074 55.591 -4.517 18509 260 1 1 . 1 1 79 79 ARG H H 79 6.999 6.999 8.495 -1.496 18509 261 1 1 . 1 1 80 80 HIS N N 80 118.000 118.000 124.178 -6.178 18509 262 1 1 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.596 -6.643 18509 263 1 1 . 1 1 80 80 HIS H H 80 8.355 8.355 9.682 -1.327 18509 264 1 1 . 1 1 81 81 VAL C C 81 173.460 173.460 174.862 -1.402 18509 265 1 1 . 1 1 82 82 GLY N N 82 97.322 97.322 110.023 -12.701 18509 266 1 1 . 1 1 82 82 GLY C C 82 170.370 170.370 172.414 -2.044 18509 267 1 1 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.011 -2.323 18509 268 1 1 . 1 1 82 82 GLY H H 82 8.487 8.487 8.108 0.379 18509 269 1 1 . 1 1 83 83 ASP N N 83 120.890 120.890 120.378 0.512 18509 270 1 1 . 1 1 83 83 ASP C C 83 168.737 168.737 175.457 -6.720 18509 271 1 1 . 1 1 83 83 ASP CA C 83 52.918 52.918 54.374 -1.456 18509 272 1 1 . 1 1 83 83 ASP H H 83 7.127 7.127 8.309 -1.182 18509 273 1 1 . 1 1 84 84 LEU N N 84 120.154 120.154 119.807 0.347 18509 274 1 1 . 1 1 84 84 LEU C C 84 173.212 173.212 175.306 -2.094 18509 275 1 1 . 1 1 84 84 LEU CA C 84 50.433 50.433 52.311 -1.878 18509 276 1 1 . 1 1 84 84 LEU H H 84 7.128 7.128 7.928 -0.800 18509 277 1 1 . 1 1 85 85 GLY N N 85 106.867 106.867 110.269 -3.402 18509 278 1 1 . 1 1 85 85 GLY C C 85 167.654 167.654 171.864 -4.210 18509 279 1 1 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.386 -2.375 18509 280 1 1 . 1 1 85 85 GLY H H 85 8.260 8.260 7.969 0.291 18509 281 1 1 . 1 1 86 86 ASN N N 86 117.454 117.454 117.579 -0.125 18509 282 1 1 . 1 1 86 86 ASN C C 86 173.942 173.942 173.461 0.481 18509 283 1 1 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.059 -2.793 18509 284 1 1 . 1 1 86 86 ASN H H 86 8.041 8.041 7.924 0.117 18509 285 1 1 . 1 1 87 87 VAL N N 87 113.370 113.370 120.493 -7.123 18509 286 1 1 . 1 1 87 87 VAL C C 87 171.526 171.526 174.220 -2.694 18509 287 1 1 . 1 1 87 87 VAL CA C 87 55.708 55.708 59.642 -3.933 18509 288 1 1 . 1 1 87 87 VAL H H 87 8.960 8.960 8.247 0.713 18509 289 1 1 . 1 1 88 88 THR N N 88 117.939 117.939 118.257 -0.318 18509 290 1 1 . 1 1 88 88 THR C C 88 170.367 170.367 173.338 -2.971 18509 291 1 1 . 1 1 88 88 THR CA C 88 58.694 58.694 61.250 -2.556 18509 292 1 1 . 1 1 88 88 THR H H 88 8.681 8.681 8.432 0.249 18509 293 1 1 . 1 1 89 89 ALA N N 89 128.674 128.674 129.910 -1.236 18509 294 1 1 . 1 1 89 89 ALA C C 89 174.480 174.480 177.052 -2.572 18509 295 1 1 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.781 -4.412 18509 296 1 1 . 1 1 89 89 ALA H H 89 9.377 9.377 8.620 0.757 18509 297 1 1 . 1 1 90 90 ASP N N 90 124.235 124.235 121.485 2.750 18509 298 1 1 . 1 1 90 90 ASP C C 90 173.825 173.825 177.351 -3.526 18509 299 1 1 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.552 -3.205 18509 300 1 1 . 1 1 90 90 ASP H H 90 8.455 8.455 8.089 0.366 18509 301 1 1 . 1 1 91 91 LYS N N 91 114.942 114.942 116.658 -1.716 18509 302 1 1 . 1 1 91 91 LYS C C 91 174.101 174.101 176.070 -1.969 18509 303 1 1 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.454 -3.175 18509 304 1 1 . 1 1 91 91 LYS H H 91 8.231 8.231 8.521 -0.290 18509 305 1 1 . 1 1 92 92 ASP N N 92 119.251 119.251 117.546 1.705 18509 306 1 1 . 1 1 92 92 ASP C C 92 173.020 173.020 176.080 -3.060 18509 307 1 1 . 1 1 92 92 ASP CA C 92 51.127 51.127 54.225 -3.098 18509 308 1 1 . 1 1 92 92 ASP H H 92 8.109 8.109 7.533 0.576 18509 309 1 1 . 1 1 93 93 GLY N N 93 110.868 110.868 109.045 1.823 18509 310 1 1 . 1 1 93 93 GLY C C 93 169.706 169.706 172.876 -3.170 18509 311 1 1 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.714 -1.951 18509 312 1 1 . 1 1 93 93 GLY H H 93 8.405 8.405 8.278 0.127 18509 313 1 1 . 1 1 94 94 VAL N N 94 118.755 118.755 116.454 2.301 18509 314 1 1 . 1 1 94 94 VAL C C 94 173.510 173.510 174.171 -0.661 18509 315 1 1 . 1 1 94 94 VAL CA C 94 58.185 58.185 59.654 -1.469 18509 316 1 1 . 1 1 94 94 VAL H H 94 7.814 7.814 7.632 0.182 18509 317 1 1 . 1 1 95 95 ALA N N 95 131.313 131.313 128.844 2.469 18509 318 1 1 . 1 1 95 95 ALA C C 95 171.635 171.635 175.824 -4.189 18509 319 1 1 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.138 -3.224 18509 320 1 1 . 1 1 95 95 ALA H H 95 9.763 9.763 8.870 0.893 18509 321 1 1 . 1 1 96 96 ASP N N 96 125.170 125.170 123.698 1.472 18509 322 1 1 . 1 1 96 96 ASP C C 96 172.336 172.336 175.260 -2.924 18509 323 1 1 . 1 1 96 96 ASP H H 96 8.515 8.515 8.482 0.033 18509 324 1 1 . 1 1 97 97 VAL N N 97 125.879 125.879 123.529 2.350 18509 325 1 1 . 1 1 97 97 VAL C C 97 173.488 173.488 175.038 -1.550 18509 326 1 1 . 1 1 97 97 VAL CA C 97 58.243 58.243 62.285 -4.042 18509 327 1 1 . 1 1 97 97 VAL H H 97 8.703 8.703 7.989 0.714 18509 328 1 1 . 1 1 98 98 SER N N 98 123.017 123.017 125.115 -2.098 18509 329 1 1 . 1 1 98 98 SER C C 98 169.715 169.715 173.904 -4.189 18509 330 1 1 . 1 1 98 98 SER CA C 98 55.068 55.068 57.183 -2.115 18509 331 1 1 . 1 1 98 98 SER H H 98 8.784 8.784 8.271 0.513 18509 332 1 1 . 1 1 99 99 ILE N N 99 125.807 125.807 129.095 -3.288 18509 333 1 1 . 1 1 99 99 ILE C C 99 171.321 171.321 175.510 -4.189 18509 334 1 1 . 1 1 99 99 ILE CA C 99 57.155 57.155 61.423 -4.268 18509 335 1 1 . 1 1 99 99 ILE H H 99 9.411 9.411 8.314 1.097 18509 336 1 1 . 1 1 100 100 GLU N N 100 124.068 124.068 127.016 -2.948 18509 337 1 1 . 1 1 100 100 GLU C C 100 172.098 172.098 175.583 -3.485 18509 338 1 1 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.080 -1.790 18509 339 1 1 . 1 1 100 100 GLU H H 100 8.652 8.652 8.492 0.160 18509 340 1 1 . 1 1 101 101 ASP N N 101 126.109 126.109 122.744 3.365 18509 341 1 1 . 1 1 101 101 ASP C C 101 171.144 171.144 175.779 -4.635 18509 342 1 1 . 1 1 101 101 ASP CA C 101 51.419 51.419 54.232 -2.813 18509 343 1 1 . 1 1 101 101 ASP H H 101 9.317 9.317 8.506 0.811 18509 344 1 1 . 1 1 102 102 SER N N 102 118.470 118.470 117.713 0.757 18509 345 1 1 . 1 1 102 102 SER C C 102 171.596 171.596 174.322 -2.726 18509 346 1 1 . 1 1 102 102 SER CA C 102 55.245 55.245 56.994 -1.749 18509 347 1 1 . 1 1 102 102 SER H H 102 8.933 8.933 7.788 1.145 18509 348 1 1 . 1 1 103 103 VAL N N 103 123.179 123.179 119.138 4.041 18509 349 1 1 . 1 1 103 103 VAL CA C 103 61.450 61.450 64.514 -3.064 18509 350 1 1 . 1 1 103 103 VAL H H 103 8.148 8.148 9.659 -1.511 18509 351 1 1 . 1 1 104 104 ILE C C 104 169.576 169.576 175.013 -5.437 18509 352 1 1 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.233 -0.038 18509 353 1 1 . 1 1 105 105 SER N N 105 107.618 107.618 118.822 -11.204 18509 354 1 1 . 1 1 105 105 SER C C 105 170.046 170.046 174.593 -4.547 18509 355 1 1 . 1 1 105 105 SER CA C 105 52.550 52.550 58.182 -5.633 18509 356 1 1 . 1 1 105 105 SER H H 105 6.988 6.988 8.124 -1.136 18509 357 1 1 . 1 1 106 106 LEU N N 106 120.137 120.137 123.111 -2.974 18509 358 1 1 . 1 1 106 106 LEU H H 106 8.313 8.313 7.998 0.315 18509 359 1 1 . 1 1 107 107 SER C C 107 170.701 170.701 174.314 -3.613 18509 360 1 1 . 1 1 107 107 SER CA C 107 54.540 54.540 59.160 -4.620 18509 361 1 1 . 1 1 108 108 GLY N N 108 107.603 107.603 112.548 -4.945 18509 362 1 1 . 1 1 108 108 GLY C C 108 173.128 173.128 173.103 0.025 18509 363 1 1 . 1 1 108 108 GLY CA C 108 41.287 41.287 45.141 -3.854 18509 364 1 1 . 1 1 108 108 GLY H H 108 8.717 8.717 8.374 0.343 18509 365 1 1 . 1 1 109 109 ASP N N 109 120.664 120.664 121.999 -1.335 18509 366 1 1 . 1 1 109 109 ASP C C 109 171.904 171.904 176.429 -4.525 18509 367 1 1 . 1 1 109 109 ASP H H 109 9.019 9.019 8.664 0.355 18509 368 1 1 . 1 1 110 110 HIS N N 110 116.324 116.324 117.316 -0.992 18509 369 1 1 . 1 1 110 110 HIS H H 110 9.283 9.283 8.417 0.866 18509 370 1 1 . 1 1 111 111 SER N N 111 110.225 110.225 109.920 0.305 18509 371 1 1 . 1 1 111 111 SER CA C 111 54.681 54.681 57.920 -3.239 18509 372 1 1 . 1 1 111 111 SER H H 111 7.156 7.156 7.647 -0.491 18509 373 1 1 . 1 1 112 112 ILE N N 112 117.053 117.053 121.783 -4.730 18509 374 1 1 . 1 1 112 112 ILE C C 112 171.419 171.419 174.863 -3.444 18509 375 1 1 . 1 1 112 112 ILE CA C 112 57.239 57.239 60.135 -2.896 18509 376 1 1 . 1 1 112 112 ILE H H 112 7.837 7.837 8.405 -0.568 18509 377 1 1 . 1 1 113 113 ILE N N 113 121.032 121.032 121.084 -0.052 18509 378 1 1 . 1 1 113 113 ILE C C 113 173.604 173.604 176.403 -2.799 18509 379 1 1 . 1 1 113 113 ILE CA C 113 58.318 58.318 62.954 -4.636 18509 380 1 1 . 1 1 113 113 ILE H H 113 7.592 7.592 7.954 -0.362 18509 381 1 1 . 1 1 114 114 GLY N N 114 112.661 112.661 115.816 -3.155 18509 382 1 1 . 1 1 114 114 GLY C C 114 169.739 169.739 174.491 -4.752 18509 383 1 1 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.804 -2.894 18509 384 1 1 . 1 1 114 114 GLY H H 114 9.575 9.575 8.766 0.809 18509 385 1 1 . 1 1 115 115 ARG N N 115 118.398 118.398 123.783 -5.385 18509 386 1 1 . 1 1 115 115 ARG C C 115 171.079 171.079 175.492 -4.413 18509 387 1 1 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.988 -3.325 18509 388 1 1 . 1 1 115 115 ARG H H 115 7.464 7.464 7.868 -0.404 18509 389 1 1 . 1 1 116 116 THR N N 116 112.218 112.218 117.136 -4.918 18509 390 1 1 . 1 1 116 116 THR C C 116 169.821 169.821 174.917 -5.096 18509 391 1 1 . 1 1 116 116 THR CA C 116 59.633 59.633 60.641 -1.008 18509 392 1 1 . 1 1 116 116 THR H H 116 6.677 6.677 8.259 -1.582 18509 393 1 1 . 1 1 117 117 LEU N N 117 129.477 129.477 123.093 6.384 18509 394 1 1 . 1 1 117 117 LEU C C 117 171.126 171.126 175.533 -4.407 18509 395 1 1 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.936 -4.521 18509 396 1 1 . 1 1 117 117 LEU H H 117 8.799 8.799 8.734 0.065 18509 397 1 1 . 1 1 118 118 VAL N N 118 125.091 125.091 119.628 5.463 18509 398 1 1 . 1 1 118 118 VAL C C 118 170.267 170.267 174.746 -4.479 18509 399 1 1 . 1 1 118 118 VAL CA C 118 58.139 58.139 59.706 -1.567 18509 400 1 1 . 1 1 118 118 VAL H H 118 8.906 8.906 8.331 0.575 18509 401 1 1 . 1 1 119 119 VAL N N 119 120.716 120.716 125.736 -5.020 18509 402 1 1 . 1 1 119 119 VAL C C 119 171.175 171.175 173.844 -2.669 18509 403 1 1 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.390 -4.119 18509 404 1 1 . 1 1 119 119 VAL H H 119 7.982 7.982 7.774 0.208 18509 405 1 1 . 1 1 120 120 HIS N N 120 125.052 125.052 121.428 3.624 18509 406 1 1 . 1 1 120 120 HIS C C 120 172.599 172.599 173.636 -1.037 18509 407 1 1 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.628 -2.234 18509 408 1 1 . 1 1 120 120 HIS H H 120 8.935 8.935 8.392 0.543 18509 409 1 1 . 1 1 121 121 GLU N N 121 121.453 121.453 121.733 -0.280 18509 410 1 1 . 1 1 121 121 GLU C C 121 172.304 172.304 175.490 -3.186 18509 411 1 1 . 1 1 121 121 GLU CA C 121 56.090 56.090 57.091 -1.001 18509 412 1 1 . 1 1 121 121 GLU H H 121 9.178 9.178 7.958 1.220 18509 413 1 1 . 1 1 122 122 LYS N N 122 115.248 115.248 122.242 -6.994 18509 414 1 1 . 1 1 122 122 LYS C C 122 171.523 171.523 174.927 -3.404 18509 415 1 1 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.384 -4.765 18509 416 1 1 . 1 1 122 122 LYS H H 122 8.478 8.478 8.044 0.434 18509 417 1 1 . 1 1 123 123 ALA N N 123 120.866 120.866 127.053 -6.187 18509 418 1 1 . 1 1 123 123 ALA C C 123 173.219 173.219 176.839 -3.620 18509 419 1 1 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.465 -3.615 18509 420 1 1 . 1 1 123 123 ALA H H 123 7.796 7.796 8.744 -0.948 18509 421 1 1 . 1 1 124 124 ASP N N 124 121.799 121.799 126.474 -4.675 18509 422 1 1 . 1 1 124 124 ASP C C 124 174.458 174.458 175.041 -0.583 18509 423 1 1 . 1 1 124 124 ASP CA C 124 49.408 49.408 52.562 -3.154 18509 424 1 1 . 1 1 124 124 ASP H H 124 10.165 10.165 8.375 1.790 18509 425 1 1 . 1 1 125 125 ASP N N 125 129.369 129.369 122.410 6.959 18509 426 1 1 . 1 1 125 125 ASP C C 125 175.231 175.231 176.003 -0.772 18509 427 1 1 . 1 1 125 125 ASP CA C 125 50.939 50.939 54.670 -3.731 18509 428 1 1 . 1 1 125 125 ASP H H 125 10.055 10.055 7.701 2.354 18509 429 1 1 . 1 1 126 126 LEU N N 126 117.190 117.190 121.125 -3.935 18509 430 1 1 . 1 1 126 126 LEU C C 126 173.964 173.964 178.333 -4.369 18509 431 1 1 . 1 1 126 126 LEU H H 126 10.483 10.483 8.479 2.004 18509 432 1 1 . 1 1 127 127 GLY N N 127 103.809 103.809 103.213 0.596 18509 433 1 1 . 1 1 127 127 GLY CA C 127 42.878 42.878 45.122 -2.244 18509 434 1 1 . 1 1 127 127 GLY H H 127 8.637 8.637 7.632 1.005 18509 435 1 1 . 1 1 128 128 LYS N N 128 118.290 118.290 119.470 -1.180 18509 436 1 1 . 1 1 128 128 LYS CA C 128 51.740 51.740 55.748 -4.008 18509 437 1 1 . 1 1 128 128 LYS H H 128 7.158 7.158 8.479 -1.321 18509 438 1 1 . 1 1 129 129 GLY N N 129 108.507 108.507 107.378 1.129 18509 439 1 1 . 1 1 129 129 GLY C C 129 171.524 171.524 174.790 -3.266 18509 440 1 1 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.889 -4.776 18509 441 1 1 . 1 1 129 129 GLY H H 129 8.913 8.913 7.933 0.980 18509 442 1 1 . 1 1 130 130 GLY N N 130 108.537 108.537 111.034 -2.497 18509 443 1 1 . 1 1 130 130 GLY C C 130 169.994 169.994 172.662 -2.668 18509 444 1 1 . 1 1 130 130 GLY CA C 130 42.419 42.419 45.259 -2.840 18509 445 1 1 . 1 1 130 130 GLY H H 130 8.723 8.723 8.011 0.712 18509 446 1 1 . 1 1 131 131 ASN N N 131 111.951 111.951 119.174 -7.223 18509 447 1 1 . 1 1 131 131 ASN C C 131 172.236 172.236 176.833 -4.597 18509 448 1 1 . 1 1 131 131 ASN H H 131 7.152 7.152 7.881 -0.729 18509 449 1 1 . 1 1 132 132 GLU N N 132 120.461 120.461 122.100 -1.639 18509 450 1 1 . 1 1 132 132 GLU C C 132 171.084 171.084 177.953 -6.869 18509 451 1 1 . 1 1 132 132 GLU H H 132 8.935 8.935 8.898 0.037 18509 452 1 1 . 1 1 133 133 GLU N N 133 120.137 120.137 117.951 2.186 18509 453 1 1 . 1 1 133 133 GLU C C 133 176.239 176.239 179.127 -2.888 18509 454 1 1 . 1 1 133 133 GLU H H 133 8.775 8.775 8.805 -0.030 18509 455 1 1 . 1 1 134 134 SER N N 134 114.981 114.981 116.677 -1.696 18509 456 1 1 . 1 1 134 134 SER CA C 134 59.046 59.046 60.976 -1.930 18509 457 1 1 . 1 1 134 134 SER H H 134 8.117 8.117 8.146 -0.029 18509 458 1 1 . 1 1 135 135 THR N N 135 102.263 102.263 119.670 -17.407 18509 459 1 1 . 1 1 135 135 THR C C 135 172.804 172.804 175.971 -3.167 18509 460 1 1 . 1 1 135 135 THR CA C 135 60.029 60.029 67.228 -7.199 18509 461 1 1 . 1 1 135 135 THR H H 135 7.206 7.206 8.560 -1.354 18509 462 1 1 . 1 1 136 136 LYS N N 136 122.108 122.108 121.299 0.809 18509 463 1 1 . 1 1 136 136 LYS H H 136 7.884 7.884 7.708 0.176 18509 464 1 1 . 1 1 137 137 THR N N 137 105.718 105.718 108.321 -2.603 18509 465 1 1 . 1 1 137 137 THR H H 137 8.630 8.630 8.185 0.445 18509 466 1 1 . 1 1 138 138 GLY N N 138 111.372 111.372 110.572 0.800 18509 467 1 1 . 1 1 138 138 GLY CA C 138 42.483 42.483 44.758 -2.275 18509 468 1 1 . 1 1 138 138 GLY H H 138 7.426 7.426 7.875 -0.449 18509 469 1 1 . 1 1 139 139 ASN N N 139 107.496 107.496 122.035 -14.539 18509 470 1 1 . 1 1 139 139 ASN H H 139 7.545 7.545 8.307 -0.762 18509 471 1 1 . 1 1 140 140 ALA N N 140 114.542 114.542 125.623 -11.081 18509 472 1 1 . 1 1 140 140 ALA C C 140 173.571 173.571 176.585 -3.014 18509 473 1 1 . 1 1 140 140 ALA H H 140 6.368 6.368 8.237 -1.869 18509 474 1 1 . 1 1 141 141 GLY N N 141 105.287 105.287 110.704 -5.417 18509 475 1 1 . 1 1 141 141 GLY C C 141 173.542 173.542 175.077 -1.535 18509 476 1 1 . 1 1 141 141 GLY H H 141 8.271 8.271 8.897 -0.626 18509 477 1 1 . 1 1 142 142 SER N N 142 118.771 118.771 120.203 -1.432 18509 478 1 1 . 1 1 142 142 SER C C 142 170.188 170.188 175.225 -5.037 18509 479 1 1 . 1 1 142 142 SER H H 142 9.196 9.196 8.480 0.716 18509 480 1 1 . 1 1 143 143 ARG N N 143 120.189 120.189 114.771 5.418 18509 481 1 1 . 1 1 143 143 ARG C C 143 171.596 171.596 176.612 -5.016 18509 482 1 1 . 1 1 143 143 ARG H H 143 8.943 8.943 8.086 0.857 18509 483 1 1 . 1 1 144 144 LEU N N 144 122.907 122.907 121.306 1.601 18509 484 1 1 . 1 1 144 144 LEU C C 144 174.393 174.393 176.467 -2.074 18509 485 1 1 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.337 -2.962 18509 486 1 1 . 1 1 144 144 LEU H H 144 8.395 8.395 7.968 0.427 18509 487 1 1 . 1 1 145 145 ALA N N 145 114.159 114.159 116.816 -2.657 18509 488 1 1 . 1 1 145 145 ALA C C 145 171.752 171.752 174.861 -3.109 18509 489 1 1 . 1 1 145 145 ALA CA C 145 48.129 48.129 52.105 -3.976 18509 490 1 1 . 1 1 145 145 ALA H H 145 7.356 7.356 7.526 -0.170 18509 491 1 1 . 1 1 146 146 CYS N N 146 110.738 110.738 121.781 -11.043 18509 492 1 1 . 1 1 146 146 CYS C C 146 170.087 170.087 173.490 -3.403 18509 493 1 1 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.431 -6.354 18509 494 1 1 . 1 1 146 146 CYS H H 146 9.008 9.008 8.669 0.339 18509 495 1 1 . 1 1 147 147 GLY N N 147 106.461 106.461 111.876 -5.415 18509 496 1 1 . 1 1 147 147 GLY C C 147 167.909 167.909 172.105 -4.196 18509 497 1 1 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.201 -2.527 18509 498 1 1 . 1 1 147 147 GLY H H 147 8.018 8.018 8.113 -0.095 18509 499 1 1 . 1 1 148 148 VAL N N 148 124.054 124.054 122.959 1.095 18509 500 1 1 . 1 1 148 148 VAL C C 148 172.084 172.084 176.000 -3.916 18509 501 1 1 . 1 1 148 148 VAL CA C 148 59.635 59.635 63.886 -4.251 18509 502 1 1 . 1 1 148 148 VAL H H 148 8.434 8.434 8.237 0.197 18509 503 1 1 . 1 1 149 149 ILE N N 149 126.918 126.918 122.286 4.632 18509 504 1 1 . 1 1 149 149 ILE C C 149 171.804 171.804 174.861 -3.057 18509 505 1 1 . 1 1 149 149 ILE CA C 149 59.184 59.184 58.608 0.577 18509 506 1 1 . 1 1 149 149 ILE H H 149 8.613 8.613 8.984 -0.371 18509 507 1 1 . 1 1 150 150 GLY N N 150 116.493 116.493 110.214 6.279 18509 508 1 1 . 1 1 150 150 GLY C C 150 170.188 170.188 172.211 -2.023 18509 509 1 1 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.824 -4.704 18509 510 1 1 . 1 1 150 150 GLY H H 150 9.283 9.283 7.910 1.373 18509 511 1 1 . 1 1 151 151 ILE N N 151 120.189 120.189 117.600 2.589 18509 512 1 1 . 1 1 151 151 ILE C C 151 172.231 172.231 174.911 -2.680 18509 513 1 1 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.617 -1.245 18509 514 1 1 . 1 1 151 151 ILE H H 151 8.943 8.943 8.476 0.467 18509 515 1 1 . 1 1 152 152 ALA N N 152 129.719 129.719 130.669 -0.950 18509 516 1 1 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.157 -4.385 18509 517 1 1 . 1 1 152 152 ALA H H 152 8.170 8.170 8.107 0.063 18509 518 1 2 . 1 1 2 2 THR C C 2 170.139 170.139 173.604 -3.465 18509 519 1 2 . 1 1 3 3 LYS N N 3 123.998 123.998 117.993 6.005 18509 520 1 2 . 1 1 3 3 LYS C C 3 171.607 171.607 173.853 -2.246 18509 521 1 2 . 1 1 3 3 LYS CA C 3 51.178 51.178 55.244 -4.066 18509 522 1 2 . 1 1 3 3 LYS H H 3 8.666 8.666 7.483 1.183 18509 523 1 2 . 1 1 4 4 ALA N N 4 123.295 123.295 122.027 1.268 18509 524 1 2 . 1 1 4 4 ALA C C 4 172.145 172.145 175.054 -2.909 18509 525 1 2 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.816 -3.312 18509 526 1 2 . 1 1 4 4 ALA H H 4 9.116 9.116 8.525 0.591 18509 527 1 2 . 1 1 5 5 VAL N N 5 121.466 121.466 120.848 0.618 18509 528 1 2 . 1 1 5 5 VAL C C 5 167.836 167.836 174.008 -6.172 18509 529 1 2 . 1 1 5 5 VAL CA C 5 56.875 56.875 60.167 -3.292 18509 530 1 2 . 1 1 5 5 VAL H H 5 9.545 9.545 8.896 0.649 18509 531 1 2 . 1 1 6 6 ALA N N 6 125.984 125.984 129.746 -3.762 18509 532 1 2 . 1 1 6 6 ALA C C 6 171.607 171.607 175.840 -4.233 18509 533 1 2 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.369 -2.898 18509 534 1 2 . 1 1 6 6 ALA H H 6 9.177 9.177 8.415 0.762 18509 535 1 2 . 1 1 7 7 VAL N N 7 123.600 123.600 125.078 -1.478 18509 536 1 2 . 1 1 7 7 VAL C C 7 172.244 172.244 174.573 -2.329 18509 537 1 2 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.990 -3.514 18509 538 1 2 . 1 1 7 7 VAL H H 7 9.116 9.116 8.098 1.018 18509 539 1 2 . 1 1 8 8 LEU N N 8 126.455 126.455 128.185 -1.730 18509 540 1 2 . 1 1 8 8 LEU C C 8 172.557 172.557 176.298 -3.741 18509 541 1 2 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.762 -2.710 18509 542 1 2 . 1 1 8 8 LEU H H 8 8.916 8.916 8.797 0.119 18509 543 1 2 . 1 1 9 9 LYS N N 9 120.820 120.820 121.326 -0.506 18509 544 1 2 . 1 1 9 9 LYS C C 9 172.509 172.509 175.555 -3.046 18509 545 1 2 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.120 -3.223 18509 546 1 2 . 1 1 9 9 LYS H H 9 8.315 8.315 7.919 0.396 18509 547 1 2 . 1 1 10 10 GLY N N 10 111.249 111.249 111.653 -0.404 18509 548 1 2 . 1 1 10 10 GLY C C 10 169.847 169.847 173.364 -3.517 18509 549 1 2 . 1 1 10 10 GLY CA C 10 42.275 42.275 44.340 -2.065 18509 550 1 2 . 1 1 10 10 GLY H H 10 8.968 8.968 8.271 0.697 18509 551 1 2 . 1 1 11 11 ASP N N 11 120.904 120.904 121.781 -0.877 18509 552 1 2 . 1 1 11 11 ASP C C 11 173.132 173.132 176.448 -3.316 18509 553 1 2 . 1 1 11 11 ASP CA C 11 51.317 51.317 54.071 -2.754 18509 554 1 2 . 1 1 11 11 ASP H H 11 8.745 8.745 8.280 0.465 18509 555 1 2 . 1 1 12 12 GLY N N 12 109.862 109.862 107.802 2.060 18509 556 1 2 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.539 -2.340 18509 557 1 2 . 1 1 12 12 GLY H H 12 7.985 7.985 7.709 0.276 18509 558 1 2 . 1 1 13 13 PRO C C 13 173.640 173.640 175.619 -1.979 18509 559 1 2 . 1 1 14 14 VAL N N 14 120.414 120.414 124.065 -3.651 18509 560 1 2 . 1 1 14 14 VAL C C 14 172.804 172.804 174.192 -1.388 18509 561 1 2 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.195 -0.311 18509 562 1 2 . 1 1 14 14 VAL H H 14 7.476 7.476 8.177 -0.701 18509 563 1 2 . 1 1 15 15 GLN N N 15 122.664 122.664 127.771 -5.107 18509 564 1 2 . 1 1 15 15 GLN C C 15 171.168 171.168 174.599 -3.431 18509 565 1 2 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.516 -3.837 18509 566 1 2 . 1 1 15 15 GLN H H 15 7.938 7.938 8.784 -0.846 18509 567 1 2 . 1 1 16 16 GLY N N 16 107.018 107.018 109.434 -2.416 18509 568 1 2 . 1 1 16 16 GLY C C 16 167.726 167.726 171.842 -4.116 18509 569 1 2 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.299 -1.674 18509 570 1 2 . 1 1 16 16 GLY H H 16 8.288 8.288 8.417 -0.129 18509 571 1 2 . 1 1 17 17 ILE N N 17 120.248 120.248 114.985 5.263 18509 572 1 2 . 1 1 17 17 ILE C C 17 171.194 171.194 173.573 -2.379 18509 573 1 2 . 1 1 17 17 ILE CA C 17 58.497 58.497 60.248 -1.750 18509 574 1 2 . 1 1 17 17 ILE H H 17 7.948 7.948 7.803 0.145 18509 575 1 2 . 1 1 18 18 ILE N N 18 125.851 125.851 124.580 1.271 18509 576 1 2 . 1 1 18 18 ILE C C 18 168.889 168.889 174.994 -6.105 18509 577 1 2 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.778 -6.347 18509 578 1 2 . 1 1 18 18 ILE H H 18 8.725 8.725 8.296 0.429 18509 579 1 2 . 1 1 19 19 ASN N N 19 123.256 123.256 123.842 -0.586 18509 580 1 2 . 1 1 19 19 ASN C C 19 168.903 168.903 173.834 -4.931 18509 581 1 2 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.566 -2.478 18509 582 1 2 . 1 1 19 19 ASN H H 19 8.727 8.727 9.107 -0.380 18509 583 1 2 . 1 1 20 20 PHE N N 20 113.849 113.849 124.234 -10.385 18509 584 1 2 . 1 1 20 20 PHE C C 20 173.219 173.219 174.110 -0.891 18509 585 1 2 . 1 1 20 20 PHE CA C 20 52.058 52.058 56.286 -4.229 18509 586 1 2 . 1 1 20 20 PHE H H 20 8.399 8.399 9.031 -0.632 18509 587 1 2 . 1 1 21 21 GLU N N 21 121.454 121.454 127.447 -5.993 18509 588 1 2 . 1 1 21 21 GLU C C 21 170.280 170.280 174.612 -4.332 18509 589 1 2 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.364 -1.320 18509 590 1 2 . 1 1 21 21 GLU H H 21 9.526 9.526 8.517 1.009 18509 591 1 2 . 1 1 22 22 GLN N N 22 130.340 130.340 123.634 6.706 18509 592 1 2 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.399 -3.219 18509 593 1 2 . 1 1 22 22 GLN H H 22 9.305 9.305 8.446 0.859 18509 594 1 2 . 1 1 23 23 LYS N N 23 128.657 128.657 120.429 8.228 18509 595 1 2 . 1 1 23 23 LYS CA C 23 57.241 57.241 54.082 3.159 18509 596 1 2 . 1 1 23 23 LYS H H 23 9.088 9.088 8.643 0.445 18509 597 1 2 . 1 1 24 24 GLU CA C 24 51.392 51.392 59.208 -7.816 18509 598 1 2 . 1 1 25 25 SER CA C 25 58.078 58.078 59.312 -1.234 18509 599 1 2 . 1 1 27 27 GLY N N 27 108.125 108.125 105.176 2.949 18509 600 1 2 . 1 1 27 27 GLY CA C 27 42.925 42.925 45.093 -2.168 18509 601 1 2 . 1 1 27 27 GLY H H 27 8.032 8.032 8.080 -0.048 18509 602 1 2 . 1 1 28 28 PRO C C 28 173.128 173.128 176.717 -3.589 18509 603 1 2 . 1 1 29 29 VAL N N 29 121.267 121.267 118.376 2.891 18509 604 1 2 . 1 1 29 29 VAL C C 29 172.198 172.198 175.643 -3.445 18509 605 1 2 . 1 1 29 29 VAL CA C 29 57.720 57.720 60.968 -3.248 18509 606 1 2 . 1 1 29 29 VAL H H 29 9.089 9.089 7.998 1.091 18509 607 1 2 . 1 1 30 30 LYS N N 30 127.589 127.589 125.830 1.759 18509 608 1 2 . 1 1 30 30 LYS C C 30 172.098 172.098 174.477 -2.379 18509 609 1 2 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.226 -2.584 18509 610 1 2 . 1 1 30 30 LYS H H 30 9.200 9.200 8.045 1.155 18509 611 1 2 . 1 1 31 31 VAL N N 31 126.037 126.037 126.283 -0.246 18509 612 1 2 . 1 1 31 31 VAL C C 31 172.244 172.244 174.351 -2.107 18509 613 1 2 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.771 -2.632 18509 614 1 2 . 1 1 31 31 VAL H H 31 9.282 9.282 8.450 0.832 18509 615 1 2 . 1 1 32 32 TRP N N 32 125.414 125.414 130.601 -5.187 18509 616 1 2 . 1 1 32 32 TRP C C 32 170.156 170.156 173.925 -3.769 18509 617 1 2 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.540 -3.403 18509 618 1 2 . 1 1 32 32 TRP H H 32 8.983 8.983 8.806 0.177 18509 619 1 2 . 1 1 33 33 GLY N N 33 107.848 107.848 113.352 -5.504 18509 620 1 2 . 1 1 33 33 GLY C C 33 168.400 168.400 171.456 -3.056 18509 621 1 2 . 1 1 33 33 GLY CA C 33 41.567 41.567 43.916 -2.349 18509 622 1 2 . 1 1 33 33 GLY H H 33 8.360 8.360 7.742 0.618 18509 623 1 2 . 1 1 34 34 SER N N 34 114.377 114.377 116.380 -2.003 18509 624 1 2 . 1 1 34 34 SER C C 34 169.618 169.618 172.879 -3.261 18509 625 1 2 . 1 1 34 34 SER CA C 34 53.875 53.875 55.573 -1.698 18509 626 1 2 . 1 1 34 34 SER H H 34 7.838 7.838 8.326 -0.488 18509 627 1 2 . 1 1 35 35 ILE N N 35 123.149 123.149 124.086 -0.937 18509 628 1 2 . 1 1 35 35 ILE C C 35 169.713 169.713 173.581 -3.868 18509 629 1 2 . 1 1 35 35 ILE CA C 35 56.769 56.769 60.587 -3.818 18509 630 1 2 . 1 1 35 35 ILE H H 35 8.496 8.496 8.388 0.108 18509 631 1 2 . 1 1 36 36 LYS N N 36 123.803 123.803 126.897 -3.094 18509 632 1 2 . 1 1 36 36 LYS C C 36 172.260 172.260 175.495 -3.235 18509 633 1 2 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.783 -3.633 18509 634 1 2 . 1 1 36 36 LYS H H 36 9.091 9.091 8.301 0.790 18509 635 1 2 . 1 1 37 37 GLY N N 37 105.495 105.495 110.632 -5.137 18509 636 1 2 . 1 1 37 37 GLY C C 37 171.641 171.641 173.205 -1.564 18509 637 1 2 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.291 -0.930 18509 638 1 2 . 1 1 37 37 GLY H H 37 8.237 8.237 7.501 0.736 18509 639 1 2 . 1 1 38 38 LEU N N 38 120.966 120.966 119.409 1.557 18509 640 1 2 . 1 1 38 38 LEU C C 38 174.112 174.112 177.316 -3.204 18509 641 1 2 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.660 -4.189 18509 642 1 2 . 1 1 38 38 LEU H H 38 8.156 8.156 8.343 -0.187 18509 643 1 2 . 1 1 39 39 THR N N 39 110.363 110.363 115.333 -4.970 18509 644 1 2 . 1 1 39 39 THR C C 39 173.102 173.102 173.983 -0.881 18509 645 1 2 . 1 1 39 39 THR CA C 39 58.194 58.194 62.798 -4.604 18509 646 1 2 . 1 1 39 39 THR H H 39 8.660 8.660 8.270 0.390 18509 647 1 2 . 1 1 40 40 GLU N N 40 125.818 125.818 126.688 -0.870 18509 648 1 2 . 1 1 40 40 GLU C C 40 173.134 173.134 174.035 -0.901 18509 649 1 2 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.812 -1.456 18509 650 1 2 . 1 1 40 40 GLU H H 40 8.804 8.804 8.013 0.791 18509 651 1 2 . 1 1 41 41 GLY N N 41 113.875 113.875 106.290 7.585 18509 652 1 2 . 1 1 41 41 GLY C C 41 170.046 170.046 173.193 -3.147 18509 653 1 2 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.156 -5.102 18509 654 1 2 . 1 1 41 41 GLY H H 41 8.763 8.763 8.244 0.519 18509 655 1 2 . 1 1 42 42 LEU N N 42 120.137 120.137 124.168 -4.031 18509 656 1 2 . 1 1 42 42 LEU C C 42 174.218 174.218 176.004 -1.786 18509 657 1 2 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.529 -2.373 18509 658 1 2 . 1 1 42 42 LEU H H 42 8.313 8.313 8.442 -0.129 18509 659 1 2 . 1 1 43 43 HIS N N 43 114.385 114.385 112.823 1.562 18509 660 1 2 . 1 1 43 43 HIS C C 43 171.504 171.504 174.439 -2.935 18509 661 1 2 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.618 -4.633 18509 662 1 2 . 1 1 43 43 HIS H H 43 8.712 8.712 7.893 0.819 18509 663 1 2 . 1 1 44 44 GLY N N 44 108.872 108.872 106.574 2.298 18509 664 1 2 . 1 1 44 44 GLY C C 44 168.656 168.656 172.328 -3.672 18509 665 1 2 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.460 -1.265 18509 666 1 2 . 1 1 44 44 GLY H H 44 8.875 8.875 8.400 0.475 18509 667 1 2 . 1 1 45 45 PHE N N 45 126.439 126.439 124.035 2.404 18509 668 1 2 . 1 1 45 45 PHE CA C 45 53.098 53.098 58.193 -5.095 18509 669 1 2 . 1 1 45 45 PHE H H 45 8.111 8.111 8.635 -0.524 18509 670 1 2 . 1 1 46 46 HIS N N 46 115.353 115.353 128.374 -13.021 18509 671 1 2 . 1 1 46 46 HIS C C 46 172.415 172.415 173.146 -0.731 18509 672 1 2 . 1 1 46 46 HIS CA C 46 49.206 49.206 53.551 -4.345 18509 673 1 2 . 1 1 46 46 HIS H H 46 8.107 8.107 8.501 -0.394 18509 674 1 2 . 1 1 47 47 VAL N N 47 120.548 120.548 125.123 -4.575 18509 675 1 2 . 1 1 47 47 VAL C C 47 173.900 173.900 174.643 -0.743 18509 676 1 2 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.841 -3.049 18509 677 1 2 . 1 1 47 47 VAL H H 47 9.366 9.366 7.697 1.669 18509 678 1 2 . 1 1 48 48 HIS N N 48 129.236 129.236 123.212 6.024 18509 679 1 2 . 1 1 48 48 HIS C C 48 171.084 171.084 173.401 -2.317 18509 680 1 2 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.679 -1.923 18509 681 1 2 . 1 1 48 48 HIS H H 48 10.210 10.210 7.999 2.211 18509 682 1 2 . 1 1 49 49 GLU N N 49 118.119 118.119 127.240 -9.121 18509 683 1 2 . 1 1 49 49 GLU C C 49 171.635 171.635 176.116 -4.481 18509 684 1 2 . 1 1 49 49 GLU CA C 49 57.759 57.759 56.901 0.858 18509 685 1 2 . 1 1 49 49 GLU H H 49 8.492 8.492 8.582 -0.090 18509 686 1 2 . 1 1 50 50 PHE N N 50 110.329 110.329 120.604 -10.275 18509 687 1 2 . 1 1 50 50 PHE C C 50 175.252 175.252 173.174 2.078 18509 688 1 2 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.406 -5.506 18509 689 1 2 . 1 1 50 50 PHE H H 50 8.580 8.580 8.352 0.228 18509 690 1 2 . 1 1 51 51 GLY N N 51 119.251 119.251 107.539 11.712 18509 691 1 2 . 1 1 51 51 GLY C C 51 168.248 168.248 172.768 -4.520 18509 692 1 2 . 1 1 51 51 GLY H H 51 10.208 10.208 7.856 2.352 18509 693 1 2 . 1 1 52 52 ASP N N 52 114.958 114.958 118.684 -3.726 18509 694 1 2 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.719 -5.828 18509 695 1 2 . 1 1 52 52 ASP H H 52 5.834 5.834 8.247 -2.413 18509 696 1 2 . 1 1 53 53 ASN N N 53 128.224 128.224 116.818 11.406 18509 697 1 2 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.030 -3.797 18509 698 1 2 . 1 1 53 53 ASN H H 53 9.360 9.360 8.177 1.183 18509 699 1 2 . 1 1 54 54 THR C C 54 168.656 168.656 174.238 -5.582 18509 700 1 2 . 1 1 55 55 ALA N N 55 126.661 126.661 124.057 2.604 18509 701 1 2 . 1 1 55 55 ALA C C 55 174.185 174.185 177.126 -2.941 18509 702 1 2 . 1 1 55 55 ALA CA C 55 46.155 46.155 52.984 -6.829 18509 703 1 2 . 1 1 55 55 ALA H H 55 8.390 8.390 7.742 0.648 18509 704 1 2 . 1 1 56 56 GLY N N 56 107.903 107.903 103.597 4.306 18509 705 1 2 . 1 1 56 56 GLY C C 56 171.578 171.578 172.585 -1.007 18509 706 1 2 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.518 -2.938 18509 707 1 2 . 1 1 56 56 GLY H H 56 7.282 7.282 7.579 -0.297 18509 708 1 2 . 1 1 57 57 CYS N N 57 117.952 117.952 122.671 -4.719 18509 709 1 2 . 1 1 57 57 CYS C C 57 175.209 175.209 175.990 -0.781 18509 710 1 2 . 1 1 57 57 CYS CA C 57 49.088 49.088 59.060 -9.972 18509 711 1 2 . 1 1 57 57 CYS H H 57 8.900 8.900 8.521 0.379 18509 712 1 2 . 1 1 58 58 THR N N 58 119.852 119.852 117.912 1.940 18509 713 1 2 . 1 1 58 58 THR CA C 58 58.239 58.239 64.867 -6.628 18509 714 1 2 . 1 1 58 58 THR H H 58 8.505 8.505 8.091 0.414 18509 715 1 2 . 1 1 59 59 SER C C 59 170.763 170.763 175.416 -4.653 18509 716 1 2 . 1 1 59 59 SER CA C 59 55.609 55.609 60.453 -4.844 18509 717 1 2 . 1 1 60 60 ALA N N 60 119.753 119.753 121.434 -1.681 18509 718 1 2 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.926 -2.986 18509 719 1 2 . 1 1 60 60 ALA H H 60 6.898 6.898 8.002 -1.104 18509 720 1 2 . 1 1 61 61 GLY N N 61 101.351 101.351 106.971 -5.620 18509 721 1 2 . 1 1 61 61 GLY CA C 61 42.805 42.805 45.808 -3.003 18509 722 1 2 . 1 1 61 61 GLY H H 61 7.730 7.730 7.465 0.265 18509 723 1 2 . 1 1 62 62 PRO C C 62 172.276 172.276 175.882 -3.606 18509 724 1 2 . 1 1 63 63 HIS N N 63 115.023 115.023 120.336 -5.313 18509 725 1 2 . 1 1 63 63 HIS CA C 63 52.119 52.119 56.318 -4.199 18509 726 1 2 . 1 1 63 63 HIS H H 63 7.474 7.474 7.356 0.118 18509 727 1 2 . 1 1 64 64 PHE C C 64 171.731 171.731 174.161 -2.430 18509 728 1 2 . 1 1 65 65 ASN N N 65 126.978 126.978 118.370 8.608 18509 729 1 2 . 1 1 65 65 ASN CA C 65 47.753 47.753 50.119 -2.366 18509 730 1 2 . 1 1 65 65 ASN H H 65 9.426 9.426 8.249 1.177 18509 731 1 2 . 1 1 67 67 LEU N N 67 117.937 117.937 116.503 1.434 18509 732 1 2 . 1 1 67 67 LEU C C 67 172.580 172.580 176.836 -4.256 18509 733 1 2 . 1 1 67 67 LEU CA C 67 50.911 50.911 53.410 -2.499 18509 734 1 2 . 1 1 67 67 LEU H H 67 7.720 7.720 8.215 -0.495 18509 735 1 2 . 1 1 68 68 SER N N 68 110.842 110.842 116.944 -6.102 18509 736 1 2 . 1 1 68 68 SER CA C 68 55.953 55.953 60.513 -4.560 18509 737 1 2 . 1 1 68 68 SER H H 68 7.428 7.428 7.534 -0.106 18509 738 1 2 . 1 1 69 69 ARG N N 69 120.782 120.782 119.485 1.297 18509 739 1 2 . 1 1 69 69 ARG C C 69 173.381 173.381 176.306 -2.925 18509 740 1 2 . 1 1 69 69 ARG CA C 69 50.543 50.543 57.242 -6.699 18509 741 1 2 . 1 1 69 69 ARG H H 69 8.508 8.508 7.949 0.559 18509 742 1 2 . 1 1 70 70 LYS N N 70 118.055 118.055 116.395 1.660 18509 743 1 2 . 1 1 70 70 LYS C C 70 169.994 169.994 175.026 -5.032 18509 744 1 2 . 1 1 70 70 LYS CA C 70 52.596 52.596 55.825 -3.229 18509 745 1 2 . 1 1 70 70 LYS H H 70 8.745 8.745 7.485 1.260 18509 746 1 2 . 1 1 71 71 HIS N N 71 111.871 111.871 118.480 -6.609 18509 747 1 2 . 1 1 71 71 HIS C C 71 171.534 171.534 177.060 -5.526 18509 748 1 2 . 1 1 71 71 HIS CA C 71 52.549 52.549 57.087 -4.538 18509 749 1 2 . 1 1 71 71 HIS H H 71 7.152 7.152 8.422 -1.270 18509 750 1 2 . 1 1 72 72 GLY N N 72 112.910 112.910 109.952 2.958 18509 751 1 2 . 1 1 72 72 GLY C C 72 168.634 168.634 173.565 -4.931 18509 752 1 2 . 1 1 72 72 GLY CA C 72 41.274 41.274 46.004 -4.730 18509 753 1 2 . 1 1 72 72 GLY H H 72 7.209 7.209 8.322 -1.113 18509 754 1 2 . 1 1 73 73 GLY N N 73 105.207 105.207 106.334 -1.127 18509 755 1 2 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.267 -3.046 18509 756 1 2 . 1 1 73 73 GLY H H 73 8.789 8.789 7.624 1.165 18509 757 1 2 . 1 1 74 74 PRO C C 74 175.753 175.753 177.691 -1.938 18509 758 1 2 . 1 1 75 75 LYS N N 75 114.868 114.868 114.389 0.479 18509 759 1 2 . 1 1 75 75 LYS C C 75 173.640 173.640 175.841 -2.201 18509 760 1 2 . 1 1 75 75 LYS CA C 75 51.103 51.103 55.037 -3.934 18509 761 1 2 . 1 1 75 75 LYS H H 75 8.651 8.651 7.953 0.698 18509 762 1 2 . 1 1 76 76 ASP N N 76 120.414 120.414 119.640 0.774 18509 763 1 2 . 1 1 76 76 ASP C C 76 172.557 172.557 174.306 -1.749 18509 764 1 2 . 1 1 76 76 ASP CA C 76 51.309 51.309 52.962 -1.653 18509 765 1 2 . 1 1 76 76 ASP H H 76 7.461 7.461 7.845 -0.384 18509 766 1 2 . 1 1 77 77 GLU N N 77 120.820 120.820 112.804 8.016 18509 767 1 2 . 1 1 77 77 GLU C C 77 174.101 174.101 174.379 -0.278 18509 768 1 2 . 1 1 77 77 GLU CA C 77 55.513 55.513 56.242 -0.729 18509 769 1 2 . 1 1 77 77 GLU H H 77 8.315 8.315 8.444 -0.129 18509 770 1 2 . 1 1 78 78 GLU N N 78 119.251 119.251 116.517 2.734 18509 771 1 2 . 1 1 78 78 GLU C C 78 168.285 168.285 174.053 -5.768 18509 772 1 2 . 1 1 78 78 GLU CA C 78 52.078 52.078 55.709 -3.631 18509 773 1 2 . 1 1 78 78 GLU H H 78 8.109 8.109 7.485 0.624 18509 774 1 2 . 1 1 79 79 ARG N N 79 118.991 118.991 119.645 -0.654 18509 775 1 2 . 1 1 79 79 ARG C C 79 172.123 172.123 174.765 -2.642 18509 776 1 2 . 1 1 79 79 ARG CA C 79 51.074 51.074 56.153 -5.079 18509 777 1 2 . 1 1 79 79 ARG H H 79 6.999 6.999 8.663 -1.664 18509 778 1 2 . 1 1 80 80 HIS N N 80 118.000 118.000 116.607 1.393 18509 779 1 2 . 1 1 80 80 HIS CA C 80 49.953 49.953 57.519 -7.566 18509 780 1 2 . 1 1 80 80 HIS H H 80 8.355 8.355 8.435 -0.080 18509 781 1 2 . 1 1 81 81 VAL C C 81 173.460 173.460 174.844 -1.384 18509 782 1 2 . 1 1 82 82 GLY N N 82 97.322 97.322 105.131 -7.809 18509 783 1 2 . 1 1 82 82 GLY C C 82 170.370 170.370 171.708 -1.338 18509 784 1 2 . 1 1 82 82 GLY CA C 82 42.688 42.688 43.335 -0.647 18509 785 1 2 . 1 1 82 82 GLY H H 82 8.487 8.487 7.286 1.201 18509 786 1 2 . 1 1 83 83 ASP N N 83 120.890 120.890 119.210 1.680 18509 787 1 2 . 1 1 83 83 ASP C C 83 168.737 168.737 174.223 -5.486 18509 788 1 2 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.186 -0.268 18509 789 1 2 . 1 1 83 83 ASP H H 83 7.127 7.127 8.166 -1.039 18509 790 1 2 . 1 1 84 84 LEU N N 84 120.154 120.154 121.788 -1.634 18509 791 1 2 . 1 1 84 84 LEU C C 84 173.212 173.212 175.481 -2.269 18509 792 1 2 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.731 -4.298 18509 793 1 2 . 1 1 84 84 LEU H H 84 7.128 7.128 8.332 -1.204 18509 794 1 2 . 1 1 85 85 GLY N N 85 106.867 106.867 113.481 -6.614 18509 795 1 2 . 1 1 85 85 GLY C C 85 167.654 167.654 171.615 -3.961 18509 796 1 2 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.938 -1.927 18509 797 1 2 . 1 1 85 85 GLY H H 85 8.260 8.260 7.750 0.510 18509 798 1 2 . 1 1 86 86 ASN N N 86 117.454 117.454 116.010 1.444 18509 799 1 2 . 1 1 86 86 ASN C C 86 173.942 173.942 172.873 1.069 18509 800 1 2 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.770 -3.505 18509 801 1 2 . 1 1 86 86 ASN H H 86 8.041 8.041 8.147 -0.106 18509 802 1 2 . 1 1 87 87 VAL N N 87 113.370 113.370 121.116 -7.746 18509 803 1 2 . 1 1 87 87 VAL C C 87 171.526 171.526 174.821 -3.295 18509 804 1 2 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.404 -4.696 18509 805 1 2 . 1 1 87 87 VAL H H 87 8.960 8.960 8.580 0.380 18509 806 1 2 . 1 1 88 88 THR N N 88 117.939 117.939 118.794 -0.855 18509 807 1 2 . 1 1 88 88 THR C C 88 170.367 170.367 172.821 -2.454 18509 808 1 2 . 1 1 88 88 THR CA C 88 58.694 58.694 60.873 -2.179 18509 809 1 2 . 1 1 88 88 THR H H 88 8.681 8.681 8.329 0.352 18509 810 1 2 . 1 1 89 89 ALA N N 89 128.674 128.674 125.744 2.930 18509 811 1 2 . 1 1 89 89 ALA C C 89 174.480 174.480 175.388 -0.908 18509 812 1 2 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.687 -4.318 18509 813 1 2 . 1 1 89 89 ALA H H 89 9.377 9.377 8.050 1.327 18509 814 1 2 . 1 1 90 90 ASP N N 90 124.235 124.235 120.062 4.173 18509 815 1 2 . 1 1 90 90 ASP C C 90 173.825 173.825 176.874 -3.049 18509 816 1 2 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.775 -3.428 18509 817 1 2 . 1 1 90 90 ASP H H 90 8.455 8.455 8.351 0.104 18509 818 1 2 . 1 1 91 91 LYS N N 91 114.942 114.942 119.931 -4.989 18509 819 1 2 . 1 1 91 91 LYS C C 91 174.101 174.101 175.816 -1.715 18509 820 1 2 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.658 -3.379 18509 821 1 2 . 1 1 91 91 LYS H H 91 8.231 8.231 8.651 -0.420 18509 822 1 2 . 1 1 92 92 ASP N N 92 119.251 119.251 116.505 2.746 18509 823 1 2 . 1 1 92 92 ASP C C 92 173.020 173.020 176.513 -3.493 18509 824 1 2 . 1 1 92 92 ASP CA C 92 51.127 51.127 54.008 -2.881 18509 825 1 2 . 1 1 92 92 ASP H H 92 8.109 8.109 7.860 0.249 18509 826 1 2 . 1 1 93 93 GLY N N 93 110.868 110.868 110.428 0.440 18509 827 1 2 . 1 1 93 93 GLY C C 93 169.706 169.706 172.981 -3.275 18509 828 1 2 . 1 1 93 93 GLY CA C 93 43.763 43.763 46.008 -2.245 18509 829 1 2 . 1 1 93 93 GLY H H 93 8.405 8.405 8.321 0.084 18509 830 1 2 . 1 1 94 94 VAL N N 94 118.755 118.755 120.520 -1.765 18509 831 1 2 . 1 1 94 94 VAL C C 94 173.510 173.510 174.794 -1.284 18509 832 1 2 . 1 1 94 94 VAL CA C 94 58.185 58.185 60.690 -2.505 18509 833 1 2 . 1 1 94 94 VAL H H 94 7.814 7.814 7.853 -0.039 18509 834 1 2 . 1 1 95 95 ALA N N 95 131.313 131.313 129.686 1.627 18509 835 1 2 . 1 1 95 95 ALA C C 95 171.635 171.635 176.095 -4.460 18509 836 1 2 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.681 -3.767 18509 837 1 2 . 1 1 95 95 ALA H H 95 9.763 9.763 8.208 1.555 18509 838 1 2 . 1 1 96 96 ASP N N 96 125.170 125.170 124.511 0.659 18509 839 1 2 . 1 1 96 96 ASP C C 96 172.336 172.336 175.254 -2.918 18509 840 1 2 . 1 1 96 96 ASP H H 96 8.515 8.515 8.558 -0.043 18509 841 1 2 . 1 1 97 97 VAL N N 97 125.879 125.879 125.984 -0.105 18509 842 1 2 . 1 1 97 97 VAL C C 97 173.488 173.488 175.318 -1.830 18509 843 1 2 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.627 -3.384 18509 844 1 2 . 1 1 97 97 VAL H H 97 8.703 8.703 8.396 0.307 18509 845 1 2 . 1 1 98 98 SER N N 98 123.017 123.017 124.738 -1.721 18509 846 1 2 . 1 1 98 98 SER C C 98 169.715 169.715 173.350 -3.635 18509 847 1 2 . 1 1 98 98 SER CA C 98 55.068 55.068 57.644 -2.576 18509 848 1 2 . 1 1 98 98 SER H H 98 8.784 8.784 8.728 0.056 18509 849 1 2 . 1 1 99 99 ILE N N 99 125.807 125.807 126.516 -0.709 18509 850 1 2 . 1 1 99 99 ILE C C 99 171.321 171.321 174.859 -3.538 18509 851 1 2 . 1 1 99 99 ILE CA C 99 57.155 57.155 61.294 -4.139 18509 852 1 2 . 1 1 99 99 ILE H H 99 9.411 9.411 8.413 0.998 18509 853 1 2 . 1 1 100 100 GLU N N 100 124.068 124.068 127.917 -3.849 18509 854 1 2 . 1 1 100 100 GLU C C 100 172.098 172.098 175.166 -3.068 18509 855 1 2 . 1 1 100 100 GLU CA C 100 52.290 52.290 53.727 -1.437 18509 856 1 2 . 1 1 100 100 GLU H H 100 8.652 8.652 8.461 0.191 18509 857 1 2 . 1 1 101 101 ASP N N 101 126.109 126.109 122.613 3.496 18509 858 1 2 . 1 1 101 101 ASP C C 101 171.144 171.144 175.508 -4.364 18509 859 1 2 . 1 1 101 101 ASP CA C 101 51.419 51.419 54.345 -2.926 18509 860 1 2 . 1 1 101 101 ASP H H 101 9.317 9.317 8.648 0.669 18509 861 1 2 . 1 1 102 102 SER N N 102 118.470 118.470 119.060 -0.590 18509 862 1 2 . 1 1 102 102 SER C C 102 171.596 171.596 173.459 -1.863 18509 863 1 2 . 1 1 102 102 SER CA C 102 55.245 55.245 57.466 -2.221 18509 864 1 2 . 1 1 102 102 SER H H 102 8.933 8.933 8.116 0.817 18509 865 1 2 . 1 1 103 103 VAL N N 103 123.179 123.179 123.835 -0.656 18509 866 1 2 . 1 1 103 103 VAL CA C 103 61.450 61.450 62.523 -1.073 18509 867 1 2 . 1 1 103 103 VAL H H 103 8.148 8.148 8.882 -0.734 18509 868 1 2 . 1 1 104 104 ILE C C 104 169.576 169.576 176.089 -6.513 18509 869 1 2 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.630 -0.436 18509 870 1 2 . 1 1 105 105 SER N N 105 107.618 107.618 117.721 -10.103 18509 871 1 2 . 1 1 105 105 SER C C 105 170.046 170.046 173.431 -3.385 18509 872 1 2 . 1 1 105 105 SER CA C 105 52.550 52.550 58.717 -6.167 18509 873 1 2 . 1 1 105 105 SER H H 105 6.988 6.988 8.331 -1.343 18509 874 1 2 . 1 1 106 106 LEU N N 106 120.137 120.137 120.254 -0.117 18509 875 1 2 . 1 1 106 106 LEU H H 106 8.313 8.313 8.125 0.188 18509 876 1 2 . 1 1 107 107 SER C C 107 170.701 170.701 173.752 -3.051 18509 877 1 2 . 1 1 107 107 SER CA C 107 54.540 54.540 58.465 -3.925 18509 878 1 2 . 1 1 108 108 GLY N N 108 107.603 107.603 109.551 -1.948 18509 879 1 2 . 1 1 108 108 GLY C C 108 173.128 173.128 173.658 -0.530 18509 880 1 2 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.247 -2.960 18509 881 1 2 . 1 1 108 108 GLY H H 108 8.717 8.717 8.133 0.584 18509 882 1 2 . 1 1 109 109 ASP N N 109 120.664 120.664 121.867 -1.203 18509 883 1 2 . 1 1 109 109 ASP C C 109 171.904 171.904 176.806 -4.902 18509 884 1 2 . 1 1 109 109 ASP H H 109 9.019 9.019 9.147 -0.128 18509 885 1 2 . 1 1 110 110 HIS N N 110 116.324 116.324 115.055 1.269 18509 886 1 2 . 1 1 110 110 HIS H H 110 9.283 9.283 8.173 1.110 18509 887 1 2 . 1 1 111 111 SER N N 111 110.225 110.225 114.266 -4.041 18509 888 1 2 . 1 1 111 111 SER CA C 111 54.681 54.681 61.992 -7.311 18509 889 1 2 . 1 1 111 111 SER H H 111 7.156 7.156 8.563 -1.407 18509 890 1 2 . 1 1 112 112 ILE N N 112 117.053 117.053 120.714 -3.661 18509 891 1 2 . 1 1 112 112 ILE C C 112 171.419 171.419 175.115 -3.696 18509 892 1 2 . 1 1 112 112 ILE CA C 112 57.239 57.239 62.500 -5.261 18509 893 1 2 . 1 1 112 112 ILE H H 112 7.837 7.837 8.057 -0.220 18509 894 1 2 . 1 1 113 113 ILE N N 113 121.032 121.032 121.388 -0.356 18509 895 1 2 . 1 1 113 113 ILE C C 113 173.604 173.604 174.811 -1.207 18509 896 1 2 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.800 -2.482 18509 897 1 2 . 1 1 113 113 ILE H H 113 7.592 7.592 7.734 -0.142 18509 898 1 2 . 1 1 114 114 GLY N N 114 112.661 112.661 116.975 -4.314 18509 899 1 2 . 1 1 114 114 GLY C C 114 169.739 169.739 173.207 -3.468 18509 900 1 2 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.064 -3.154 18509 901 1 2 . 1 1 114 114 GLY H H 114 9.575 9.575 8.288 1.287 18509 902 1 2 . 1 1 115 115 ARG N N 115 118.398 118.398 119.308 -0.910 18509 903 1 2 . 1 1 115 115 ARG C C 115 171.079 171.079 174.910 -3.831 18509 904 1 2 . 1 1 115 115 ARG CA C 115 51.663 51.663 53.035 -1.372 18509 905 1 2 . 1 1 115 115 ARG H H 115 7.464 7.464 8.107 -0.643 18509 906 1 2 . 1 1 116 116 THR N N 116 112.218 112.218 114.635 -2.417 18509 907 1 2 . 1 1 116 116 THR C C 116 169.821 169.821 174.655 -4.834 18509 908 1 2 . 1 1 116 116 THR CA C 116 59.633 59.633 59.863 -0.230 18509 909 1 2 . 1 1 116 116 THR H H 116 6.677 6.677 8.301 -1.624 18509 910 1 2 . 1 1 117 117 LEU N N 117 129.477 129.477 124.037 5.440 18509 911 1 2 . 1 1 117 117 LEU C C 117 171.126 171.126 174.918 -3.792 18509 912 1 2 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.574 -4.159 18509 913 1 2 . 1 1 117 117 LEU H H 117 8.799 8.799 8.638 0.161 18509 914 1 2 . 1 1 118 118 VAL N N 118 125.091 125.091 125.426 -0.335 18509 915 1 2 . 1 1 118 118 VAL C C 118 170.267 170.267 175.422 -5.155 18509 916 1 2 . 1 1 118 118 VAL CA C 118 58.139 58.139 62.100 -3.961 18509 917 1 2 . 1 1 118 118 VAL H H 118 8.906 8.906 8.096 0.810 18509 918 1 2 . 1 1 119 119 VAL N N 119 120.716 120.716 123.775 -3.059 18509 919 1 2 . 1 1 119 119 VAL C C 119 171.175 171.175 173.469 -2.294 18509 920 1 2 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.686 -4.415 18509 921 1 2 . 1 1 119 119 VAL H H 119 7.982 7.982 7.974 0.008 18509 922 1 2 . 1 1 120 120 HIS N N 120 125.052 125.052 118.147 6.905 18509 923 1 2 . 1 1 120 120 HIS C C 120 172.599 172.599 173.291 -0.692 18509 924 1 2 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.700 -1.306 18509 925 1 2 . 1 1 120 120 HIS H H 120 8.935 8.935 8.375 0.560 18509 926 1 2 . 1 1 121 121 GLU N N 121 121.453 121.453 120.476 0.977 18509 927 1 2 . 1 1 121 121 GLU C C 121 172.304 172.304 175.399 -3.095 18509 928 1 2 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.592 -0.502 18509 929 1 2 . 1 1 121 121 GLU H H 121 9.178 9.178 8.708 0.470 18509 930 1 2 . 1 1 122 122 LYS N N 122 115.248 115.248 122.280 -7.032 18509 931 1 2 . 1 1 122 122 LYS C C 122 171.523 171.523 174.133 -2.610 18509 932 1 2 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.061 -4.442 18509 933 1 2 . 1 1 122 122 LYS H H 122 8.478 8.478 7.831 0.647 18509 934 1 2 . 1 1 123 123 ALA N N 123 120.866 120.866 123.586 -2.720 18509 935 1 2 . 1 1 123 123 ALA C C 123 173.219 173.219 175.981 -2.762 18509 936 1 2 . 1 1 123 123 ALA CA C 123 48.850 48.850 51.198 -2.348 18509 937 1 2 . 1 1 123 123 ALA H H 123 7.796 7.796 8.327 -0.531 18509 938 1 2 . 1 1 124 124 ASP N N 124 121.799 121.799 123.791 -1.992 18509 939 1 2 . 1 1 124 124 ASP C C 124 174.458 174.458 174.165 0.293 18509 940 1 2 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.565 -4.157 18509 941 1 2 . 1 1 124 124 ASP H H 124 10.165 10.165 8.510 1.655 18509 942 1 2 . 1 1 125 125 ASP N N 125 129.369 129.369 121.824 7.545 18509 943 1 2 . 1 1 125 125 ASP C C 125 175.231 175.231 174.759 0.472 18509 944 1 2 . 1 1 125 125 ASP CA C 125 50.939 50.939 53.782 -2.843 18509 945 1 2 . 1 1 125 125 ASP H H 125 10.055 10.055 7.937 2.118 18509 946 1 2 . 1 1 126 126 LEU N N 126 117.190 117.190 123.145 -5.955 18509 947 1 2 . 1 1 126 126 LEU C C 126 173.964 173.964 178.042 -4.078 18509 948 1 2 . 1 1 126 126 LEU H H 126 10.483 10.483 8.871 1.612 18509 949 1 2 . 1 1 127 127 GLY N N 127 103.809 103.809 107.738 -3.929 18509 950 1 2 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.410 -3.533 18509 951 1 2 . 1 1 127 127 GLY H H 127 8.637 8.637 7.832 0.805 18509 952 1 2 . 1 1 128 128 LYS N N 128 118.290 118.290 122.041 -3.751 18509 953 1 2 . 1 1 128 128 LYS CA C 128 51.740 51.740 54.423 -2.683 18509 954 1 2 . 1 1 128 128 LYS H H 128 7.158 7.158 8.730 -1.572 18509 955 1 2 . 1 1 129 129 GLY N N 129 108.507 108.507 108.609 -0.102 18509 956 1 2 . 1 1 129 129 GLY C C 129 171.524 171.524 173.645 -2.121 18509 957 1 2 . 1 1 129 129 GLY CA C 129 42.113 42.113 45.630 -3.517 18509 958 1 2 . 1 1 129 129 GLY H H 129 8.913 8.913 8.218 0.695 18509 959 1 2 . 1 1 130 130 GLY N N 130 108.537 108.537 108.153 0.384 18509 960 1 2 . 1 1 130 130 GLY C C 130 169.994 169.994 173.278 -3.284 18509 961 1 2 . 1 1 130 130 GLY CA C 130 42.419 42.419 45.024 -2.605 18509 962 1 2 . 1 1 130 130 GLY H H 130 8.723 8.723 8.271 0.452 18509 963 1 2 . 1 1 131 131 ASN N N 131 111.951 111.951 120.113 -8.162 18509 964 1 2 . 1 1 131 131 ASN C C 131 172.236 172.236 176.948 -4.712 18509 965 1 2 . 1 1 131 131 ASN H H 131 7.152 7.152 8.236 -1.084 18509 966 1 2 . 1 1 132 132 GLU N N 132 120.461 120.461 124.352 -3.891 18509 967 1 2 . 1 1 132 132 GLU C C 132 171.084 171.084 178.110 -7.026 18509 968 1 2 . 1 1 132 132 GLU H H 132 8.935 8.935 8.980 -0.045 18509 969 1 2 . 1 1 133 133 GLU N N 133 120.137 120.137 117.135 3.002 18509 970 1 2 . 1 1 133 133 GLU C C 133 176.239 176.239 178.752 -2.513 18509 971 1 2 . 1 1 133 133 GLU H H 133 8.775 8.775 8.197 0.578 18509 972 1 2 . 1 1 134 134 SER N N 134 114.981 114.981 114.976 0.005 18509 973 1 2 . 1 1 134 134 SER CA C 134 59.046 59.046 60.925 -1.879 18509 974 1 2 . 1 1 134 134 SER H H 134 8.117 8.117 7.645 0.472 18509 975 1 2 . 1 1 135 135 THR N N 135 102.263 102.263 118.145 -15.882 18509 976 1 2 . 1 1 135 135 THR C C 135 172.804 172.804 176.395 -3.591 18509 977 1 2 . 1 1 135 135 THR CA C 135 60.029 60.029 64.654 -4.625 18509 978 1 2 . 1 1 135 135 THR H H 135 7.206 7.206 8.598 -1.392 18509 979 1 2 . 1 1 136 136 LYS N N 136 122.108 122.108 119.512 2.596 18509 980 1 2 . 1 1 136 136 LYS H H 136 7.884 7.884 7.527 0.357 18509 981 1 2 . 1 1 137 137 THR N N 137 105.718 105.718 110.909 -5.191 18509 982 1 2 . 1 1 137 137 THR H H 137 8.630 8.630 7.542 1.088 18509 983 1 2 . 1 1 138 138 GLY N N 138 111.372 111.372 112.141 -0.769 18509 984 1 2 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.772 -3.289 18509 985 1 2 . 1 1 138 138 GLY H H 138 7.426 7.426 7.835 -0.409 18509 986 1 2 . 1 1 139 139 ASN N N 139 107.496 107.496 119.977 -12.481 18509 987 1 2 . 1 1 139 139 ASN H H 139 7.545 7.545 8.082 -0.537 18509 988 1 2 . 1 1 140 140 ALA N N 140 114.542 114.542 126.795 -12.253 18509 989 1 2 . 1 1 140 140 ALA C C 140 173.571 173.571 177.270 -3.699 18509 990 1 2 . 1 1 140 140 ALA H H 140 6.368 6.368 8.210 -1.842 18509 991 1 2 . 1 1 141 141 GLY N N 141 105.287 105.287 107.788 -2.501 18509 992 1 2 . 1 1 141 141 GLY C C 141 173.542 173.542 174.731 -1.189 18509 993 1 2 . 1 1 141 141 GLY H H 141 8.271 8.271 8.644 -0.373 18509 994 1 2 . 1 1 142 142 SER N N 142 118.771 118.771 119.165 -0.394 18509 995 1 2 . 1 1 142 142 SER C C 142 170.188 170.188 175.294 -5.106 18509 996 1 2 . 1 1 142 142 SER H H 142 9.196 9.196 8.684 0.512 18509 997 1 2 . 1 1 143 143 ARG N N 143 120.189 120.189 120.167 0.022 18509 998 1 2 . 1 1 143 143 ARG C C 143 171.596 171.596 177.908 -6.312 18509 999 1 2 . 1 1 143 143 ARG H H 143 8.943 8.943 8.199 0.744 18509 1000 1 2 . 1 1 144 144 LEU N N 144 122.907 122.907 119.642 3.265 18509 1001 1 2 . 1 1 144 144 LEU C C 144 174.393 174.393 175.365 -0.972 18509 1002 1 2 . 1 1 144 144 LEU CA C 144 53.375 53.375 57.359 -3.984 18509 1003 1 2 . 1 1 144 144 LEU H H 144 8.395 8.395 7.913 0.482 18509 1004 1 2 . 1 1 145 145 ALA N N 145 114.159 114.159 116.615 -2.456 18509 1005 1 2 . 1 1 145 145 ALA C C 145 171.752 171.752 175.088 -3.336 18509 1006 1 2 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.122 -2.993 18509 1007 1 2 . 1 1 145 145 ALA H H 145 7.356 7.356 7.388 -0.032 18509 1008 1 2 . 1 1 146 146 CYS N N 146 110.738 110.738 120.615 -9.877 18509 1009 1 2 . 1 1 146 146 CYS C C 146 170.087 170.087 173.973 -3.886 18509 1010 1 2 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.521 -6.444 18509 1011 1 2 . 1 1 146 146 CYS H H 146 9.008 9.008 8.067 0.941 18509 1012 1 2 . 1 1 147 147 GLY N N 147 106.461 106.461 109.878 -3.417 18509 1013 1 2 . 1 1 147 147 GLY C C 147 167.909 167.909 172.325 -4.416 18509 1014 1 2 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.316 -2.642 18509 1015 1 2 . 1 1 147 147 GLY H H 147 8.018 8.018 8.201 -0.183 18509 1016 1 2 . 1 1 148 148 VAL N N 148 124.054 124.054 121.203 2.851 18509 1017 1 2 . 1 1 148 148 VAL C C 148 172.084 172.084 174.838 -2.754 18509 1018 1 2 . 1 1 148 148 VAL CA C 148 59.635 59.635 61.502 -1.867 18509 1019 1 2 . 1 1 148 148 VAL H H 148 8.434 8.434 7.919 0.515 18509 1020 1 2 . 1 1 149 149 ILE N N 149 126.918 126.918 128.859 -1.941 18509 1021 1 2 . 1 1 149 149 ILE C C 149 171.804 171.804 174.571 -2.767 18509 1022 1 2 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.380 -0.196 18509 1023 1 2 . 1 1 149 149 ILE H H 149 8.613 8.613 8.722 -0.109 18509 1024 1 2 . 1 1 150 150 GLY N N 150 116.493 116.493 115.570 0.923 18509 1025 1 2 . 1 1 150 150 GLY C C 150 170.188 170.188 172.880 -2.692 18509 1026 1 2 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.940 -4.820 18509 1027 1 2 . 1 1 150 150 GLY H H 150 9.283 9.283 8.327 0.956 18509 1028 1 2 . 1 1 151 151 ILE N N 151 120.189 120.189 122.862 -2.673 18509 1029 1 2 . 1 1 151 151 ILE C C 151 172.231 172.231 174.844 -2.613 18509 1030 1 2 . 1 1 151 151 ILE CA C 151 60.372 60.372 62.505 -2.132 18509 1031 1 2 . 1 1 151 151 ILE H H 151 8.943 8.943 7.904 1.039 18509 1032 1 2 . 1 1 152 152 ALA N N 152 129.719 129.719 129.429 0.290 18509 1033 1 2 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.771 -4.999 18509 1034 1 2 . 1 1 152 152 ALA H H 152 8.170 8.170 7.829 0.341 18509 1035 1 3 . 1 1 2 2 THR C C 2 170.139 170.139 173.897 -3.758 18509 1036 1 3 . 1 1 3 3 LYS N N 3 123.998 123.998 119.791 4.207 18509 1037 1 3 . 1 1 3 3 LYS C C 3 171.607 171.607 173.674 -2.067 18509 1038 1 3 . 1 1 3 3 LYS CA C 3 51.178 51.178 55.209 -4.031 18509 1039 1 3 . 1 1 3 3 LYS H H 3 8.666 8.666 7.343 1.323 18509 1040 1 3 . 1 1 4 4 ALA N N 4 123.295 123.295 123.401 -0.106 18509 1041 1 3 . 1 1 4 4 ALA C C 4 172.145 172.145 175.266 -3.121 18509 1042 1 3 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.483 -2.979 18509 1043 1 3 . 1 1 4 4 ALA H H 4 9.116 9.116 8.227 0.889 18509 1044 1 3 . 1 1 5 5 VAL N N 5 121.466 121.466 118.820 2.646 18509 1045 1 3 . 1 1 5 5 VAL C C 5 167.836 167.836 173.423 -5.587 18509 1046 1 3 . 1 1 5 5 VAL CA C 5 56.875 56.875 60.536 -3.661 18509 1047 1 3 . 1 1 5 5 VAL H H 5 9.545 9.545 9.150 0.395 18509 1048 1 3 . 1 1 6 6 ALA N N 6 125.984 125.984 131.197 -5.213 18509 1049 1 3 . 1 1 6 6 ALA C C 6 171.607 171.607 175.675 -4.068 18509 1050 1 3 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.502 -3.031 18509 1051 1 3 . 1 1 6 6 ALA H H 6 9.177 9.177 8.314 0.863 18509 1052 1 3 . 1 1 7 7 VAL N N 7 123.600 123.600 125.678 -2.078 18509 1053 1 3 . 1 1 7 7 VAL C C 7 172.244 172.244 174.182 -1.938 18509 1054 1 3 . 1 1 7 7 VAL CA C 7 58.476 58.476 62.199 -3.723 18509 1055 1 3 . 1 1 7 7 VAL H H 7 9.116 9.116 8.001 1.115 18509 1056 1 3 . 1 1 8 8 LEU N N 8 126.455 126.455 122.062 4.393 18509 1057 1 3 . 1 1 8 8 LEU C C 8 172.557 172.557 175.161 -2.604 18509 1058 1 3 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.042 -1.990 18509 1059 1 3 . 1 1 8 8 LEU H H 8 8.916 8.916 8.332 0.584 18509 1060 1 3 . 1 1 9 9 LYS N N 9 120.820 120.820 120.293 0.527 18509 1061 1 3 . 1 1 9 9 LYS C C 9 172.509 172.509 174.738 -2.229 18509 1062 1 3 . 1 1 9 9 LYS CA C 9 51.897 51.897 56.201 -4.304 18509 1063 1 3 . 1 1 9 9 LYS H H 9 8.315 8.315 8.933 -0.618 18509 1064 1 3 . 1 1 10 10 GLY N N 10 111.249 111.249 111.492 -0.243 18509 1065 1 3 . 1 1 10 10 GLY C C 10 169.847 169.847 173.356 -3.509 18509 1066 1 3 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.099 -2.824 18509 1067 1 3 . 1 1 10 10 GLY H H 10 8.968 8.968 8.315 0.653 18509 1068 1 3 . 1 1 11 11 ASP N N 11 120.904 120.904 120.970 -0.066 18509 1069 1 3 . 1 1 11 11 ASP C C 11 173.132 173.132 176.988 -3.856 18509 1070 1 3 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.874 -4.557 18509 1071 1 3 . 1 1 11 11 ASP H H 11 8.745 8.745 8.251 0.494 18509 1072 1 3 . 1 1 12 12 GLY N N 12 109.862 109.862 108.744 1.118 18509 1073 1 3 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.195 -1.995 18509 1074 1 3 . 1 1 12 12 GLY H H 12 7.985 7.985 7.611 0.374 18509 1075 1 3 . 1 1 13 13 PRO C C 13 173.640 173.640 175.417 -1.777 18509 1076 1 3 . 1 1 14 14 VAL N N 14 120.414 120.414 125.150 -4.736 18509 1077 1 3 . 1 1 14 14 VAL C C 14 172.804 172.804 174.792 -1.988 18509 1078 1 3 . 1 1 14 14 VAL CA C 14 59.884 59.884 61.478 -1.594 18509 1079 1 3 . 1 1 14 14 VAL H H 14 7.476 7.476 8.239 -0.763 18509 1080 1 3 . 1 1 15 15 GLN N N 15 122.664 122.664 125.596 -2.932 18509 1081 1 3 . 1 1 15 15 GLN C C 15 171.168 171.168 174.833 -3.665 18509 1082 1 3 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.010 -3.331 18509 1083 1 3 . 1 1 15 15 GLN H H 15 7.938 7.938 8.773 -0.835 18509 1084 1 3 . 1 1 16 16 GLY N N 16 107.018 107.018 107.852 -0.834 18509 1085 1 3 . 1 1 16 16 GLY C C 16 167.726 167.726 172.054 -4.328 18509 1086 1 3 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.194 -1.569 18509 1087 1 3 . 1 1 16 16 GLY H H 16 8.288 8.288 8.452 -0.164 18509 1088 1 3 . 1 1 17 17 ILE N N 17 120.248 120.248 116.720 3.528 18509 1089 1 3 . 1 1 17 17 ILE C C 17 171.194 171.194 174.256 -3.062 18509 1090 1 3 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.999 -1.502 18509 1091 1 3 . 1 1 17 17 ILE H H 17 7.948 7.948 7.786 0.162 18509 1092 1 3 . 1 1 18 18 ILE N N 18 125.851 125.851 126.188 -0.337 18509 1093 1 3 . 1 1 18 18 ILE C C 18 168.889 168.889 175.032 -6.143 18509 1094 1 3 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.182 -5.751 18509 1095 1 3 . 1 1 18 18 ILE H H 18 8.725 8.725 8.271 0.454 18509 1096 1 3 . 1 1 19 19 ASN N N 19 123.256 123.256 122.080 1.176 18509 1097 1 3 . 1 1 19 19 ASN C C 19 168.903 168.903 172.947 -4.044 18509 1098 1 3 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.468 -2.380 18509 1099 1 3 . 1 1 19 19 ASN H H 19 8.727 8.727 8.194 0.533 18509 1100 1 3 . 1 1 20 20 PHE N N 20 113.849 113.849 119.626 -5.777 18509 1101 1 3 . 1 1 20 20 PHE C C 20 173.219 173.219 175.019 -1.800 18509 1102 1 3 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.146 -5.088 18509 1103 1 3 . 1 1 20 20 PHE H H 20 8.399 8.399 8.633 -0.234 18509 1104 1 3 . 1 1 21 21 GLU N N 21 121.454 121.454 121.298 0.156 18509 1105 1 3 . 1 1 21 21 GLU C C 21 170.280 170.280 174.798 -4.518 18509 1106 1 3 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.929 -1.885 18509 1107 1 3 . 1 1 21 21 GLU H H 21 9.526 9.526 8.709 0.817 18509 1108 1 3 . 1 1 22 22 GLN N N 22 130.340 130.340 124.280 6.060 18509 1109 1 3 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.278 -4.098 18509 1110 1 3 . 1 1 22 22 GLN H H 22 9.305 9.305 8.487 0.818 18509 1111 1 3 . 1 1 23 23 LYS N N 23 128.657 128.657 124.825 3.832 18509 1112 1 3 . 1 1 23 23 LYS CA C 23 57.241 57.241 54.434 2.807 18509 1113 1 3 . 1 1 23 23 LYS H H 23 9.088 9.088 8.435 0.653 18509 1114 1 3 . 1 1 24 24 GLU CA C 24 51.392 51.392 59.319 -7.927 18509 1115 1 3 . 1 1 25 25 SER CA C 25 58.078 58.078 59.376 -1.298 18509 1116 1 3 . 1 1 27 27 GLY N N 27 108.125 108.125 109.958 -1.833 18509 1117 1 3 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.769 -1.844 18509 1118 1 3 . 1 1 27 27 GLY H H 27 8.032 8.032 8.006 0.026 18509 1119 1 3 . 1 1 28 28 PRO C C 28 173.128 173.128 176.816 -3.688 18509 1120 1 3 . 1 1 29 29 VAL N N 29 121.267 121.267 117.284 3.983 18509 1121 1 3 . 1 1 29 29 VAL C C 29 172.198 172.198 175.640 -3.442 18509 1122 1 3 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.965 -4.245 18509 1123 1 3 . 1 1 29 29 VAL H H 29 9.089 9.089 8.707 0.382 18509 1124 1 3 . 1 1 30 30 LYS N N 30 127.589 127.589 127.750 -0.161 18509 1125 1 3 . 1 1 30 30 LYS C C 30 172.098 172.098 175.195 -3.097 18509 1126 1 3 . 1 1 30 30 LYS CA C 30 52.642 52.642 56.117 -3.475 18509 1127 1 3 . 1 1 30 30 LYS H H 30 9.200 9.200 8.732 0.468 18509 1128 1 3 . 1 1 31 31 VAL N N 31 126.037 126.037 125.460 0.577 18509 1129 1 3 . 1 1 31 31 VAL C C 31 172.244 172.244 174.281 -2.037 18509 1130 1 3 . 1 1 31 31 VAL CA C 31 57.139 57.139 60.924 -3.785 18509 1131 1 3 . 1 1 31 31 VAL H H 31 9.282 9.282 8.027 1.255 18509 1132 1 3 . 1 1 32 32 TRP N N 32 125.414 125.414 128.127 -2.713 18509 1133 1 3 . 1 1 32 32 TRP C C 32 170.156 170.156 174.110 -3.954 18509 1134 1 3 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.331 -3.194 18509 1135 1 3 . 1 1 32 32 TRP H H 32 8.983 8.983 8.334 0.649 18509 1136 1 3 . 1 1 33 33 GLY N N 33 107.848 107.848 112.671 -4.823 18509 1137 1 3 . 1 1 33 33 GLY C C 33 168.400 168.400 171.978 -3.578 18509 1138 1 3 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.264 -3.697 18509 1139 1 3 . 1 1 33 33 GLY H H 33 8.360 8.360 9.050 -0.690 18509 1140 1 3 . 1 1 34 34 SER N N 34 114.377 114.377 119.575 -5.198 18509 1141 1 3 . 1 1 34 34 SER C C 34 169.618 169.618 173.362 -3.744 18509 1142 1 3 . 1 1 34 34 SER CA C 34 53.875 53.875 57.342 -3.467 18509 1143 1 3 . 1 1 34 34 SER H H 34 7.838 7.838 8.142 -0.304 18509 1144 1 3 . 1 1 35 35 ILE N N 35 123.149 123.149 126.314 -3.165 18509 1145 1 3 . 1 1 35 35 ILE C C 35 169.713 169.713 175.391 -5.678 18509 1146 1 3 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.752 -2.983 18509 1147 1 3 . 1 1 35 35 ILE H H 35 8.496 8.496 9.134 -0.638 18509 1148 1 3 . 1 1 36 36 LYS N N 36 123.803 123.803 124.715 -0.912 18509 1149 1 3 . 1 1 36 36 LYS C C 36 172.260 172.260 175.438 -3.178 18509 1150 1 3 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.994 -3.844 18509 1151 1 3 . 1 1 36 36 LYS H H 36 9.091 9.091 9.008 0.083 18509 1152 1 3 . 1 1 37 37 GLY N N 37 105.495 105.495 110.308 -4.813 18509 1153 1 3 . 1 1 37 37 GLY C C 37 171.641 171.641 172.846 -1.205 18509 1154 1 3 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.037 -1.676 18509 1155 1 3 . 1 1 37 37 GLY H H 37 8.237 8.237 8.636 -0.399 18509 1156 1 3 . 1 1 38 38 LEU N N 38 120.966 120.966 119.638 1.328 18509 1157 1 3 . 1 1 38 38 LEU C C 38 174.112 174.112 177.289 -3.177 18509 1158 1 3 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.473 -4.002 18509 1159 1 3 . 1 1 38 38 LEU H H 38 8.156 8.156 8.234 -0.078 18509 1160 1 3 . 1 1 39 39 THR N N 39 110.363 110.363 114.452 -4.089 18509 1161 1 3 . 1 1 39 39 THR C C 39 173.102 173.102 173.827 -0.725 18509 1162 1 3 . 1 1 39 39 THR CA C 39 58.194 58.194 63.049 -4.855 18509 1163 1 3 . 1 1 39 39 THR H H 39 8.660 8.660 8.356 0.304 18509 1164 1 3 . 1 1 40 40 GLU N N 40 125.818 125.818 127.118 -1.300 18509 1165 1 3 . 1 1 40 40 GLU C C 40 173.134 173.134 174.161 -1.027 18509 1166 1 3 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.562 -1.206 18509 1167 1 3 . 1 1 40 40 GLU H H 40 8.804 8.804 7.949 0.855 18509 1168 1 3 . 1 1 41 41 GLY N N 41 113.875 113.875 106.538 7.337 18509 1169 1 3 . 1 1 41 41 GLY C C 41 170.046 170.046 173.626 -3.580 18509 1170 1 3 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.928 -4.874 18509 1171 1 3 . 1 1 41 41 GLY H H 41 8.763 8.763 8.175 0.588 18509 1172 1 3 . 1 1 42 42 LEU N N 42 120.137 120.137 124.189 -4.052 18509 1173 1 3 . 1 1 42 42 LEU C C 42 174.218 174.218 175.338 -1.120 18509 1174 1 3 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.478 -2.323 18509 1175 1 3 . 1 1 42 42 LEU H H 42 8.313 8.313 8.203 0.110 18509 1176 1 3 . 1 1 43 43 HIS N N 43 114.385 114.385 114.720 -0.335 18509 1177 1 3 . 1 1 43 43 HIS C C 43 171.504 171.504 174.176 -2.672 18509 1178 1 3 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.527 -4.542 18509 1179 1 3 . 1 1 43 43 HIS H H 43 8.712 8.712 7.497 1.215 18509 1180 1 3 . 1 1 44 44 GLY N N 44 108.872 108.872 110.986 -2.114 18509 1181 1 3 . 1 1 44 44 GLY C C 44 168.656 168.656 172.775 -4.119 18509 1182 1 3 . 1 1 44 44 GLY CA C 44 44.195 44.195 44.970 -0.775 18509 1183 1 3 . 1 1 44 44 GLY H H 44 8.875 8.875 8.325 0.550 18509 1184 1 3 . 1 1 45 45 PHE N N 45 126.439 126.439 126.262 0.177 18509 1185 1 3 . 1 1 45 45 PHE CA C 45 53.098 53.098 56.609 -3.511 18509 1186 1 3 . 1 1 45 45 PHE H H 45 8.111 8.111 8.993 -0.882 18509 1187 1 3 . 1 1 46 46 HIS N N 46 115.353 115.353 125.336 -9.983 18509 1188 1 3 . 1 1 46 46 HIS C C 46 172.415 172.415 173.827 -1.412 18509 1189 1 3 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.270 -5.064 18509 1190 1 3 . 1 1 46 46 HIS H H 46 8.107 8.107 8.165 -0.058 18509 1191 1 3 . 1 1 47 47 VAL N N 47 120.548 120.548 122.376 -1.828 18509 1192 1 3 . 1 1 47 47 VAL C C 47 173.900 173.900 173.769 0.131 18509 1193 1 3 . 1 1 47 47 VAL CA C 47 58.792 58.792 60.284 -1.492 18509 1194 1 3 . 1 1 47 47 VAL H H 47 9.366 9.366 7.923 1.443 18509 1195 1 3 . 1 1 48 48 HIS N N 48 129.236 129.236 126.750 2.486 18509 1196 1 3 . 1 1 48 48 HIS C C 48 171.084 171.084 173.811 -2.727 18509 1197 1 3 . 1 1 48 48 HIS CA C 48 52.756 52.756 55.011 -2.255 18509 1198 1 3 . 1 1 48 48 HIS H H 48 10.210 10.210 7.837 2.373 18509 1199 1 3 . 1 1 49 49 GLU N N 49 118.119 118.119 119.759 -1.640 18509 1200 1 3 . 1 1 49 49 GLU C C 49 171.635 171.635 175.797 -4.162 18509 1201 1 3 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.315 2.444 18509 1202 1 3 . 1 1 49 49 GLU H H 49 8.492 8.492 8.945 -0.453 18509 1203 1 3 . 1 1 50 50 PHE N N 50 110.329 110.329 118.628 -8.299 18509 1204 1 3 . 1 1 50 50 PHE C C 50 175.252 175.252 175.808 -0.556 18509 1205 1 3 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.544 -5.644 18509 1206 1 3 . 1 1 50 50 PHE H H 50 8.580 8.580 8.724 -0.144 18509 1207 1 3 . 1 1 51 51 GLY N N 51 119.251 119.251 113.966 5.285 18509 1208 1 3 . 1 1 51 51 GLY C C 51 168.248 168.248 173.710 -5.462 18509 1209 1 3 . 1 1 51 51 GLY H H 51 10.208 10.208 8.515 1.693 18509 1210 1 3 . 1 1 52 52 ASP N N 52 114.958 114.958 125.379 -10.421 18509 1211 1 3 . 1 1 52 52 ASP CA C 52 48.891 48.891 52.137 -3.246 18509 1212 1 3 . 1 1 52 52 ASP H H 52 5.834 5.834 8.420 -2.586 18509 1213 1 3 . 1 1 53 53 ASN N N 53 128.224 128.224 117.785 10.439 18509 1214 1 3 . 1 1 53 53 ASN CA C 53 48.233 48.233 53.549 -5.316 18509 1215 1 3 . 1 1 53 53 ASN H H 53 9.360 9.360 8.252 1.108 18509 1216 1 3 . 1 1 54 54 THR C C 54 168.656 168.656 174.661 -6.005 18509 1217 1 3 . 1 1 55 55 ALA N N 55 126.661 126.661 120.675 5.986 18509 1218 1 3 . 1 1 55 55 ALA C C 55 174.185 174.185 176.061 -1.876 18509 1219 1 3 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.126 -4.971 18509 1220 1 3 . 1 1 55 55 ALA H H 55 8.390 8.390 8.417 -0.027 18509 1221 1 3 . 1 1 56 56 GLY N N 56 107.903 107.903 107.074 0.829 18509 1222 1 3 . 1 1 56 56 GLY C C 56 171.578 171.578 172.933 -1.355 18509 1223 1 3 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.498 -2.918 18509 1224 1 3 . 1 1 56 56 GLY H H 56 7.282 7.282 7.599 -0.317 18509 1225 1 3 . 1 1 57 57 CYS N N 57 117.952 117.952 123.477 -5.525 18509 1226 1 3 . 1 1 57 57 CYS C C 57 175.209 175.209 174.899 0.310 18509 1227 1 3 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.788 -7.700 18509 1228 1 3 . 1 1 57 57 CYS H H 57 8.900 8.900 8.448 0.452 18509 1229 1 3 . 1 1 58 58 THR N N 58 119.852 119.852 120.191 -0.339 18509 1230 1 3 . 1 1 58 58 THR CA C 58 58.239 58.239 65.165 -6.926 18509 1231 1 3 . 1 1 58 58 THR H H 58 8.505 8.505 8.350 0.155 18509 1232 1 3 . 1 1 59 59 SER C C 59 170.763 170.763 175.876 -5.113 18509 1233 1 3 . 1 1 59 59 SER CA C 59 55.609 55.609 62.167 -6.558 18509 1234 1 3 . 1 1 60 60 ALA N N 60 119.753 119.753 120.776 -1.023 18509 1235 1 3 . 1 1 60 60 ALA CA C 60 49.940 49.940 51.933 -1.993 18509 1236 1 3 . 1 1 60 60 ALA H H 60 6.898 6.898 8.365 -1.467 18509 1237 1 3 . 1 1 61 61 GLY N N 61 101.351 101.351 107.898 -6.547 18509 1238 1 3 . 1 1 61 61 GLY CA C 61 42.805 42.805 44.761 -1.956 18509 1239 1 3 . 1 1 61 61 GLY H H 61 7.730 7.730 7.487 0.243 18509 1240 1 3 . 1 1 62 62 PRO C C 62 172.276 172.276 175.564 -3.288 18509 1241 1 3 . 1 1 63 63 HIS N N 63 115.023 115.023 120.964 -5.941 18509 1242 1 3 . 1 1 63 63 HIS CA C 63 52.119 52.119 55.339 -3.220 18509 1243 1 3 . 1 1 63 63 HIS H H 63 7.474 7.474 8.412 -0.938 18509 1244 1 3 . 1 1 64 64 PHE C C 64 171.731 171.731 173.545 -1.814 18509 1245 1 3 . 1 1 65 65 ASN N N 65 126.978 126.978 120.728 6.250 18509 1246 1 3 . 1 1 65 65 ASN CA C 65 47.753 47.753 51.553 -3.800 18509 1247 1 3 . 1 1 65 65 ASN H H 65 9.426 9.426 8.392 1.034 18509 1248 1 3 . 1 1 67 67 LEU N N 67 117.937 117.937 119.495 -1.558 18509 1249 1 3 . 1 1 67 67 LEU C C 67 172.580 172.580 178.610 -6.030 18509 1250 1 3 . 1 1 67 67 LEU CA C 67 50.911 50.911 57.250 -6.339 18509 1251 1 3 . 1 1 67 67 LEU H H 67 7.720 7.720 9.123 -1.403 18509 1252 1 3 . 1 1 68 68 SER N N 68 110.842 110.842 114.210 -3.368 18509 1253 1 3 . 1 1 68 68 SER CA C 68 55.953 55.953 61.049 -5.096 18509 1254 1 3 . 1 1 68 68 SER H H 68 7.428 7.428 7.756 -0.328 18509 1255 1 3 . 1 1 69 69 ARG N N 69 120.782 120.782 121.109 -0.327 18509 1256 1 3 . 1 1 69 69 ARG C C 69 173.381 173.381 177.819 -4.438 18509 1257 1 3 . 1 1 69 69 ARG CA C 69 50.543 50.543 58.093 -7.550 18509 1258 1 3 . 1 1 69 69 ARG H H 69 8.508 8.508 7.350 1.158 18509 1259 1 3 . 1 1 70 70 LYS N N 70 118.055 118.055 116.295 1.760 18509 1260 1 3 . 1 1 70 70 LYS C C 70 169.994 169.994 177.544 -7.550 18509 1261 1 3 . 1 1 70 70 LYS CA C 70 52.596 52.596 58.356 -5.761 18509 1262 1 3 . 1 1 70 70 LYS H H 70 8.745 8.745 7.459 1.286 18509 1263 1 3 . 1 1 71 71 HIS N N 71 111.871 111.871 115.079 -3.208 18509 1264 1 3 . 1 1 71 71 HIS C C 71 171.534 171.534 174.916 -3.382 18509 1265 1 3 . 1 1 71 71 HIS CA C 71 52.549 52.549 56.635 -4.085 18509 1266 1 3 . 1 1 71 71 HIS H H 71 7.152 7.152 7.796 -0.644 18509 1267 1 3 . 1 1 72 72 GLY N N 72 112.910 112.910 107.430 5.480 18509 1268 1 3 . 1 1 72 72 GLY C C 72 168.634 168.634 172.737 -4.103 18509 1269 1 3 . 1 1 72 72 GLY CA C 72 41.274 41.274 45.660 -4.386 18509 1270 1 3 . 1 1 72 72 GLY H H 72 7.209 7.209 8.367 -1.158 18509 1271 1 3 . 1 1 73 73 GLY N N 73 105.207 105.207 105.789 -0.582 18509 1272 1 3 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.588 -2.367 18509 1273 1 3 . 1 1 73 73 GLY H H 73 8.789 8.789 7.510 1.279 18509 1274 1 3 . 1 1 74 74 PRO C C 74 175.753 175.753 177.703 -1.950 18509 1275 1 3 . 1 1 75 75 LYS N N 75 114.868 114.868 117.424 -2.556 18509 1276 1 3 . 1 1 75 75 LYS C C 75 173.640 173.640 176.462 -2.822 18509 1277 1 3 . 1 1 75 75 LYS CA C 75 51.103 51.103 58.528 -7.425 18509 1278 1 3 . 1 1 75 75 LYS H H 75 8.651 8.651 8.206 0.445 18509 1279 1 3 . 1 1 76 76 ASP N N 76 120.414 120.414 115.147 5.267 18509 1280 1 3 . 1 1 76 76 ASP C C 76 172.557 172.557 174.602 -2.045 18509 1281 1 3 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.564 -3.255 18509 1282 1 3 . 1 1 76 76 ASP H H 76 7.461 7.461 7.439 0.022 18509 1283 1 3 . 1 1 77 77 GLU N N 77 120.820 120.820 121.081 -0.261 18509 1284 1 3 . 1 1 77 77 GLU C C 77 174.101 174.101 174.500 -0.399 18509 1285 1 3 . 1 1 77 77 GLU CA C 77 55.513 55.513 56.150 -0.637 18509 1286 1 3 . 1 1 77 77 GLU H H 77 8.315 8.315 7.916 0.399 18509 1287 1 3 . 1 1 78 78 GLU N N 78 119.251 119.251 124.019 -4.768 18509 1288 1 3 . 1 1 78 78 GLU C C 78 168.285 168.285 176.133 -7.848 18509 1289 1 3 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.238 -5.160 18509 1290 1 3 . 1 1 78 78 GLU H H 78 8.109 8.109 8.722 -0.613 18509 1291 1 3 . 1 1 79 79 ARG N N 79 118.991 118.991 115.283 3.708 18509 1292 1 3 . 1 1 79 79 ARG C C 79 172.123 172.123 177.115 -4.992 18509 1293 1 3 . 1 1 79 79 ARG CA C 79 51.074 51.074 58.096 -7.022 18509 1294 1 3 . 1 1 79 79 ARG H H 79 6.999 6.999 8.519 -1.520 18509 1295 1 3 . 1 1 80 80 HIS N N 80 118.000 118.000 118.747 -0.747 18509 1296 1 3 . 1 1 80 80 HIS CA C 80 49.953 49.953 57.870 -7.917 18509 1297 1 3 . 1 1 80 80 HIS H H 80 8.355 8.355 8.328 0.027 18509 1298 1 3 . 1 1 81 81 VAL C C 81 173.460 173.460 175.640 -2.180 18509 1299 1 3 . 1 1 82 82 GLY N N 82 97.322 97.322 106.879 -9.557 18509 1300 1 3 . 1 1 82 82 GLY C C 82 170.370 170.370 173.323 -2.953 18509 1301 1 3 . 1 1 82 82 GLY CA C 82 42.688 42.688 46.057 -3.369 18509 1302 1 3 . 1 1 82 82 GLY H H 82 8.487 8.487 7.698 0.789 18509 1303 1 3 . 1 1 83 83 ASP N N 83 120.890 120.890 116.182 4.708 18509 1304 1 3 . 1 1 83 83 ASP C C 83 168.737 168.737 173.809 -5.072 18509 1305 1 3 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.350 -0.432 18509 1306 1 3 . 1 1 83 83 ASP H H 83 7.127 7.127 7.344 -0.217 18509 1307 1 3 . 1 1 84 84 LEU N N 84 120.154 120.154 122.630 -2.476 18509 1308 1 3 . 1 1 84 84 LEU C C 84 173.212 173.212 174.305 -1.093 18509 1309 1 3 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.654 -4.221 18509 1310 1 3 . 1 1 84 84 LEU H H 84 7.128 7.128 8.209 -1.081 18509 1311 1 3 . 1 1 85 85 GLY N N 85 106.867 106.867 111.407 -4.540 18509 1312 1 3 . 1 1 85 85 GLY C C 85 167.654 167.654 172.184 -4.530 18509 1313 1 3 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.024 -2.013 18509 1314 1 3 . 1 1 85 85 GLY H H 85 8.260 8.260 7.947 0.313 18509 1315 1 3 . 1 1 86 86 ASN N N 86 117.454 117.454 121.660 -4.206 18509 1316 1 3 . 1 1 86 86 ASN C C 86 173.942 173.942 173.886 0.056 18509 1317 1 3 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.805 -3.539 18509 1318 1 3 . 1 1 86 86 ASN H H 86 8.041 8.041 8.366 -0.325 18509 1319 1 3 . 1 1 87 87 VAL N N 87 113.370 113.370 117.846 -4.476 18509 1320 1 3 . 1 1 87 87 VAL C C 87 171.526 171.526 173.734 -2.208 18509 1321 1 3 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.876 -5.168 18509 1322 1 3 . 1 1 87 87 VAL H H 87 8.960 8.960 8.389 0.571 18509 1323 1 3 . 1 1 88 88 THR N N 88 117.939 117.939 123.268 -5.329 18509 1324 1 3 . 1 1 88 88 THR C C 88 170.367 170.367 172.768 -2.401 18509 1325 1 3 . 1 1 88 88 THR CA C 88 58.694 58.694 61.419 -2.725 18509 1326 1 3 . 1 1 88 88 THR H H 88 8.681 8.681 8.299 0.382 18509 1327 1 3 . 1 1 89 89 ALA N N 89 128.674 128.674 129.412 -0.738 18509 1328 1 3 . 1 1 89 89 ALA C C 89 174.480 174.480 176.258 -1.778 18509 1329 1 3 . 1 1 89 89 ALA CA C 89 46.369 46.369 49.734 -3.365 18509 1330 1 3 . 1 1 89 89 ALA H H 89 9.377 9.377 8.159 1.218 18509 1331 1 3 . 1 1 90 90 ASP N N 90 124.235 124.235 121.190 3.045 18509 1332 1 3 . 1 1 90 90 ASP C C 90 173.825 173.825 177.319 -3.494 18509 1333 1 3 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.558 -3.211 18509 1334 1 3 . 1 1 90 90 ASP H H 90 8.455 8.455 8.523 -0.068 18509 1335 1 3 . 1 1 91 91 LYS N N 91 114.942 114.942 118.681 -3.739 18509 1336 1 3 . 1 1 91 91 LYS C C 91 174.101 174.101 176.174 -2.073 18509 1337 1 3 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.578 -3.299 18509 1338 1 3 . 1 1 91 91 LYS H H 91 8.231 8.231 8.594 -0.363 18509 1339 1 3 . 1 1 92 92 ASP N N 92 119.251 119.251 117.147 2.104 18509 1340 1 3 . 1 1 92 92 ASP C C 92 173.020 173.020 176.790 -3.770 18509 1341 1 3 . 1 1 92 92 ASP CA C 92 51.127 51.127 54.206 -3.079 18509 1342 1 3 . 1 1 92 92 ASP H H 92 8.109 8.109 7.682 0.427 18509 1343 1 3 . 1 1 93 93 GLY N N 93 110.868 110.868 108.944 1.924 18509 1344 1 3 . 1 1 93 93 GLY C C 93 169.706 169.706 172.939 -3.233 18509 1345 1 3 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.565 -1.802 18509 1346 1 3 . 1 1 93 93 GLY H H 93 8.405 8.405 8.286 0.119 18509 1347 1 3 . 1 1 94 94 VAL N N 94 118.755 118.755 113.501 5.254 18509 1348 1 3 . 1 1 94 94 VAL C C 94 173.510 173.510 173.613 -0.103 18509 1349 1 3 . 1 1 94 94 VAL CA C 94 58.185 58.185 59.286 -1.101 18509 1350 1 3 . 1 1 94 94 VAL H H 94 7.814 7.814 7.541 0.273 18509 1351 1 3 . 1 1 95 95 ALA N N 95 131.313 131.313 127.200 4.113 18509 1352 1 3 . 1 1 95 95 ALA C C 95 171.635 171.635 175.325 -3.690 18509 1353 1 3 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.524 -3.610 18509 1354 1 3 . 1 1 95 95 ALA H H 95 9.763 9.763 9.074 0.689 18509 1355 1 3 . 1 1 96 96 ASP N N 96 125.170 125.170 126.325 -1.155 18509 1356 1 3 . 1 1 96 96 ASP C C 96 172.336 172.336 175.453 -3.117 18509 1357 1 3 . 1 1 96 96 ASP H H 96 8.515 8.515 8.741 -0.226 18509 1358 1 3 . 1 1 97 97 VAL N N 97 125.879 125.879 127.605 -1.726 18509 1359 1 3 . 1 1 97 97 VAL C C 97 173.488 173.488 173.393 0.095 18509 1360 1 3 . 1 1 97 97 VAL CA C 97 58.243 58.243 60.110 -1.867 18509 1361 1 3 . 1 1 97 97 VAL H H 97 8.703 8.703 8.707 -0.004 18509 1362 1 3 . 1 1 98 98 SER N N 98 123.017 123.017 122.267 0.750 18509 1363 1 3 . 1 1 98 98 SER C C 98 169.715 169.715 173.141 -3.426 18509 1364 1 3 . 1 1 98 98 SER CA C 98 55.068 55.068 57.309 -2.241 18509 1365 1 3 . 1 1 98 98 SER H H 98 8.784 8.784 8.258 0.526 18509 1366 1 3 . 1 1 99 99 ILE N N 99 125.807 125.807 119.301 6.506 18509 1367 1 3 . 1 1 99 99 ILE C C 99 171.321 171.321 175.066 -3.745 18509 1368 1 3 . 1 1 99 99 ILE CA C 99 57.155 57.155 59.588 -2.433 18509 1369 1 3 . 1 1 99 99 ILE H H 99 9.411 9.411 7.589 1.822 18509 1370 1 3 . 1 1 100 100 GLU N N 100 124.068 124.068 122.542 1.526 18509 1371 1 3 . 1 1 100 100 GLU C C 100 172.098 172.098 174.769 -2.671 18509 1372 1 3 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.862 -2.572 18509 1373 1 3 . 1 1 100 100 GLU H H 100 8.652 8.652 8.511 0.141 18509 1374 1 3 . 1 1 101 101 ASP N N 101 126.109 126.109 123.065 3.044 18509 1375 1 3 . 1 1 101 101 ASP C C 101 171.144 171.144 175.386 -4.242 18509 1376 1 3 . 1 1 101 101 ASP CA C 101 51.419 51.419 52.537 -1.118 18509 1377 1 3 . 1 1 101 101 ASP H H 101 9.317 9.317 8.392 0.925 18509 1378 1 3 . 1 1 102 102 SER N N 102 118.470 118.470 117.541 0.929 18509 1379 1 3 . 1 1 102 102 SER C C 102 171.596 171.596 176.078 -4.482 18509 1380 1 3 . 1 1 102 102 SER CA C 102 55.245 55.245 59.993 -4.748 18509 1381 1 3 . 1 1 102 102 SER H H 102 8.933 8.933 8.636 0.297 18509 1382 1 3 . 1 1 103 103 VAL N N 103 123.179 123.179 122.495 0.684 18509 1383 1 3 . 1 1 103 103 VAL CA C 103 61.450 61.450 64.112 -2.662 18509 1384 1 3 . 1 1 103 103 VAL H H 103 8.148 8.148 8.627 -0.479 18509 1385 1 3 . 1 1 104 104 ILE C C 104 169.576 169.576 176.809 -7.233 18509 1386 1 3 . 1 1 104 104 ILE CA C 104 60.194 60.194 61.846 -1.652 18509 1387 1 3 . 1 1 105 105 SER N N 105 107.618 107.618 117.162 -9.544 18509 1388 1 3 . 1 1 105 105 SER C C 105 170.046 170.046 174.049 -4.003 18509 1389 1 3 . 1 1 105 105 SER CA C 105 52.550 52.550 56.958 -4.408 18509 1390 1 3 . 1 1 105 105 SER H H 105 6.988 6.988 7.449 -0.461 18509 1391 1 3 . 1 1 106 106 LEU N N 106 120.137 120.137 125.160 -5.023 18509 1392 1 3 . 1 1 106 106 LEU H H 106 8.313 8.313 7.639 0.674 18509 1393 1 3 . 1 1 107 107 SER C C 107 170.701 170.701 175.318 -4.617 18509 1394 1 3 . 1 1 107 107 SER CA C 107 54.540 54.540 59.447 -4.907 18509 1395 1 3 . 1 1 108 108 GLY N N 108 107.603 107.603 112.842 -5.239 18509 1396 1 3 . 1 1 108 108 GLY C C 108 173.128 173.128 174.670 -1.542 18509 1397 1 3 . 1 1 108 108 GLY CA C 108 41.287 41.287 43.569 -2.282 18509 1398 1 3 . 1 1 108 108 GLY H H 108 8.717 8.717 8.104 0.613 18509 1399 1 3 . 1 1 109 109 ASP N N 109 120.664 120.664 120.548 0.116 18509 1400 1 3 . 1 1 109 109 ASP C C 109 171.904 171.904 177.966 -6.062 18509 1401 1 3 . 1 1 109 109 ASP H H 109 9.019 9.019 8.895 0.124 18509 1402 1 3 . 1 1 110 110 HIS N N 110 116.324 116.324 117.603 -1.279 18509 1403 1 3 . 1 1 110 110 HIS H H 110 9.283 9.283 7.968 1.315 18509 1404 1 3 . 1 1 111 111 SER N N 111 110.225 110.225 113.330 -3.105 18509 1405 1 3 . 1 1 111 111 SER CA C 111 54.681 54.681 59.184 -4.503 18509 1406 1 3 . 1 1 111 111 SER H H 111 7.156 7.156 8.131 -0.975 18509 1407 1 3 . 1 1 112 112 ILE N N 112 117.053 117.053 122.546 -5.493 18509 1408 1 3 . 1 1 112 112 ILE C C 112 171.419 171.419 175.906 -4.487 18509 1409 1 3 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.061 -3.822 18509 1410 1 3 . 1 1 112 112 ILE H H 112 7.837 7.837 8.450 -0.613 18509 1411 1 3 . 1 1 113 113 ILE N N 113 121.032 121.032 114.867 6.165 18509 1412 1 3 . 1 1 113 113 ILE C C 113 173.604 173.604 176.116 -2.512 18509 1413 1 3 . 1 1 113 113 ILE CA C 113 58.318 58.318 59.864 -1.546 18509 1414 1 3 . 1 1 113 113 ILE H H 113 7.592 7.592 6.917 0.675 18509 1415 1 3 . 1 1 114 114 GLY N N 114 112.661 112.661 107.845 4.816 18509 1416 1 3 . 1 1 114 114 GLY C C 114 169.739 169.739 173.766 -4.027 18509 1417 1 3 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.288 -2.378 18509 1418 1 3 . 1 1 114 114 GLY H H 114 9.575 9.575 8.625 0.950 18509 1419 1 3 . 1 1 115 115 ARG N N 115 118.398 118.398 122.356 -3.958 18509 1420 1 3 . 1 1 115 115 ARG C C 115 171.079 171.079 176.341 -5.262 18509 1421 1 3 . 1 1 115 115 ARG CA C 115 51.663 51.663 53.737 -2.074 18509 1422 1 3 . 1 1 115 115 ARG H H 115 7.464 7.464 7.911 -0.447 18509 1423 1 3 . 1 1 116 116 THR N N 116 112.218 112.218 118.899 -6.681 18509 1424 1 3 . 1 1 116 116 THR C C 116 169.821 169.821 175.389 -5.568 18509 1425 1 3 . 1 1 116 116 THR CA C 116 59.633 59.633 63.190 -3.557 18509 1426 1 3 . 1 1 116 116 THR H H 116 6.677 6.677 8.321 -1.644 18509 1427 1 3 . 1 1 117 117 LEU N N 117 129.477 129.477 124.661 4.816 18509 1428 1 3 . 1 1 117 117 LEU C C 117 171.126 171.126 175.257 -4.131 18509 1429 1 3 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.274 -3.859 18509 1430 1 3 . 1 1 117 117 LEU H H 117 8.799 8.799 8.413 0.386 18509 1431 1 3 . 1 1 118 118 VAL N N 118 125.091 125.091 123.760 1.331 18509 1432 1 3 . 1 1 118 118 VAL C C 118 170.267 170.267 175.736 -5.469 18509 1433 1 3 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.271 -3.132 18509 1434 1 3 . 1 1 118 118 VAL H H 118 8.906 8.906 8.784 0.122 18509 1435 1 3 . 1 1 119 119 VAL N N 119 120.716 120.716 124.109 -3.393 18509 1436 1 3 . 1 1 119 119 VAL C C 119 171.175 171.175 174.250 -3.075 18509 1437 1 3 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.129 -3.858 18509 1438 1 3 . 1 1 119 119 VAL H H 119 7.982 7.982 8.451 -0.469 18509 1439 1 3 . 1 1 120 120 HIS N N 120 125.052 125.052 118.308 6.744 18509 1440 1 3 . 1 1 120 120 HIS C C 120 172.599 172.599 173.739 -1.140 18509 1441 1 3 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.245 -1.851 18509 1442 1 3 . 1 1 120 120 HIS H H 120 8.935 8.935 8.289 0.646 18509 1443 1 3 . 1 1 121 121 GLU N N 121 121.453 121.453 123.324 -1.871 18509 1444 1 3 . 1 1 121 121 GLU C C 121 172.304 172.304 175.044 -2.740 18509 1445 1 3 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.632 -0.542 18509 1446 1 3 . 1 1 121 121 GLU H H 121 9.178 9.178 8.463 0.715 18509 1447 1 3 . 1 1 122 122 LYS N N 122 115.248 115.248 117.993 -2.745 18509 1448 1 3 . 1 1 122 122 LYS C C 122 171.523 171.523 174.410 -2.887 18509 1449 1 3 . 1 1 122 122 LYS CA C 122 50.619 50.619 54.674 -4.055 18509 1450 1 3 . 1 1 122 122 LYS H H 122 8.478 8.478 7.808 0.670 18509 1451 1 3 . 1 1 123 123 ALA N N 123 120.866 120.866 122.806 -1.940 18509 1452 1 3 . 1 1 123 123 ALA C C 123 173.219 173.219 176.952 -3.733 18509 1453 1 3 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.299 -3.449 18509 1454 1 3 . 1 1 123 123 ALA H H 123 7.796 7.796 8.452 -0.656 18509 1455 1 3 . 1 1 124 124 ASP N N 124 121.799 121.799 124.227 -2.428 18509 1456 1 3 . 1 1 124 124 ASP C C 124 174.458 174.458 175.170 -0.712 18509 1457 1 3 . 1 1 124 124 ASP CA C 124 49.408 49.408 52.937 -3.529 18509 1458 1 3 . 1 1 124 124 ASP H H 124 10.165 10.165 8.612 1.553 18509 1459 1 3 . 1 1 125 125 ASP N N 125 129.369 129.369 120.997 8.372 18509 1460 1 3 . 1 1 125 125 ASP C C 125 175.231 175.231 175.999 -0.768 18509 1461 1 3 . 1 1 125 125 ASP CA C 125 50.939 50.939 54.207 -3.268 18509 1462 1 3 . 1 1 125 125 ASP H H 125 10.055 10.055 7.642 2.413 18509 1463 1 3 . 1 1 126 126 LEU N N 126 117.190 117.190 124.977 -7.787 18509 1464 1 3 . 1 1 126 126 LEU C C 126 173.964 173.964 178.768 -4.804 18509 1465 1 3 . 1 1 126 126 LEU H H 126 10.483 10.483 8.717 1.766 18509 1466 1 3 . 1 1 127 127 GLY N N 127 103.809 103.809 104.013 -0.204 18509 1467 1 3 . 1 1 127 127 GLY CA C 127 42.878 42.878 45.977 -3.099 18509 1468 1 3 . 1 1 127 127 GLY H H 127 8.637 8.637 8.673 -0.036 18509 1469 1 3 . 1 1 128 128 LYS N N 128 118.290 118.290 119.017 -0.727 18509 1470 1 3 . 1 1 128 128 LYS CA C 128 51.740 51.740 54.888 -3.148 18509 1471 1 3 . 1 1 128 128 LYS H H 128 7.158 7.158 7.109 0.049 18509 1472 1 3 . 1 1 129 129 GLY N N 129 108.507 108.507 107.758 0.749 18509 1473 1 3 . 1 1 129 129 GLY C C 129 171.524 171.524 174.463 -2.939 18509 1474 1 3 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.493 -4.380 18509 1475 1 3 . 1 1 129 129 GLY H H 129 8.913 8.913 7.816 1.097 18509 1476 1 3 . 1 1 130 130 GLY N N 130 108.537 108.537 107.615 0.922 18509 1477 1 3 . 1 1 130 130 GLY C C 130 169.994 169.994 173.269 -3.275 18509 1478 1 3 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.767 -2.348 18509 1479 1 3 . 1 1 130 130 GLY H H 130 8.723 8.723 7.975 0.748 18509 1480 1 3 . 1 1 131 131 ASN N N 131 111.951 111.951 119.237 -7.286 18509 1481 1 3 . 1 1 131 131 ASN C C 131 172.236 172.236 175.605 -3.369 18509 1482 1 3 . 1 1 131 131 ASN H H 131 7.152 7.152 8.037 -0.885 18509 1483 1 3 . 1 1 132 132 GLU N N 132 120.461 120.461 120.562 -0.101 18509 1484 1 3 . 1 1 132 132 GLU C C 132 171.084 171.084 177.970 -6.886 18509 1485 1 3 . 1 1 132 132 GLU H H 132 8.935 8.935 8.932 0.003 18509 1486 1 3 . 1 1 133 133 GLU N N 133 120.137 120.137 117.973 2.164 18509 1487 1 3 . 1 1 133 133 GLU C C 133 176.239 176.239 179.108 -2.869 18509 1488 1 3 . 1 1 133 133 GLU H H 133 8.775 8.775 8.775 -0.000 18509 1489 1 3 . 1 1 134 134 SER N N 134 114.981 114.981 114.963 0.018 18509 1490 1 3 . 1 1 134 134 SER CA C 134 59.046 59.046 61.133 -2.087 18509 1491 1 3 . 1 1 134 134 SER H H 134 8.117 8.117 7.855 0.262 18509 1492 1 3 . 1 1 135 135 THR N N 135 102.263 102.263 117.357 -15.094 18509 1493 1 3 . 1 1 135 135 THR C C 135 172.804 172.804 175.373 -2.569 18509 1494 1 3 . 1 1 135 135 THR CA C 135 60.029 60.029 65.545 -5.516 18509 1495 1 3 . 1 1 135 135 THR H H 135 7.206 7.206 8.077 -0.871 18509 1496 1 3 . 1 1 136 136 LYS N N 136 122.108 122.108 119.117 2.991 18509 1497 1 3 . 1 1 136 136 LYS H H 136 7.884 7.884 7.415 0.469 18509 1498 1 3 . 1 1 137 137 THR N N 137 105.718 105.718 111.860 -6.142 18509 1499 1 3 . 1 1 137 137 THR H H 137 8.630 8.630 7.688 0.942 18509 1500 1 3 . 1 1 138 138 GLY N N 138 111.372 111.372 111.704 -0.332 18509 1501 1 3 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.296 -2.813 18509 1502 1 3 . 1 1 138 138 GLY H H 138 7.426 7.426 7.752 -0.326 18509 1503 1 3 . 1 1 139 139 ASN N N 139 107.496 107.496 119.306 -11.810 18509 1504 1 3 . 1 1 139 139 ASN H H 139 7.545 7.545 7.780 -0.235 18509 1505 1 3 . 1 1 140 140 ALA N N 140 114.542 114.542 128.484 -13.942 18509 1506 1 3 . 1 1 140 140 ALA C C 140 173.571 173.571 176.614 -3.043 18509 1507 1 3 . 1 1 140 140 ALA H H 140 6.368 6.368 8.314 -1.946 18509 1508 1 3 . 1 1 141 141 GLY N N 141 105.287 105.287 107.995 -2.708 18509 1509 1 3 . 1 1 141 141 GLY C C 141 173.542 173.542 175.558 -2.016 18509 1510 1 3 . 1 1 141 141 GLY H H 141 8.271 8.271 8.795 -0.524 18509 1511 1 3 . 1 1 142 142 SER N N 142 118.771 118.771 120.369 -1.598 18509 1512 1 3 . 1 1 142 142 SER C C 142 170.188 170.188 175.190 -5.002 18509 1513 1 3 . 1 1 142 142 SER H H 142 9.196 9.196 8.133 1.063 18509 1514 1 3 . 1 1 143 143 ARG N N 143 120.189 120.189 115.769 4.420 18509 1515 1 3 . 1 1 143 143 ARG C C 143 171.596 171.596 176.378 -4.782 18509 1516 1 3 . 1 1 143 143 ARG H H 143 8.943 8.943 7.934 1.009 18509 1517 1 3 . 1 1 144 144 LEU N N 144 122.907 122.907 122.411 0.496 18509 1518 1 3 . 1 1 144 144 LEU C C 144 174.393 174.393 175.414 -1.021 18509 1519 1 3 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.719 -3.344 18509 1520 1 3 . 1 1 144 144 LEU H H 144 8.395 8.395 7.923 0.472 18509 1521 1 3 . 1 1 145 145 ALA N N 145 114.159 114.159 115.768 -1.609 18509 1522 1 3 . 1 1 145 145 ALA C C 145 171.752 171.752 175.088 -3.336 18509 1523 1 3 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.303 -3.174 18509 1524 1 3 . 1 1 145 145 ALA H H 145 7.356 7.356 7.593 -0.237 18509 1525 1 3 . 1 1 146 146 CYS N N 146 110.738 110.738 121.195 -10.457 18509 1526 1 3 . 1 1 146 146 CYS C C 146 170.087 170.087 174.577 -4.490 18509 1527 1 3 . 1 1 146 146 CYS CA C 146 51.077 51.077 56.425 -5.348 18509 1528 1 3 . 1 1 146 146 CYS H H 146 9.008 9.008 8.061 0.947 18509 1529 1 3 . 1 1 147 147 GLY N N 147 106.461 106.461 107.514 -1.053 18509 1530 1 3 . 1 1 147 147 GLY C C 147 167.909 167.909 172.402 -4.493 18509 1531 1 3 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.345 -2.671 18509 1532 1 3 . 1 1 147 147 GLY H H 147 8.018 8.018 8.294 -0.276 18509 1533 1 3 . 1 1 148 148 VAL N N 148 124.054 124.054 125.821 -1.767 18509 1534 1 3 . 1 1 148 148 VAL C C 148 172.084 172.084 174.342 -2.258 18509 1535 1 3 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.402 -2.767 18509 1536 1 3 . 1 1 148 148 VAL H H 148 8.434 8.434 7.951 0.483 18509 1537 1 3 . 1 1 149 149 ILE N N 149 126.918 126.918 130.264 -3.346 18509 1538 1 3 . 1 1 149 149 ILE C C 149 171.804 171.804 174.714 -2.910 18509 1539 1 3 . 1 1 149 149 ILE CA C 149 59.184 59.184 58.558 0.626 18509 1540 1 3 . 1 1 149 149 ILE H H 149 8.613 8.613 8.327 0.286 18509 1541 1 3 . 1 1 150 150 GLY N N 150 116.493 116.493 112.597 3.896 18509 1542 1 3 . 1 1 150 150 GLY C C 150 170.188 170.188 172.468 -2.280 18509 1543 1 3 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.157 -4.037 18509 1544 1 3 . 1 1 150 150 GLY H H 150 9.283 9.283 9.218 0.065 18509 1545 1 3 . 1 1 151 151 ILE N N 151 120.189 120.189 123.129 -2.940 18509 1546 1 3 . 1 1 151 151 ILE C C 151 172.231 172.231 174.527 -2.296 18509 1547 1 3 . 1 1 151 151 ILE CA C 151 60.372 60.372 62.058 -1.686 18509 1548 1 3 . 1 1 151 151 ILE H H 151 8.943 8.943 8.394 0.549 18509 1549 1 3 . 1 1 152 152 ALA N N 152 129.719 129.719 131.713 -1.994 18509 1550 1 3 . 1 1 152 152 ALA CA C 152 46.772 46.772 50.881 -4.109 18509 1551 1 3 . 1 1 152 152 ALA H H 152 8.170 8.170 7.912 0.258 18509 1552 1 4 . 1 1 2 2 THR C C 2 170.139 170.139 174.414 -4.275 18509 1553 1 4 . 1 1 3 3 LYS N N 3 123.998 123.998 118.870 5.128 18509 1554 1 4 . 1 1 3 3 LYS C C 3 171.607 171.607 174.414 -2.807 18509 1555 1 4 . 1 1 3 3 LYS CA C 3 51.178 51.178 55.174 -3.996 18509 1556 1 4 . 1 1 3 3 LYS H H 3 8.666 8.666 7.714 0.952 18509 1557 1 4 . 1 1 4 4 ALA N N 4 123.295 123.295 121.442 1.853 18509 1558 1 4 . 1 1 4 4 ALA C C 4 172.145 172.145 175.027 -2.882 18509 1559 1 4 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.544 -3.040 18509 1560 1 4 . 1 1 4 4 ALA H H 4 9.116 9.116 8.041 1.075 18509 1561 1 4 . 1 1 5 5 VAL N N 5 121.466 121.466 115.639 5.827 18509 1562 1 4 . 1 1 5 5 VAL C C 5 167.836 167.836 174.039 -6.203 18509 1563 1 4 . 1 1 5 5 VAL CA C 5 56.875 56.875 59.087 -2.212 18509 1564 1 4 . 1 1 5 5 VAL H H 5 9.545 9.545 8.702 0.843 18509 1565 1 4 . 1 1 6 6 ALA N N 6 125.984 125.984 124.474 1.510 18509 1566 1 4 . 1 1 6 6 ALA C C 6 171.607 171.607 176.049 -4.442 18509 1567 1 4 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.402 -2.931 18509 1568 1 4 . 1 1 6 6 ALA H H 6 9.177 9.177 8.350 0.827 18509 1569 1 4 . 1 1 7 7 VAL N N 7 123.600 123.600 125.127 -1.527 18509 1570 1 4 . 1 1 7 7 VAL C C 7 172.244 172.244 174.823 -2.579 18509 1571 1 4 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.982 -3.506 18509 1572 1 4 . 1 1 7 7 VAL H H 7 9.116 9.116 8.163 0.953 18509 1573 1 4 . 1 1 8 8 LEU N N 8 126.455 126.455 123.764 2.691 18509 1574 1 4 . 1 1 8 8 LEU C C 8 172.557 172.557 175.207 -2.650 18509 1575 1 4 . 1 1 8 8 LEU CA C 8 51.052 51.052 52.998 -1.946 18509 1576 1 4 . 1 1 8 8 LEU H H 8 8.916 8.916 8.371 0.545 18509 1577 1 4 . 1 1 9 9 LYS N N 9 120.820 120.820 120.773 0.047 18509 1578 1 4 . 1 1 9 9 LYS C C 9 172.509 172.509 175.178 -2.669 18509 1579 1 4 . 1 1 9 9 LYS CA C 9 51.897 51.897 54.701 -2.804 18509 1580 1 4 . 1 1 9 9 LYS H H 9 8.315 8.315 8.243 0.072 18509 1581 1 4 . 1 1 10 10 GLY N N 10 111.249 111.249 111.645 -0.396 18509 1582 1 4 . 1 1 10 10 GLY C C 10 169.847 169.847 173.433 -3.586 18509 1583 1 4 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.259 -2.984 18509 1584 1 4 . 1 1 10 10 GLY H H 10 8.968 8.968 7.985 0.983 18509 1585 1 4 . 1 1 11 11 ASP N N 11 120.904 120.904 121.425 -0.521 18509 1586 1 4 . 1 1 11 11 ASP C C 11 173.132 173.132 177.207 -4.075 18509 1587 1 4 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.292 -3.975 18509 1588 1 4 . 1 1 11 11 ASP H H 11 8.745 8.745 8.219 0.526 18509 1589 1 4 . 1 1 12 12 GLY N N 12 109.862 109.862 108.181 1.681 18509 1590 1 4 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.582 -2.382 18509 1591 1 4 . 1 1 12 12 GLY H H 12 7.985 7.985 7.662 0.323 18509 1592 1 4 . 1 1 13 13 PRO C C 13 173.640 173.640 176.307 -2.667 18509 1593 1 4 . 1 1 14 14 VAL N N 14 120.414 120.414 117.545 2.869 18509 1594 1 4 . 1 1 14 14 VAL C C 14 172.804 172.804 174.404 -1.600 18509 1595 1 4 . 1 1 14 14 VAL CA C 14 59.884 59.884 59.823 0.061 18509 1596 1 4 . 1 1 14 14 VAL H H 14 7.476 7.476 7.869 -0.393 18509 1597 1 4 . 1 1 15 15 GLN N N 15 122.664 122.664 123.891 -1.227 18509 1598 1 4 . 1 1 15 15 GLN C C 15 171.168 171.168 175.113 -3.945 18509 1599 1 4 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.373 -3.694 18509 1600 1 4 . 1 1 15 15 GLN H H 15 7.938 7.938 8.250 -0.312 18509 1601 1 4 . 1 1 16 16 GLY N N 16 107.018 107.018 108.333 -1.315 18509 1602 1 4 . 1 1 16 16 GLY C C 16 167.726 167.726 171.752 -4.026 18509 1603 1 4 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.224 -1.599 18509 1604 1 4 . 1 1 16 16 GLY H H 16 8.288 8.288 8.390 -0.102 18509 1605 1 4 . 1 1 17 17 ILE N N 17 120.248 120.248 114.268 5.980 18509 1606 1 4 . 1 1 17 17 ILE C C 17 171.194 171.194 173.507 -2.313 18509 1607 1 4 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.488 -0.991 18509 1608 1 4 . 1 1 17 17 ILE H H 17 7.948 7.948 8.421 -0.473 18509 1609 1 4 . 1 1 18 18 ILE N N 18 125.851 125.851 123.378 2.473 18509 1610 1 4 . 1 1 18 18 ILE C C 18 168.889 168.889 174.584 -5.695 18509 1611 1 4 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.875 -6.444 18509 1612 1 4 . 1 1 18 18 ILE H H 18 8.725 8.725 8.505 0.220 18509 1613 1 4 . 1 1 19 19 ASN N N 19 123.256 123.256 125.100 -1.844 18509 1614 1 4 . 1 1 19 19 ASN C C 19 168.903 168.903 174.258 -5.355 18509 1615 1 4 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.003 -1.915 18509 1616 1 4 . 1 1 19 19 ASN H H 19 8.727 8.727 8.584 0.143 18509 1617 1 4 . 1 1 20 20 PHE N N 20 113.849 113.849 118.767 -4.918 18509 1618 1 4 . 1 1 20 20 PHE C C 20 173.219 173.219 174.334 -1.115 18509 1619 1 4 . 1 1 20 20 PHE CA C 20 52.058 52.058 55.570 -3.512 18509 1620 1 4 . 1 1 20 20 PHE H H 20 8.399 8.399 8.201 0.198 18509 1621 1 4 . 1 1 21 21 GLU N N 21 121.454 121.454 121.385 0.069 18509 1622 1 4 . 1 1 21 21 GLU C C 21 170.280 170.280 175.185 -4.905 18509 1623 1 4 . 1 1 21 21 GLU CA C 21 53.044 53.044 55.348 -2.304 18509 1624 1 4 . 1 1 21 21 GLU H H 21 9.526 9.526 8.834 0.692 18509 1625 1 4 . 1 1 22 22 GLN N N 22 130.340 130.340 122.156 8.184 18509 1626 1 4 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.265 -4.085 18509 1627 1 4 . 1 1 22 22 GLN H H 22 9.305 9.305 8.514 0.791 18509 1628 1 4 . 1 1 23 23 LYS N N 23 128.657 128.657 120.813 7.844 18509 1629 1 4 . 1 1 23 23 LYS CA C 23 57.241 57.241 57.722 -0.481 18509 1630 1 4 . 1 1 23 23 LYS H H 23 9.088 9.088 8.297 0.791 18509 1631 1 4 . 1 1 24 24 GLU CA C 24 51.392 51.392 57.944 -6.552 18509 1632 1 4 . 1 1 25 25 SER CA C 25 58.078 58.078 59.389 -1.311 18509 1633 1 4 . 1 1 27 27 GLY N N 27 108.125 108.125 109.736 -1.611 18509 1634 1 4 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.719 -1.794 18509 1635 1 4 . 1 1 27 27 GLY H H 27 8.032 8.032 8.413 -0.381 18509 1636 1 4 . 1 1 28 28 PRO C C 28 173.128 173.128 176.301 -3.173 18509 1637 1 4 . 1 1 29 29 VAL N N 29 121.267 121.267 120.350 0.917 18509 1638 1 4 . 1 1 29 29 VAL C C 29 172.198 172.198 175.523 -3.325 18509 1639 1 4 . 1 1 29 29 VAL CA C 29 57.720 57.720 60.778 -3.058 18509 1640 1 4 . 1 1 29 29 VAL H H 29 9.089 9.089 8.282 0.807 18509 1641 1 4 . 1 1 30 30 LYS N N 30 127.589 127.589 128.591 -1.002 18509 1642 1 4 . 1 1 30 30 LYS C C 30 172.098 172.098 175.554 -3.456 18509 1643 1 4 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.468 -2.826 18509 1644 1 4 . 1 1 30 30 LYS H H 30 9.200 9.200 7.919 1.281 18509 1645 1 4 . 1 1 31 31 VAL N N 31 126.037 126.037 117.593 8.444 18509 1646 1 4 . 1 1 31 31 VAL C C 31 172.244 172.244 174.446 -2.202 18509 1647 1 4 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.770 -2.631 18509 1648 1 4 . 1 1 31 31 VAL H H 31 9.282 9.282 7.989 1.293 18509 1649 1 4 . 1 1 32 32 TRP N N 32 125.414 125.414 125.591 -0.177 18509 1650 1 4 . 1 1 32 32 TRP C C 32 170.156 170.156 174.045 -3.889 18509 1651 1 4 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.515 -3.378 18509 1652 1 4 . 1 1 32 32 TRP H H 32 8.983 8.983 8.397 0.586 18509 1653 1 4 . 1 1 33 33 GLY N N 33 107.848 107.848 112.647 -4.799 18509 1654 1 4 . 1 1 33 33 GLY C C 33 168.400 168.400 171.807 -3.407 18509 1655 1 4 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.704 -3.137 18509 1656 1 4 . 1 1 33 33 GLY H H 33 8.360 8.360 7.780 0.580 18509 1657 1 4 . 1 1 34 34 SER N N 34 114.377 114.377 118.022 -3.645 18509 1658 1 4 . 1 1 34 34 SER C C 34 169.618 169.618 173.394 -3.776 18509 1659 1 4 . 1 1 34 34 SER CA C 34 53.875 53.875 56.546 -2.671 18509 1660 1 4 . 1 1 34 34 SER H H 34 7.838 7.838 8.240 -0.402 18509 1661 1 4 . 1 1 35 35 ILE N N 35 123.149 123.149 117.306 5.843 18509 1662 1 4 . 1 1 35 35 ILE C C 35 169.713 169.713 174.071 -4.358 18509 1663 1 4 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.614 -2.845 18509 1664 1 4 . 1 1 35 35 ILE H H 35 8.496 8.496 8.093 0.403 18509 1665 1 4 . 1 1 36 36 LYS N N 36 123.803 123.803 124.503 -0.700 18509 1666 1 4 . 1 1 36 36 LYS C C 36 172.260 172.260 175.378 -3.118 18509 1667 1 4 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.169 -3.019 18509 1668 1 4 . 1 1 36 36 LYS H H 36 9.091 9.091 8.909 0.182 18509 1669 1 4 . 1 1 37 37 GLY N N 37 105.495 105.495 109.574 -4.079 18509 1670 1 4 . 1 1 37 37 GLY C C 37 171.641 171.641 172.386 -0.745 18509 1671 1 4 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.885 -1.524 18509 1672 1 4 . 1 1 37 37 GLY H H 37 8.237 8.237 8.118 0.119 18509 1673 1 4 . 1 1 38 38 LEU N N 38 120.966 120.966 118.679 2.287 18509 1674 1 4 . 1 1 38 38 LEU C C 38 174.112 174.112 177.689 -3.577 18509 1675 1 4 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.878 -4.407 18509 1676 1 4 . 1 1 38 38 LEU H H 38 8.156 8.156 8.501 -0.345 18509 1677 1 4 . 1 1 39 39 THR N N 39 110.363 110.363 115.890 -5.527 18509 1678 1 4 . 1 1 39 39 THR C C 39 173.102 173.102 173.838 -0.736 18509 1679 1 4 . 1 1 39 39 THR CA C 39 58.194 58.194 63.979 -5.785 18509 1680 1 4 . 1 1 39 39 THR H H 39 8.660 8.660 8.349 0.311 18509 1681 1 4 . 1 1 40 40 GLU N N 40 125.818 125.818 126.525 -0.707 18509 1682 1 4 . 1 1 40 40 GLU C C 40 173.134 173.134 174.025 -0.891 18509 1683 1 4 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.924 -1.568 18509 1684 1 4 . 1 1 40 40 GLU H H 40 8.804 8.804 7.975 0.829 18509 1685 1 4 . 1 1 41 41 GLY N N 41 113.875 113.875 111.953 1.922 18509 1686 1 4 . 1 1 41 41 GLY C C 41 170.046 170.046 173.285 -3.239 18509 1687 1 4 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.992 -4.938 18509 1688 1 4 . 1 1 41 41 GLY H H 41 8.763 8.763 8.321 0.442 18509 1689 1 4 . 1 1 42 42 LEU N N 42 120.137 120.137 125.548 -5.411 18509 1690 1 4 . 1 1 42 42 LEU C C 42 174.218 174.218 176.520 -2.302 18509 1691 1 4 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.511 -3.356 18509 1692 1 4 . 1 1 42 42 LEU H H 42 8.313 8.313 8.495 -0.182 18509 1693 1 4 . 1 1 43 43 HIS N N 43 114.385 114.385 109.817 4.568 18509 1694 1 4 . 1 1 43 43 HIS C C 43 171.504 171.504 173.984 -2.480 18509 1695 1 4 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.105 -4.120 18509 1696 1 4 . 1 1 43 43 HIS H H 43 8.712 8.712 7.482 1.230 18509 1697 1 4 . 1 1 44 44 GLY N N 44 108.872 108.872 109.871 -0.999 18509 1698 1 4 . 1 1 44 44 GLY C C 44 168.656 168.656 172.591 -3.935 18509 1699 1 4 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.610 -1.415 18509 1700 1 4 . 1 1 44 44 GLY H H 44 8.875 8.875 7.986 0.889 18509 1701 1 4 . 1 1 45 45 PHE N N 45 126.439 126.439 123.538 2.901 18509 1702 1 4 . 1 1 45 45 PHE CA C 45 53.098 53.098 57.100 -4.002 18509 1703 1 4 . 1 1 45 45 PHE H H 45 8.111 8.111 8.132 -0.021 18509 1704 1 4 . 1 1 46 46 HIS N N 46 115.353 115.353 123.859 -8.506 18509 1705 1 4 . 1 1 46 46 HIS C C 46 172.415 172.415 173.490 -1.075 18509 1706 1 4 . 1 1 46 46 HIS CA C 46 49.206 49.206 55.712 -6.506 18509 1707 1 4 . 1 1 46 46 HIS H H 46 8.107 8.107 9.201 -1.094 18509 1708 1 4 . 1 1 47 47 VAL N N 47 120.548 120.548 123.582 -3.034 18509 1709 1 4 . 1 1 47 47 VAL C C 47 173.900 173.900 174.780 -0.880 18509 1710 1 4 . 1 1 47 47 VAL CA C 47 58.792 58.792 62.807 -4.015 18509 1711 1 4 . 1 1 47 47 VAL H H 47 9.366 9.366 7.991 1.375 18509 1712 1 4 . 1 1 48 48 HIS N N 48 129.236 129.236 123.397 5.839 18509 1713 1 4 . 1 1 48 48 HIS C C 48 171.084 171.084 174.085 -3.001 18509 1714 1 4 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.318 -1.562 18509 1715 1 4 . 1 1 48 48 HIS H H 48 10.210 10.210 8.083 2.127 18509 1716 1 4 . 1 1 49 49 GLU N N 49 118.119 118.119 125.553 -7.434 18509 1717 1 4 . 1 1 49 49 GLU C C 49 171.635 171.635 175.507 -3.872 18509 1718 1 4 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.781 1.978 18509 1719 1 4 . 1 1 49 49 GLU H H 49 8.492 8.492 7.464 1.028 18509 1720 1 4 . 1 1 50 50 PHE N N 50 110.329 110.329 123.349 -13.020 18509 1721 1 4 . 1 1 50 50 PHE C C 50 175.252 175.252 173.826 1.426 18509 1722 1 4 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.606 -5.706 18509 1723 1 4 . 1 1 50 50 PHE H H 50 8.580 8.580 8.598 -0.018 18509 1724 1 4 . 1 1 51 51 GLY N N 51 119.251 119.251 113.281 5.970 18509 1725 1 4 . 1 1 51 51 GLY C C 51 168.248 168.248 172.954 -4.706 18509 1726 1 4 . 1 1 51 51 GLY H H 51 10.208 10.208 7.880 2.328 18509 1727 1 4 . 1 1 52 52 ASP N N 52 114.958 114.958 119.225 -4.267 18509 1728 1 4 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.139 -5.248 18509 1729 1 4 . 1 1 52 52 ASP H H 52 5.834 5.834 8.462 -2.628 18509 1730 1 4 . 1 1 53 53 ASN N N 53 128.224 128.224 120.595 7.629 18509 1731 1 4 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.186 -3.953 18509 1732 1 4 . 1 1 53 53 ASN H H 53 9.360 9.360 8.065 1.295 18509 1733 1 4 . 1 1 54 54 THR C C 54 168.656 168.656 174.724 -6.068 18509 1734 1 4 . 1 1 55 55 ALA N N 55 126.661 126.661 119.514 7.147 18509 1735 1 4 . 1 1 55 55 ALA C C 55 174.185 174.185 176.306 -2.121 18509 1736 1 4 . 1 1 55 55 ALA CA C 55 46.155 46.155 50.742 -4.587 18509 1737 1 4 . 1 1 55 55 ALA H H 55 8.390 8.390 8.085 0.305 18509 1738 1 4 . 1 1 56 56 GLY N N 56 107.903 107.903 106.040 1.863 18509 1739 1 4 . 1 1 56 56 GLY C C 56 171.578 171.578 172.682 -1.104 18509 1740 1 4 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.717 -3.137 18509 1741 1 4 . 1 1 56 56 GLY H H 56 7.282 7.282 7.520 -0.238 18509 1742 1 4 . 1 1 57 57 CYS N N 57 117.952 117.952 123.671 -5.719 18509 1743 1 4 . 1 1 57 57 CYS C C 57 175.209 175.209 175.615 -0.406 18509 1744 1 4 . 1 1 57 57 CYS CA C 57 49.088 49.088 57.686 -8.598 18509 1745 1 4 . 1 1 57 57 CYS H H 57 8.900 8.900 8.659 0.241 18509 1746 1 4 . 1 1 58 58 THR N N 58 119.852 119.852 121.157 -1.305 18509 1747 1 4 . 1 1 58 58 THR CA C 58 58.239 58.239 65.420 -7.181 18509 1748 1 4 . 1 1 58 58 THR H H 58 8.505 8.505 9.137 -0.632 18509 1749 1 4 . 1 1 59 59 SER C C 59 170.763 170.763 174.988 -4.225 18509 1750 1 4 . 1 1 59 59 SER CA C 59 55.609 55.609 61.346 -5.737 18509 1751 1 4 . 1 1 60 60 ALA N N 60 119.753 119.753 121.709 -1.956 18509 1752 1 4 . 1 1 60 60 ALA CA C 60 49.940 49.940 53.031 -3.091 18509 1753 1 4 . 1 1 60 60 ALA H H 60 6.898 6.898 7.755 -0.857 18509 1754 1 4 . 1 1 61 61 GLY N N 61 101.351 101.351 108.259 -6.908 18509 1755 1 4 . 1 1 61 61 GLY CA C 61 42.805 42.805 47.478 -4.673 18509 1756 1 4 . 1 1 61 61 GLY H H 61 7.730 7.730 8.679 -0.949 18509 1757 1 4 . 1 1 62 62 PRO C C 62 172.276 172.276 176.007 -3.731 18509 1758 1 4 . 1 1 63 63 HIS N N 63 115.023 115.023 110.200 4.823 18509 1759 1 4 . 1 1 63 63 HIS CA C 63 52.119 52.119 56.669 -4.550 18509 1760 1 4 . 1 1 63 63 HIS H H 63 7.474 7.474 7.396 0.078 18509 1761 1 4 . 1 1 64 64 PHE C C 64 171.731 171.731 173.459 -1.728 18509 1762 1 4 . 1 1 65 65 ASN N N 65 126.978 126.978 126.170 0.808 18509 1763 1 4 . 1 1 65 65 ASN CA C 65 47.753 47.753 49.189 -1.436 18509 1764 1 4 . 1 1 65 65 ASN H H 65 9.426 9.426 8.089 1.337 18509 1765 1 4 . 1 1 67 67 LEU N N 67 117.937 117.937 116.725 1.212 18509 1766 1 4 . 1 1 67 67 LEU C C 67 172.580 172.580 178.796 -6.216 18509 1767 1 4 . 1 1 67 67 LEU CA C 67 50.911 50.911 55.111 -4.200 18509 1768 1 4 . 1 1 67 67 LEU H H 67 7.720 7.720 7.495 0.225 18509 1769 1 4 . 1 1 68 68 SER N N 68 110.842 110.842 116.470 -5.628 18509 1770 1 4 . 1 1 68 68 SER CA C 68 55.953 55.953 59.215 -3.262 18509 1771 1 4 . 1 1 68 68 SER H H 68 7.428 7.428 8.046 -0.618 18509 1772 1 4 . 1 1 69 69 ARG N N 69 120.782 120.782 121.549 -0.767 18509 1773 1 4 . 1 1 69 69 ARG C C 69 173.381 173.381 177.072 -3.691 18509 1774 1 4 . 1 1 69 69 ARG CA C 69 50.543 50.543 56.076 -5.533 18509 1775 1 4 . 1 1 69 69 ARG H H 69 8.508 8.508 8.154 0.354 18509 1776 1 4 . 1 1 70 70 LYS N N 70 118.055 118.055 119.394 -1.339 18509 1777 1 4 . 1 1 70 70 LYS C C 70 169.994 169.994 177.059 -7.065 18509 1778 1 4 . 1 1 70 70 LYS CA C 70 52.596 52.596 56.603 -4.008 18509 1779 1 4 . 1 1 70 70 LYS H H 70 8.745 8.745 7.833 0.912 18509 1780 1 4 . 1 1 71 71 HIS N N 71 111.871 111.871 117.103 -5.232 18509 1781 1 4 . 1 1 71 71 HIS C C 71 171.534 171.534 173.908 -2.374 18509 1782 1 4 . 1 1 71 71 HIS CA C 71 52.549 52.549 57.302 -4.753 18509 1783 1 4 . 1 1 71 71 HIS H H 71 7.152 7.152 8.388 -1.236 18509 1784 1 4 . 1 1 72 72 GLY N N 72 112.910 112.910 104.943 7.967 18509 1785 1 4 . 1 1 72 72 GLY C C 72 168.634 168.634 172.561 -3.927 18509 1786 1 4 . 1 1 72 72 GLY CA C 72 41.274 41.274 45.042 -3.768 18509 1787 1 4 . 1 1 72 72 GLY H H 72 7.209 7.209 7.939 -0.730 18509 1788 1 4 . 1 1 73 73 GLY N N 73 105.207 105.207 110.340 -5.133 18509 1789 1 4 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.198 -2.977 18509 1790 1 4 . 1 1 73 73 GLY H H 73 8.789 8.789 8.286 0.503 18509 1791 1 4 . 1 1 74 74 PRO C C 74 175.753 175.753 176.275 -0.522 18509 1792 1 4 . 1 1 75 75 LYS N N 75 114.868 114.868 115.271 -0.403 18509 1793 1 4 . 1 1 75 75 LYS C C 75 173.640 173.640 175.237 -1.597 18509 1794 1 4 . 1 1 75 75 LYS CA C 75 51.103 51.103 55.626 -4.523 18509 1795 1 4 . 1 1 75 75 LYS H H 75 8.651 8.651 7.882 0.769 18509 1796 1 4 . 1 1 76 76 ASP N N 76 120.414 120.414 119.597 0.817 18509 1797 1 4 . 1 1 76 76 ASP C C 76 172.557 172.557 174.916 -2.359 18509 1798 1 4 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.914 -3.605 18509 1799 1 4 . 1 1 76 76 ASP H H 76 7.461 7.461 8.052 -0.591 18509 1800 1 4 . 1 1 77 77 GLU N N 77 120.820 120.820 118.696 2.124 18509 1801 1 4 . 1 1 77 77 GLU C C 77 174.101 174.101 174.710 -0.609 18509 1802 1 4 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.531 -2.018 18509 1803 1 4 . 1 1 77 77 GLU H H 77 8.315 8.315 7.946 0.369 18509 1804 1 4 . 1 1 78 78 GLU N N 78 119.251 119.251 126.028 -6.777 18509 1805 1 4 . 1 1 78 78 GLU C C 78 168.285 168.285 176.467 -8.182 18509 1806 1 4 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.288 -5.210 18509 1807 1 4 . 1 1 78 78 GLU H H 78 8.109 8.109 7.988 0.121 18509 1808 1 4 . 1 1 79 79 ARG N N 79 118.991 118.991 117.306 1.685 18509 1809 1 4 . 1 1 79 79 ARG C C 79 172.123 172.123 175.661 -3.538 18509 1810 1 4 . 1 1 79 79 ARG CA C 79 51.074 51.074 55.171 -4.097 18509 1811 1 4 . 1 1 79 79 ARG H H 79 6.999 6.999 8.410 -1.411 18509 1812 1 4 . 1 1 80 80 HIS N N 80 118.000 118.000 113.112 4.888 18509 1813 1 4 . 1 1 80 80 HIS CA C 80 49.953 49.953 57.011 -7.058 18509 1814 1 4 . 1 1 80 80 HIS H H 80 8.355 8.355 7.663 0.692 18509 1815 1 4 . 1 1 81 81 VAL C C 81 173.460 173.460 176.469 -3.009 18509 1816 1 4 . 1 1 82 82 GLY N N 82 97.322 97.322 110.843 -13.521 18509 1817 1 4 . 1 1 82 82 GLY C C 82 170.370 170.370 173.104 -2.734 18509 1818 1 4 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.195 -2.507 18509 1819 1 4 . 1 1 82 82 GLY H H 82 8.487 8.487 8.888 -0.401 18509 1820 1 4 . 1 1 83 83 ASP N N 83 120.890 120.890 122.925 -2.035 18509 1821 1 4 . 1 1 83 83 ASP C C 83 168.737 168.737 173.831 -5.094 18509 1822 1 4 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.589 -0.671 18509 1823 1 4 . 1 1 83 83 ASP H H 83 7.127 7.127 7.841 -0.714 18509 1824 1 4 . 1 1 84 84 LEU N N 84 120.154 120.154 119.705 0.449 18509 1825 1 4 . 1 1 84 84 LEU C C 84 173.212 173.212 174.846 -1.634 18509 1826 1 4 . 1 1 84 84 LEU CA C 84 50.433 50.433 53.641 -3.208 18509 1827 1 4 . 1 1 84 84 LEU H H 84 7.128 7.128 8.194 -1.066 18509 1828 1 4 . 1 1 85 85 GLY N N 85 106.867 106.867 109.408 -2.541 18509 1829 1 4 . 1 1 85 85 GLY C C 85 167.654 167.654 172.626 -4.972 18509 1830 1 4 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.742 -1.731 18509 1831 1 4 . 1 1 85 85 GLY H H 85 8.260 8.260 8.393 -0.133 18509 1832 1 4 . 1 1 86 86 ASN N N 86 117.454 117.454 117.962 -0.508 18509 1833 1 4 . 1 1 86 86 ASN C C 86 173.942 173.942 173.958 -0.016 18509 1834 1 4 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.042 -2.776 18509 1835 1 4 . 1 1 86 86 ASN H H 86 8.041 8.041 8.445 -0.404 18509 1836 1 4 . 1 1 87 87 VAL N N 87 113.370 113.370 114.730 -1.360 18509 1837 1 4 . 1 1 87 87 VAL C C 87 171.526 171.526 174.719 -3.193 18509 1838 1 4 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.704 -4.996 18509 1839 1 4 . 1 1 87 87 VAL H H 87 8.960 8.960 8.162 0.798 18509 1840 1 4 . 1 1 88 88 THR N N 88 117.939 117.939 121.030 -3.091 18509 1841 1 4 . 1 1 88 88 THR C C 88 170.367 170.367 173.445 -3.078 18509 1842 1 4 . 1 1 88 88 THR CA C 88 58.694 58.694 60.387 -1.693 18509 1843 1 4 . 1 1 88 88 THR H H 88 8.681 8.681 8.429 0.252 18509 1844 1 4 . 1 1 89 89 ALA N N 89 128.674 128.674 130.311 -1.637 18509 1845 1 4 . 1 1 89 89 ALA C C 89 174.480 174.480 175.633 -1.153 18509 1846 1 4 . 1 1 89 89 ALA CA C 89 46.369 46.369 51.095 -4.726 18509 1847 1 4 . 1 1 89 89 ALA H H 89 9.377 9.377 8.082 1.295 18509 1848 1 4 . 1 1 90 90 ASP N N 90 124.235 124.235 119.674 4.561 18509 1849 1 4 . 1 1 90 90 ASP C C 90 173.825 173.825 177.736 -3.911 18509 1850 1 4 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.924 -3.577 18509 1851 1 4 . 1 1 90 90 ASP H H 90 8.455 8.455 8.177 0.278 18509 1852 1 4 . 1 1 91 91 LYS N N 91 114.942 114.942 118.409 -3.467 18509 1853 1 4 . 1 1 91 91 LYS C C 91 174.101 174.101 176.561 -2.460 18509 1854 1 4 . 1 1 91 91 LYS CA C 91 55.279 55.279 59.013 -3.734 18509 1855 1 4 . 1 1 91 91 LYS H H 91 8.231 8.231 8.478 -0.247 18509 1856 1 4 . 1 1 92 92 ASP N N 92 119.251 119.251 115.556 3.695 18509 1857 1 4 . 1 1 92 92 ASP C C 92 173.020 173.020 176.087 -3.067 18509 1858 1 4 . 1 1 92 92 ASP CA C 92 51.127 51.127 52.630 -1.503 18509 1859 1 4 . 1 1 92 92 ASP H H 92 8.109 8.109 8.049 0.060 18509 1860 1 4 . 1 1 93 93 GLY N N 93 110.868 110.868 108.407 2.461 18509 1861 1 4 . 1 1 93 93 GLY C C 93 169.706 169.706 173.037 -3.331 18509 1862 1 4 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.399 -1.636 18509 1863 1 4 . 1 1 93 93 GLY H H 93 8.405 8.405 8.076 0.329 18509 1864 1 4 . 1 1 94 94 VAL N N 94 118.755 118.755 112.300 6.455 18509 1865 1 4 . 1 1 94 94 VAL C C 94 173.510 173.510 174.246 -0.736 18509 1866 1 4 . 1 1 94 94 VAL CA C 94 58.185 58.185 60.598 -2.413 18509 1867 1 4 . 1 1 94 94 VAL H H 94 7.814 7.814 8.129 -0.315 18509 1868 1 4 . 1 1 95 95 ALA N N 95 131.313 131.313 129.538 1.775 18509 1869 1 4 . 1 1 95 95 ALA C C 95 171.635 171.635 176.712 -5.077 18509 1870 1 4 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.477 -3.563 18509 1871 1 4 . 1 1 95 95 ALA H H 95 9.763 9.763 8.720 1.043 18509 1872 1 4 . 1 1 96 96 ASP N N 96 125.170 125.170 125.573 -0.403 18509 1873 1 4 . 1 1 96 96 ASP C C 96 172.336 172.336 175.898 -3.562 18509 1874 1 4 . 1 1 96 96 ASP H H 96 8.515 8.515 8.351 0.164 18509 1875 1 4 . 1 1 97 97 VAL N N 97 125.879 125.879 124.861 1.018 18509 1876 1 4 . 1 1 97 97 VAL C C 97 173.488 173.488 174.179 -0.691 18509 1877 1 4 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.901 -3.659 18509 1878 1 4 . 1 1 97 97 VAL H H 97 8.703 8.703 8.135 0.568 18509 1879 1 4 . 1 1 98 98 SER N N 98 123.017 123.017 123.782 -0.765 18509 1880 1 4 . 1 1 98 98 SER C C 98 169.715 169.715 173.274 -3.559 18509 1881 1 4 . 1 1 98 98 SER CA C 98 55.068 55.068 57.958 -2.890 18509 1882 1 4 . 1 1 98 98 SER H H 98 8.784 8.784 7.973 0.811 18509 1883 1 4 . 1 1 99 99 ILE N N 99 125.807 125.807 123.954 1.853 18509 1884 1 4 . 1 1 99 99 ILE C C 99 171.321 171.321 174.996 -3.675 18509 1885 1 4 . 1 1 99 99 ILE CA C 99 57.155 57.155 61.037 -3.882 18509 1886 1 4 . 1 1 99 99 ILE H H 99 9.411 9.411 8.070 1.341 18509 1887 1 4 . 1 1 100 100 GLU N N 100 124.068 124.068 126.996 -2.928 18509 1888 1 4 . 1 1 100 100 GLU C C 100 172.098 172.098 175.145 -3.047 18509 1889 1 4 . 1 1 100 100 GLU CA C 100 52.290 52.290 56.140 -3.850 18509 1890 1 4 . 1 1 100 100 GLU H H 100 8.652 8.652 8.611 0.041 18509 1891 1 4 . 1 1 101 101 ASP N N 101 126.109 126.109 123.447 2.662 18509 1892 1 4 . 1 1 101 101 ASP C C 101 171.144 171.144 174.728 -3.584 18509 1893 1 4 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.313 -1.894 18509 1894 1 4 . 1 1 101 101 ASP H H 101 9.317 9.317 8.000 1.317 18509 1895 1 4 . 1 1 102 102 SER N N 102 118.470 118.470 117.321 1.149 18509 1896 1 4 . 1 1 102 102 SER C C 102 171.596 171.596 174.404 -2.808 18509 1897 1 4 . 1 1 102 102 SER CA C 102 55.245 55.245 59.474 -4.229 18509 1898 1 4 . 1 1 102 102 SER H H 102 8.933 8.933 8.545 0.388 18509 1899 1 4 . 1 1 103 103 VAL N N 103 123.179 123.179 126.767 -3.588 18509 1900 1 4 . 1 1 103 103 VAL CA C 103 61.450 61.450 62.203 -0.753 18509 1901 1 4 . 1 1 103 103 VAL H H 103 8.148 8.148 8.024 0.124 18509 1902 1 4 . 1 1 104 104 ILE C C 104 169.576 169.576 176.415 -6.839 18509 1903 1 4 . 1 1 104 104 ILE CA C 104 60.194 60.194 63.853 -3.659 18509 1904 1 4 . 1 1 105 105 SER N N 105 107.618 107.618 116.172 -8.554 18509 1905 1 4 . 1 1 105 105 SER C C 105 170.046 170.046 174.523 -4.477 18509 1906 1 4 . 1 1 105 105 SER CA C 105 52.550 52.550 56.469 -3.919 18509 1907 1 4 . 1 1 105 105 SER H H 105 6.988 6.988 8.029 -1.041 18509 1908 1 4 . 1 1 106 106 LEU N N 106 120.137 120.137 128.689 -8.552 18509 1909 1 4 . 1 1 106 106 LEU H H 106 8.313 8.313 7.892 0.421 18509 1910 1 4 . 1 1 107 107 SER C C 107 170.701 170.701 173.865 -3.164 18509 1911 1 4 . 1 1 107 107 SER CA C 107 54.540 54.540 58.561 -4.021 18509 1912 1 4 . 1 1 108 108 GLY N N 108 107.603 107.603 112.383 -4.780 18509 1913 1 4 . 1 1 108 108 GLY C C 108 173.128 173.128 173.203 -0.075 18509 1914 1 4 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.261 -2.974 18509 1915 1 4 . 1 1 108 108 GLY H H 108 8.717 8.717 7.929 0.788 18509 1916 1 4 . 1 1 109 109 ASP N N 109 120.664 120.664 122.264 -1.600 18509 1917 1 4 . 1 1 109 109 ASP C C 109 171.904 171.904 176.887 -4.983 18509 1918 1 4 . 1 1 109 109 ASP H H 109 9.019 9.019 8.592 0.427 18509 1919 1 4 . 1 1 110 110 HIS N N 110 116.324 116.324 117.457 -1.133 18509 1920 1 4 . 1 1 110 110 HIS H H 110 9.283 9.283 8.368 0.915 18509 1921 1 4 . 1 1 111 111 SER N N 111 110.225 110.225 114.913 -4.688 18509 1922 1 4 . 1 1 111 111 SER CA C 111 54.681 54.681 57.731 -3.050 18509 1923 1 4 . 1 1 111 111 SER H H 111 7.156 7.156 7.997 -0.841 18509 1924 1 4 . 1 1 112 112 ILE N N 112 117.053 117.053 118.620 -1.567 18509 1925 1 4 . 1 1 112 112 ILE C C 112 171.419 171.419 174.839 -3.420 18509 1926 1 4 . 1 1 112 112 ILE CA C 112 57.239 57.239 62.019 -4.780 18509 1927 1 4 . 1 1 112 112 ILE H H 112 7.837 7.837 8.496 -0.659 18509 1928 1 4 . 1 1 113 113 ILE N N 113 121.032 121.032 119.763 1.269 18509 1929 1 4 . 1 1 113 113 ILE C C 113 173.604 173.604 176.343 -2.739 18509 1930 1 4 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.491 -2.173 18509 1931 1 4 . 1 1 113 113 ILE H H 113 7.592 7.592 7.485 0.107 18509 1932 1 4 . 1 1 114 114 GLY N N 114 112.661 112.661 113.920 -1.259 18509 1933 1 4 . 1 1 114 114 GLY C C 114 169.739 169.739 174.609 -4.870 18509 1934 1 4 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.055 -3.145 18509 1935 1 4 . 1 1 114 114 GLY H H 114 9.575 9.575 8.173 1.402 18509 1936 1 4 . 1 1 115 115 ARG N N 115 118.398 118.398 122.128 -3.730 18509 1937 1 4 . 1 1 115 115 ARG C C 115 171.079 171.079 175.926 -4.847 18509 1938 1 4 . 1 1 115 115 ARG CA C 115 51.663 51.663 55.663 -3.999 18509 1939 1 4 . 1 1 115 115 ARG H H 115 7.464 7.464 8.018 -0.554 18509 1940 1 4 . 1 1 116 116 THR N N 116 112.218 112.218 120.954 -8.736 18509 1941 1 4 . 1 1 116 116 THR C C 116 169.821 169.821 173.943 -4.122 18509 1942 1 4 . 1 1 116 116 THR CA C 116 59.633 59.633 63.352 -3.719 18509 1943 1 4 . 1 1 116 116 THR H H 116 6.677 6.677 8.059 -1.382 18509 1944 1 4 . 1 1 117 117 LEU N N 117 129.477 129.477 130.680 -1.203 18509 1945 1 4 . 1 1 117 117 LEU C C 117 171.126 171.126 175.102 -3.976 18509 1946 1 4 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.766 -4.351 18509 1947 1 4 . 1 1 117 117 LEU H H 117 8.799 8.799 8.323 0.476 18509 1948 1 4 . 1 1 118 118 VAL N N 118 125.091 125.091 128.453 -3.362 18509 1949 1 4 . 1 1 118 118 VAL C C 118 170.267 170.267 174.302 -4.035 18509 1950 1 4 . 1 1 118 118 VAL CA C 118 58.139 58.139 62.033 -3.894 18509 1951 1 4 . 1 1 118 118 VAL H H 118 8.906 8.906 8.103 0.803 18509 1952 1 4 . 1 1 119 119 VAL N N 119 120.716 120.716 125.108 -4.392 18509 1953 1 4 . 1 1 119 119 VAL C C 119 171.175 171.175 173.338 -2.163 18509 1954 1 4 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.442 -4.171 18509 1955 1 4 . 1 1 119 119 VAL H H 119 7.982 7.982 7.898 0.084 18509 1956 1 4 . 1 1 120 120 HIS N N 120 125.052 125.052 120.630 4.422 18509 1957 1 4 . 1 1 120 120 HIS C C 120 172.599 172.599 173.534 -0.935 18509 1958 1 4 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.609 -1.215 18509 1959 1 4 . 1 1 120 120 HIS H H 120 8.935 8.935 8.394 0.541 18509 1960 1 4 . 1 1 121 121 GLU N N 121 121.453 121.453 120.439 1.014 18509 1961 1 4 . 1 1 121 121 GLU C C 121 172.304 172.304 175.611 -3.307 18509 1962 1 4 . 1 1 121 121 GLU CA C 121 56.090 56.090 57.161 -1.071 18509 1963 1 4 . 1 1 121 121 GLU H H 121 9.178 9.178 7.666 1.512 18509 1964 1 4 . 1 1 122 122 LYS N N 122 115.248 115.248 121.720 -6.472 18509 1965 1 4 . 1 1 122 122 LYS C C 122 171.523 171.523 174.250 -2.727 18509 1966 1 4 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.172 -4.553 18509 1967 1 4 . 1 1 122 122 LYS H H 122 8.478 8.478 7.804 0.674 18509 1968 1 4 . 1 1 123 123 ALA N N 123 120.866 120.866 123.405 -2.539 18509 1969 1 4 . 1 1 123 123 ALA C C 123 173.219 173.219 176.262 -3.043 18509 1970 1 4 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.013 -3.163 18509 1971 1 4 . 1 1 123 123 ALA H H 123 7.796 7.796 8.476 -0.680 18509 1972 1 4 . 1 1 124 124 ASP N N 124 121.799 121.799 122.495 -0.696 18509 1973 1 4 . 1 1 124 124 ASP C C 124 174.458 174.458 175.637 -1.179 18509 1974 1 4 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.195 -3.787 18509 1975 1 4 . 1 1 124 124 ASP H H 124 10.165 10.165 8.139 2.026 18509 1976 1 4 . 1 1 125 125 ASP N N 125 129.369 129.369 119.225 10.144 18509 1977 1 4 . 1 1 125 125 ASP C C 125 175.231 175.231 177.303 -2.072 18509 1978 1 4 . 1 1 125 125 ASP CA C 125 50.939 50.939 55.068 -4.129 18509 1979 1 4 . 1 1 125 125 ASP H H 125 10.055 10.055 7.794 2.261 18509 1980 1 4 . 1 1 126 126 LEU N N 126 117.190 117.190 128.274 -11.084 18509 1981 1 4 . 1 1 126 126 LEU C C 126 173.964 173.964 178.312 -4.348 18509 1982 1 4 . 1 1 126 126 LEU H H 126 10.483 10.483 8.097 2.386 18509 1983 1 4 . 1 1 127 127 GLY N N 127 103.809 103.809 104.663 -0.854 18509 1984 1 4 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.819 -3.941 18509 1985 1 4 . 1 1 127 127 GLY H H 127 8.637 8.637 8.250 0.387 18509 1986 1 4 . 1 1 128 128 LYS N N 128 118.290 118.290 120.077 -1.787 18509 1987 1 4 . 1 1 128 128 LYS CA C 128 51.740 51.740 57.077 -5.337 18509 1988 1 4 . 1 1 128 128 LYS H H 128 7.158 7.158 7.439 -0.281 18509 1989 1 4 . 1 1 129 129 GLY N N 129 108.507 108.507 107.255 1.252 18509 1990 1 4 . 1 1 129 129 GLY C C 129 171.524 171.524 174.542 -3.018 18509 1991 1 4 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.819 -4.707 18509 1992 1 4 . 1 1 129 129 GLY H H 129 8.913 8.913 8.592 0.321 18509 1993 1 4 . 1 1 130 130 GLY N N 130 108.537 108.537 110.888 -2.351 18509 1994 1 4 . 1 1 130 130 GLY C C 130 169.994 169.994 172.435 -2.441 18509 1995 1 4 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.705 -2.286 18509 1996 1 4 . 1 1 130 130 GLY H H 130 8.723 8.723 8.054 0.669 18509 1997 1 4 . 1 1 131 131 ASN N N 131 111.951 111.951 119.065 -7.114 18509 1998 1 4 . 1 1 131 131 ASN C C 131 172.236 172.236 175.273 -3.037 18509 1999 1 4 . 1 1 131 131 ASN H H 131 7.152 7.152 7.959 -0.807 18509 2000 1 4 . 1 1 132 132 GLU N N 132 120.461 120.461 119.255 1.206 18509 2001 1 4 . 1 1 132 132 GLU C C 132 171.084 171.084 177.663 -6.579 18509 2002 1 4 . 1 1 132 132 GLU H H 132 8.935 8.935 8.951 -0.016 18509 2003 1 4 . 1 1 133 133 GLU N N 133 120.137 120.137 118.044 2.093 18509 2004 1 4 . 1 1 133 133 GLU C C 133 176.239 176.239 178.302 -2.063 18509 2005 1 4 . 1 1 133 133 GLU H H 133 8.775 8.775 8.179 0.596 18509 2006 1 4 . 1 1 134 134 SER N N 134 114.981 114.981 115.656 -0.675 18509 2007 1 4 . 1 1 134 134 SER CA C 134 59.046 59.046 61.613 -2.567 18509 2008 1 4 . 1 1 134 134 SER H H 134 8.117 8.117 8.241 -0.124 18509 2009 1 4 . 1 1 135 135 THR N N 135 102.263 102.263 115.290 -13.027 18509 2010 1 4 . 1 1 135 135 THR C C 135 172.804 172.804 174.482 -1.678 18509 2011 1 4 . 1 1 135 135 THR CA C 135 60.029 60.029 62.274 -2.245 18509 2012 1 4 . 1 1 135 135 THR H H 135 7.206 7.206 7.478 -0.272 18509 2013 1 4 . 1 1 136 136 LYS N N 136 122.108 122.108 118.932 3.176 18509 2014 1 4 . 1 1 136 136 LYS H H 136 7.884 7.884 7.551 0.333 18509 2015 1 4 . 1 1 137 137 THR N N 137 105.718 105.718 107.441 -1.723 18509 2016 1 4 . 1 1 137 137 THR H H 137 8.630 8.630 7.547 1.083 18509 2017 1 4 . 1 1 138 138 GLY N N 138 111.372 111.372 111.990 -0.618 18509 2018 1 4 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.125 -2.642 18509 2019 1 4 . 1 1 138 138 GLY H H 138 7.426 7.426 7.765 -0.339 18509 2020 1 4 . 1 1 139 139 ASN N N 139 107.496 107.496 120.209 -12.713 18509 2021 1 4 . 1 1 139 139 ASN H H 139 7.545 7.545 7.817 -0.272 18509 2022 1 4 . 1 1 140 140 ALA N N 140 114.542 114.542 125.914 -11.372 18509 2023 1 4 . 1 1 140 140 ALA C C 140 173.571 173.571 176.064 -2.493 18509 2024 1 4 . 1 1 140 140 ALA H H 140 6.368 6.368 7.616 -1.248 18509 2025 1 4 . 1 1 141 141 GLY N N 141 105.287 105.287 107.154 -1.867 18509 2026 1 4 . 1 1 141 141 GLY C C 141 173.542 173.542 175.293 -1.751 18509 2027 1 4 . 1 1 141 141 GLY H H 141 8.271 8.271 8.467 -0.196 18509 2028 1 4 . 1 1 142 142 SER N N 142 118.771 118.771 119.160 -0.389 18509 2029 1 4 . 1 1 142 142 SER C C 142 170.188 170.188 175.626 -5.438 18509 2030 1 4 . 1 1 142 142 SER H H 142 9.196 9.196 7.944 1.252 18509 2031 1 4 . 1 1 143 143 ARG N N 143 120.189 120.189 114.708 5.481 18509 2032 1 4 . 1 1 143 143 ARG C C 143 171.596 171.596 176.717 -5.121 18509 2033 1 4 . 1 1 143 143 ARG H H 143 8.943 8.943 7.989 0.954 18509 2034 1 4 . 1 1 144 144 LEU N N 144 122.907 122.907 123.189 -0.282 18509 2035 1 4 . 1 1 144 144 LEU C C 144 174.393 174.393 175.529 -1.136 18509 2036 1 4 . 1 1 144 144 LEU CA C 144 53.375 53.375 57.332 -3.957 18509 2037 1 4 . 1 1 144 144 LEU H H 144 8.395 8.395 7.422 0.973 18509 2038 1 4 . 1 1 145 145 ALA N N 145 114.159 114.159 115.267 -1.108 18509 2039 1 4 . 1 1 145 145 ALA C C 145 171.752 171.752 175.007 -3.255 18509 2040 1 4 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.838 -3.709 18509 2041 1 4 . 1 1 145 145 ALA H H 145 7.356 7.356 7.623 -0.267 18509 2042 1 4 . 1 1 146 146 CYS N N 146 110.738 110.738 118.010 -7.272 18509 2043 1 4 . 1 1 146 146 CYS C C 146 170.087 170.087 173.401 -3.314 18509 2044 1 4 . 1 1 146 146 CYS CA C 146 51.077 51.077 58.388 -7.311 18509 2045 1 4 . 1 1 146 146 CYS H H 146 9.008 9.008 8.323 0.685 18509 2046 1 4 . 1 1 147 147 GLY N N 147 106.461 106.461 111.688 -5.227 18509 2047 1 4 . 1 1 147 147 GLY C C 147 167.909 167.909 172.564 -4.655 18509 2048 1 4 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.989 -3.315 18509 2049 1 4 . 1 1 147 147 GLY H H 147 8.018 8.018 8.400 -0.382 18509 2050 1 4 . 1 1 148 148 VAL N N 148 124.054 124.054 122.365 1.689 18509 2051 1 4 . 1 1 148 148 VAL C C 148 172.084 172.084 173.297 -1.213 18509 2052 1 4 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.340 -2.705 18509 2053 1 4 . 1 1 148 148 VAL H H 148 8.434 8.434 8.167 0.267 18509 2054 1 4 . 1 1 149 149 ILE N N 149 126.918 126.918 125.817 1.101 18509 2055 1 4 . 1 1 149 149 ILE C C 149 171.804 171.804 175.165 -3.361 18509 2056 1 4 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.703 -0.519 18509 2057 1 4 . 1 1 149 149 ILE H H 149 8.613 8.613 8.177 0.436 18509 2058 1 4 . 1 1 150 150 GLY N N 150 116.493 116.493 114.292 2.201 18509 2059 1 4 . 1 1 150 150 GLY C C 150 170.188 170.188 172.214 -2.026 18509 2060 1 4 . 1 1 150 150 GLY CA C 150 40.120 40.120 45.264 -5.144 18509 2061 1 4 . 1 1 150 150 GLY H H 150 9.283 9.283 8.712 0.571 18509 2062 1 4 . 1 1 151 151 ILE N N 151 120.189 120.189 122.168 -1.979 18509 2063 1 4 . 1 1 151 151 ILE C C 151 172.231 172.231 174.501 -2.270 18509 2064 1 4 . 1 1 151 151 ILE CA C 151 60.372 60.372 62.216 -1.844 18509 2065 1 4 . 1 1 151 151 ILE H H 151 8.943 8.943 8.358 0.585 18509 2066 1 4 . 1 1 152 152 ALA N N 152 129.719 129.719 131.699 -1.980 18509 2067 1 4 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.184 -4.412 18509 2068 1 4 . 1 1 152 152 ALA H H 152 8.170 8.170 8.099 0.071 18509 2069 1 5 . 1 1 2 2 THR C C 2 170.139 170.139 173.149 -3.010 18509 2070 1 5 . 1 1 3 3 LYS N N 3 123.998 123.998 119.638 4.360 18509 2071 1 5 . 1 1 3 3 LYS C C 3 171.607 171.607 174.232 -2.625 18509 2072 1 5 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.403 -3.225 18509 2073 1 5 . 1 1 3 3 LYS H H 3 8.666 8.666 7.622 1.044 18509 2074 1 5 . 1 1 4 4 ALA N N 4 123.295 123.295 123.074 0.221 18509 2075 1 5 . 1 1 4 4 ALA C C 4 172.145 172.145 175.444 -3.299 18509 2076 1 5 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.253 -2.749 18509 2077 1 5 . 1 1 4 4 ALA H H 4 9.116 9.116 8.190 0.926 18509 2078 1 5 . 1 1 5 5 VAL N N 5 121.466 121.466 116.461 5.005 18509 2079 1 5 . 1 1 5 5 VAL C C 5 167.836 167.836 174.066 -6.230 18509 2080 1 5 . 1 1 5 5 VAL CA C 5 56.875 56.875 60.055 -3.180 18509 2081 1 5 . 1 1 5 5 VAL H H 5 9.545 9.545 7.726 1.819 18509 2082 1 5 . 1 1 6 6 ALA N N 6 125.984 125.984 127.270 -1.286 18509 2083 1 5 . 1 1 6 6 ALA C C 6 171.607 171.607 176.548 -4.941 18509 2084 1 5 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.482 -3.011 18509 2085 1 5 . 1 1 6 6 ALA H H 6 9.177 9.177 8.482 0.695 18509 2086 1 5 . 1 1 7 7 VAL N N 7 123.600 123.600 119.209 4.391 18509 2087 1 5 . 1 1 7 7 VAL C C 7 172.244 172.244 174.215 -1.971 18509 2088 1 5 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.800 -2.324 18509 2089 1 5 . 1 1 7 7 VAL H H 7 9.116 9.116 8.251 0.865 18509 2090 1 5 . 1 1 8 8 LEU N N 8 126.455 126.455 128.198 -1.743 18509 2091 1 5 . 1 1 8 8 LEU C C 8 172.557 172.557 176.932 -4.375 18509 2092 1 5 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.121 -2.069 18509 2093 1 5 . 1 1 8 8 LEU H H 8 8.916 8.916 8.710 0.206 18509 2094 1 5 . 1 1 9 9 LYS N N 9 120.820 120.820 121.102 -0.282 18509 2095 1 5 . 1 1 9 9 LYS C C 9 172.509 172.509 174.653 -2.144 18509 2096 1 5 . 1 1 9 9 LYS CA C 9 51.897 51.897 54.779 -2.882 18509 2097 1 5 . 1 1 9 9 LYS H H 9 8.315 8.315 8.951 -0.636 18509 2098 1 5 . 1 1 10 10 GLY N N 10 111.249 111.249 111.533 -0.284 18509 2099 1 5 . 1 1 10 10 GLY C C 10 169.847 169.847 173.035 -3.188 18509 2100 1 5 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.086 -2.811 18509 2101 1 5 . 1 1 10 10 GLY H H 10 8.968 8.968 8.628 0.340 18509 2102 1 5 . 1 1 11 11 ASP N N 11 120.904 120.904 119.923 0.981 18509 2103 1 5 . 1 1 11 11 ASP C C 11 173.132 173.132 176.954 -3.822 18509 2104 1 5 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.293 -3.976 18509 2105 1 5 . 1 1 11 11 ASP H H 11 8.745 8.745 8.674 0.071 18509 2106 1 5 . 1 1 12 12 GLY N N 12 109.862 109.862 108.049 1.813 18509 2107 1 5 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.451 -2.251 18509 2108 1 5 . 1 1 12 12 GLY H H 12 7.985 7.985 7.906 0.079 18509 2109 1 5 . 1 1 13 13 PRO C C 13 173.640 173.640 175.188 -1.548 18509 2110 1 5 . 1 1 14 14 VAL N N 14 120.414 120.414 124.023 -3.609 18509 2111 1 5 . 1 1 14 14 VAL C C 14 172.804 172.804 174.128 -1.324 18509 2112 1 5 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.637 -0.753 18509 2113 1 5 . 1 1 14 14 VAL H H 14 7.476 7.476 8.407 -0.931 18509 2114 1 5 . 1 1 15 15 GLN N N 15 122.664 122.664 127.772 -5.108 18509 2115 1 5 . 1 1 15 15 GLN C C 15 171.168 171.168 174.441 -3.273 18509 2116 1 5 . 1 1 15 15 GLN CA C 15 50.679 50.679 53.902 -3.223 18509 2117 1 5 . 1 1 15 15 GLN H H 15 7.938 7.938 8.237 -0.299 18509 2118 1 5 . 1 1 16 16 GLY N N 16 107.018 107.018 109.045 -2.027 18509 2119 1 5 . 1 1 16 16 GLY C C 16 167.726 167.726 171.908 -4.182 18509 2120 1 5 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.136 -1.511 18509 2121 1 5 . 1 1 16 16 GLY H H 16 8.288 8.288 8.407 -0.119 18509 2122 1 5 . 1 1 17 17 ILE N N 17 120.248 120.248 118.051 2.197 18509 2123 1 5 . 1 1 17 17 ILE C C 17 171.194 171.194 173.894 -2.700 18509 2124 1 5 . 1 1 17 17 ILE CA C 17 58.497 58.497 60.022 -1.525 18509 2125 1 5 . 1 1 17 17 ILE H H 17 7.948 7.948 8.471 -0.523 18509 2126 1 5 . 1 1 18 18 ILE N N 18 125.851 125.851 126.730 -0.879 18509 2127 1 5 . 1 1 18 18 ILE C C 18 168.889 168.889 175.048 -6.159 18509 2128 1 5 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.473 -6.042 18509 2129 1 5 . 1 1 18 18 ILE H H 18 8.725 8.725 8.326 0.399 18509 2130 1 5 . 1 1 19 19 ASN N N 19 123.256 123.256 123.775 -0.519 18509 2131 1 5 . 1 1 19 19 ASN C C 19 168.903 168.903 173.860 -4.957 18509 2132 1 5 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.781 -2.693 18509 2133 1 5 . 1 1 19 19 ASN H H 19 8.727 8.727 8.872 -0.145 18509 2134 1 5 . 1 1 20 20 PHE N N 20 113.849 113.849 117.595 -3.746 18509 2135 1 5 . 1 1 20 20 PHE C C 20 173.219 173.219 173.841 -0.622 18509 2136 1 5 . 1 1 20 20 PHE CA C 20 52.058 52.058 55.678 -3.620 18509 2137 1 5 . 1 1 20 20 PHE H H 20 8.399 8.399 8.161 0.238 18509 2138 1 5 . 1 1 21 21 GLU N N 21 121.454 121.454 118.175 3.279 18509 2139 1 5 . 1 1 21 21 GLU C C 21 170.280 170.280 175.331 -5.051 18509 2140 1 5 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.543 -1.499 18509 2141 1 5 . 1 1 21 21 GLU H H 21 9.526 9.526 8.605 0.921 18509 2142 1 5 . 1 1 22 22 GLN N N 22 130.340 130.340 123.019 7.321 18509 2143 1 5 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.837 -4.657 18509 2144 1 5 . 1 1 22 22 GLN H H 22 9.305 9.305 8.627 0.678 18509 2145 1 5 . 1 1 23 23 LYS N N 23 128.657 128.657 125.908 2.749 18509 2146 1 5 . 1 1 23 23 LYS CA C 23 57.241 57.241 55.049 2.192 18509 2147 1 5 . 1 1 23 23 LYS H H 23 9.088 9.088 8.700 0.388 18509 2148 1 5 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.756 -7.364 18509 2149 1 5 . 1 1 25 25 SER CA C 25 58.078 58.078 58.116 -0.038 18509 2150 1 5 . 1 1 27 27 GLY N N 27 108.125 108.125 108.550 -0.425 18509 2151 1 5 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.691 -1.766 18509 2152 1 5 . 1 1 27 27 GLY H H 27 8.032 8.032 8.608 -0.576 18509 2153 1 5 . 1 1 28 28 PRO C C 28 173.128 173.128 175.955 -2.827 18509 2154 1 5 . 1 1 29 29 VAL N N 29 121.267 121.267 117.639 3.628 18509 2155 1 5 . 1 1 29 29 VAL C C 29 172.198 172.198 175.358 -3.160 18509 2156 1 5 . 1 1 29 29 VAL CA C 29 57.720 57.720 59.935 -2.215 18509 2157 1 5 . 1 1 29 29 VAL H H 29 9.089 9.089 8.202 0.887 18509 2158 1 5 . 1 1 30 30 LYS N N 30 127.589 127.589 127.891 -0.302 18509 2159 1 5 . 1 1 30 30 LYS C C 30 172.098 172.098 175.590 -3.492 18509 2160 1 5 . 1 1 30 30 LYS CA C 30 52.642 52.642 56.210 -3.568 18509 2161 1 5 . 1 1 30 30 LYS H H 30 9.200 9.200 8.416 0.784 18509 2162 1 5 . 1 1 31 31 VAL N N 31 126.037 126.037 121.239 4.798 18509 2163 1 5 . 1 1 31 31 VAL C C 31 172.244 172.244 174.320 -2.076 18509 2164 1 5 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.671 -2.532 18509 2165 1 5 . 1 1 31 31 VAL H H 31 9.282 9.282 7.829 1.453 18509 2166 1 5 . 1 1 32 32 TRP N N 32 125.414 125.414 125.710 -0.296 18509 2167 1 5 . 1 1 32 32 TRP C C 32 170.156 170.156 174.372 -4.216 18509 2168 1 5 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.952 -3.815 18509 2169 1 5 . 1 1 32 32 TRP H H 32 8.983 8.983 8.552 0.431 18509 2170 1 5 . 1 1 33 33 GLY N N 33 107.848 107.848 111.548 -3.700 18509 2171 1 5 . 1 1 33 33 GLY C C 33 168.400 168.400 171.750 -3.350 18509 2172 1 5 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.688 -3.121 18509 2173 1 5 . 1 1 33 33 GLY H H 33 8.360 8.360 7.670 0.690 18509 2174 1 5 . 1 1 34 34 SER N N 34 114.377 114.377 118.251 -3.874 18509 2175 1 5 . 1 1 34 34 SER C C 34 169.618 169.618 172.622 -3.004 18509 2176 1 5 . 1 1 34 34 SER CA C 34 53.875 53.875 57.618 -3.744 18509 2177 1 5 . 1 1 34 34 SER H H 34 7.838 7.838 8.047 -0.209 18509 2178 1 5 . 1 1 35 35 ILE N N 35 123.149 123.149 124.643 -1.494 18509 2179 1 5 . 1 1 35 35 ILE C C 35 169.713 169.713 173.477 -3.764 18509 2180 1 5 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.579 -2.810 18509 2181 1 5 . 1 1 35 35 ILE H H 35 8.496 8.496 8.231 0.265 18509 2182 1 5 . 1 1 36 36 LYS N N 36 123.803 123.803 128.144 -4.341 18509 2183 1 5 . 1 1 36 36 LYS C C 36 172.260 172.260 175.044 -2.784 18509 2184 1 5 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.028 -2.878 18509 2185 1 5 . 1 1 36 36 LYS H H 36 9.091 9.091 8.930 0.161 18509 2186 1 5 . 1 1 37 37 GLY N N 37 105.495 105.495 109.411 -3.916 18509 2187 1 5 . 1 1 37 37 GLY C C 37 171.641 171.641 172.285 -0.644 18509 2188 1 5 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.276 -0.915 18509 2189 1 5 . 1 1 37 37 GLY H H 37 8.237 8.237 8.419 -0.182 18509 2190 1 5 . 1 1 38 38 LEU N N 38 120.966 120.966 119.128 1.838 18509 2191 1 5 . 1 1 38 38 LEU C C 38 174.112 174.112 176.448 -2.336 18509 2192 1 5 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.667 -4.196 18509 2193 1 5 . 1 1 38 38 LEU H H 38 8.156 8.156 8.528 -0.372 18509 2194 1 5 . 1 1 39 39 THR N N 39 110.363 110.363 110.147 0.216 18509 2195 1 5 . 1 1 39 39 THR C C 39 173.102 173.102 174.207 -1.105 18509 2196 1 5 . 1 1 39 39 THR CA C 39 58.194 58.194 62.086 -3.892 18509 2197 1 5 . 1 1 39 39 THR H H 39 8.660 8.660 7.971 0.689 18509 2198 1 5 . 1 1 40 40 GLU N N 40 125.818 125.818 122.225 3.593 18509 2199 1 5 . 1 1 40 40 GLU C C 40 173.134 173.134 176.263 -3.129 18509 2200 1 5 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.406 -2.050 18509 2201 1 5 . 1 1 40 40 GLU H H 40 8.804 8.804 8.268 0.536 18509 2202 1 5 . 1 1 41 41 GLY N N 41 113.875 113.875 107.885 5.990 18509 2203 1 5 . 1 1 41 41 GLY C C 41 170.046 170.046 172.757 -2.711 18509 2204 1 5 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.149 -4.095 18509 2205 1 5 . 1 1 41 41 GLY H H 41 8.763 8.763 8.064 0.699 18509 2206 1 5 . 1 1 42 42 LEU N N 42 120.137 120.137 118.522 1.615 18509 2207 1 5 . 1 1 42 42 LEU C C 42 174.218 174.218 176.226 -2.008 18509 2208 1 5 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.083 -2.928 18509 2209 1 5 . 1 1 42 42 LEU H H 42 8.313 8.313 8.599 -0.286 18509 2210 1 5 . 1 1 43 43 HIS N N 43 114.385 114.385 118.553 -4.168 18509 2211 1 5 . 1 1 43 43 HIS C C 43 171.504 171.504 173.265 -1.761 18509 2212 1 5 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.826 -4.841 18509 2213 1 5 . 1 1 43 43 HIS H H 43 8.712 8.712 7.545 1.167 18509 2214 1 5 . 1 1 44 44 GLY N N 44 108.872 108.872 111.371 -2.499 18509 2215 1 5 . 1 1 44 44 GLY C C 44 168.656 168.656 172.095 -3.439 18509 2216 1 5 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.200 -1.005 18509 2217 1 5 . 1 1 44 44 GLY H H 44 8.875 8.875 8.087 0.788 18509 2218 1 5 . 1 1 45 45 PHE N N 45 126.439 126.439 119.793 6.646 18509 2219 1 5 . 1 1 45 45 PHE CA C 45 53.098 53.098 55.038 -1.940 18509 2220 1 5 . 1 1 45 45 PHE H H 45 8.111 8.111 8.869 -0.758 18509 2221 1 5 . 1 1 46 46 HIS N N 46 115.353 115.353 120.290 -4.937 18509 2222 1 5 . 1 1 46 46 HIS C C 46 172.415 172.415 174.123 -1.708 18509 2223 1 5 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.101 -4.895 18509 2224 1 5 . 1 1 46 46 HIS H H 46 8.107 8.107 8.351 -0.244 18509 2225 1 5 . 1 1 47 47 VAL N N 47 120.548 120.548 120.770 -0.222 18509 2226 1 5 . 1 1 47 47 VAL C C 47 173.900 173.900 173.034 0.866 18509 2227 1 5 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.755 -2.963 18509 2228 1 5 . 1 1 47 47 VAL H H 47 9.366 9.366 7.749 1.617 18509 2229 1 5 . 1 1 48 48 HIS N N 48 129.236 129.236 120.683 8.553 18509 2230 1 5 . 1 1 48 48 HIS C C 48 171.084 171.084 173.759 -2.675 18509 2231 1 5 . 1 1 48 48 HIS CA C 48 52.756 52.756 55.421 -2.665 18509 2232 1 5 . 1 1 48 48 HIS H H 48 10.210 10.210 8.784 1.426 18509 2233 1 5 . 1 1 49 49 GLU N N 49 118.119 118.119 124.183 -6.064 18509 2234 1 5 . 1 1 49 49 GLU C C 49 171.635 171.635 174.446 -2.811 18509 2235 1 5 . 1 1 49 49 GLU CA C 49 57.759 57.759 56.331 1.428 18509 2236 1 5 . 1 1 49 49 GLU H H 49 8.492 8.492 8.678 -0.186 18509 2237 1 5 . 1 1 50 50 PHE N N 50 110.329 110.329 122.117 -11.788 18509 2238 1 5 . 1 1 50 50 PHE C C 50 175.252 175.252 176.305 -1.053 18509 2239 1 5 . 1 1 50 50 PHE CA C 50 52.900 52.900 57.815 -4.915 18509 2240 1 5 . 1 1 50 50 PHE H H 50 8.580 8.580 8.129 0.451 18509 2241 1 5 . 1 1 51 51 GLY N N 51 119.251 119.251 111.314 7.937 18509 2242 1 5 . 1 1 51 51 GLY C C 51 168.248 168.248 173.273 -5.025 18509 2243 1 5 . 1 1 51 51 GLY H H 51 10.208 10.208 8.397 1.811 18509 2244 1 5 . 1 1 52 52 ASP N N 52 114.958 114.958 124.427 -9.469 18509 2245 1 5 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.748 -5.857 18509 2246 1 5 . 1 1 52 52 ASP H H 52 5.834 5.834 8.692 -2.858 18509 2247 1 5 . 1 1 53 53 ASN N N 53 128.224 128.224 117.338 10.886 18509 2248 1 5 . 1 1 53 53 ASN CA C 53 48.233 48.233 53.368 -5.135 18509 2249 1 5 . 1 1 53 53 ASN H H 53 9.360 9.360 8.036 1.324 18509 2250 1 5 . 1 1 54 54 THR C C 54 168.656 168.656 174.680 -6.024 18509 2251 1 5 . 1 1 55 55 ALA N N 55 126.661 126.661 120.244 6.417 18509 2252 1 5 . 1 1 55 55 ALA C C 55 174.185 174.185 177.080 -2.895 18509 2253 1 5 . 1 1 55 55 ALA CA C 55 46.155 46.155 52.766 -6.611 18509 2254 1 5 . 1 1 55 55 ALA H H 55 8.390 8.390 8.220 0.170 18509 2255 1 5 . 1 1 56 56 GLY N N 56 107.903 107.903 106.372 1.531 18509 2256 1 5 . 1 1 56 56 GLY C C 56 171.578 171.578 173.236 -1.658 18509 2257 1 5 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.122 -2.542 18509 2258 1 5 . 1 1 56 56 GLY H H 56 7.282 7.282 7.328 -0.046 18509 2259 1 5 . 1 1 57 57 CYS N N 57 117.952 117.952 123.281 -5.329 18509 2260 1 5 . 1 1 57 57 CYS C C 57 175.209 175.209 175.301 -0.092 18509 2261 1 5 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.195 -7.107 18509 2262 1 5 . 1 1 57 57 CYS H H 57 8.900 8.900 8.197 0.703 18509 2263 1 5 . 1 1 58 58 THR N N 58 119.852 119.852 119.862 -0.010 18509 2264 1 5 . 1 1 58 58 THR CA C 58 58.239 58.239 65.100 -6.861 18509 2265 1 5 . 1 1 58 58 THR H H 58 8.505 8.505 8.409 0.096 18509 2266 1 5 . 1 1 59 59 SER C C 59 170.763 170.763 174.948 -4.185 18509 2267 1 5 . 1 1 59 59 SER CA C 59 55.609 55.609 60.421 -4.812 18509 2268 1 5 . 1 1 60 60 ALA N N 60 119.753 119.753 122.195 -2.442 18509 2269 1 5 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.607 -2.667 18509 2270 1 5 . 1 1 60 60 ALA H H 60 6.898 6.898 7.656 -0.758 18509 2271 1 5 . 1 1 61 61 GLY N N 61 101.351 101.351 107.964 -6.613 18509 2272 1 5 . 1 1 61 61 GLY CA C 61 42.805 42.805 44.850 -2.045 18509 2273 1 5 . 1 1 61 61 GLY H H 61 7.730 7.730 7.504 0.226 18509 2274 1 5 . 1 1 62 62 PRO C C 62 172.276 172.276 175.838 -3.562 18509 2275 1 5 . 1 1 63 63 HIS N N 63 115.023 115.023 119.047 -4.024 18509 2276 1 5 . 1 1 63 63 HIS CA C 63 52.119 52.119 55.246 -3.127 18509 2277 1 5 . 1 1 63 63 HIS H H 63 7.474 7.474 7.798 -0.324 18509 2278 1 5 . 1 1 64 64 PHE C C 64 171.731 171.731 174.126 -2.395 18509 2279 1 5 . 1 1 65 65 ASN N N 65 126.978 126.978 119.727 7.251 18509 2280 1 5 . 1 1 65 65 ASN CA C 65 47.753 47.753 49.551 -1.798 18509 2281 1 5 . 1 1 65 65 ASN H H 65 9.426 9.426 8.670 0.756 18509 2282 1 5 . 1 1 67 67 LEU N N 67 117.937 117.937 120.251 -2.314 18509 2283 1 5 . 1 1 67 67 LEU C C 67 172.580 172.580 178.390 -5.810 18509 2284 1 5 . 1 1 67 67 LEU CA C 67 50.911 50.911 57.818 -6.907 18509 2285 1 5 . 1 1 67 67 LEU H H 67 7.720 7.720 7.967 -0.247 18509 2286 1 5 . 1 1 68 68 SER N N 68 110.842 110.842 112.657 -1.815 18509 2287 1 5 . 1 1 68 68 SER CA C 68 55.953 55.953 60.899 -4.946 18509 2288 1 5 . 1 1 68 68 SER H H 68 7.428 7.428 8.451 -1.023 18509 2289 1 5 . 1 1 69 69 ARG N N 69 120.782 120.782 116.528 4.254 18509 2290 1 5 . 1 1 69 69 ARG C C 69 173.381 173.381 175.271 -1.890 18509 2291 1 5 . 1 1 69 69 ARG CA C 69 50.543 50.543 57.045 -6.502 18509 2292 1 5 . 1 1 69 69 ARG H H 69 8.508 8.508 8.268 0.240 18509 2293 1 5 . 1 1 70 70 LYS N N 70 118.055 118.055 116.025 2.030 18509 2294 1 5 . 1 1 70 70 LYS C C 70 169.994 169.994 173.891 -3.897 18509 2295 1 5 . 1 1 70 70 LYS CA C 70 52.596 52.596 57.456 -4.860 18509 2296 1 5 . 1 1 70 70 LYS H H 70 8.745 8.745 7.644 1.101 18509 2297 1 5 . 1 1 71 71 HIS N N 71 111.871 111.871 114.129 -2.258 18509 2298 1 5 . 1 1 71 71 HIS C C 71 171.534 171.534 173.258 -1.724 18509 2299 1 5 . 1 1 71 71 HIS CA C 71 52.549 52.549 54.828 -2.279 18509 2300 1 5 . 1 1 71 71 HIS H H 71 7.152 7.152 8.098 -0.946 18509 2301 1 5 . 1 1 72 72 GLY N N 72 112.910 112.910 110.975 1.935 18509 2302 1 5 . 1 1 72 72 GLY C C 72 168.634 168.634 172.266 -3.632 18509 2303 1 5 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.908 -3.634 18509 2304 1 5 . 1 1 72 72 GLY H H 72 7.209 7.209 8.324 -1.115 18509 2305 1 5 . 1 1 73 73 GLY N N 73 105.207 105.207 106.680 -1.473 18509 2306 1 5 . 1 1 73 73 GLY CA C 73 41.221 41.221 45.087 -3.866 18509 2307 1 5 . 1 1 73 73 GLY H H 73 8.789 8.789 7.399 1.390 18509 2308 1 5 . 1 1 74 74 PRO C C 74 175.753 175.753 176.900 -1.147 18509 2309 1 5 . 1 1 75 75 LYS N N 75 114.868 114.868 118.527 -3.659 18509 2310 1 5 . 1 1 75 75 LYS C C 75 173.640 173.640 176.489 -2.849 18509 2311 1 5 . 1 1 75 75 LYS CA C 75 51.103 51.103 57.864 -6.761 18509 2312 1 5 . 1 1 75 75 LYS H H 75 8.651 8.651 7.763 0.888 18509 2313 1 5 . 1 1 76 76 ASP N N 76 120.414 120.414 116.782 3.632 18509 2314 1 5 . 1 1 76 76 ASP C C 76 172.557 172.557 174.790 -2.233 18509 2315 1 5 . 1 1 76 76 ASP CA C 76 51.309 51.309 55.516 -4.207 18509 2316 1 5 . 1 1 76 76 ASP H H 76 7.461 7.461 7.962 -0.501 18509 2317 1 5 . 1 1 77 77 GLU N N 77 120.820 120.820 115.562 5.258 18509 2318 1 5 . 1 1 77 77 GLU C C 77 174.101 174.101 176.296 -2.195 18509 2319 1 5 . 1 1 77 77 GLU CA C 77 55.513 55.513 56.999 -1.486 18509 2320 1 5 . 1 1 77 77 GLU H H 77 8.315 8.315 7.902 0.413 18509 2321 1 5 . 1 1 78 78 GLU N N 78 119.251 119.251 118.703 0.548 18509 2322 1 5 . 1 1 78 78 GLU C C 78 168.285 168.285 175.931 -7.646 18509 2323 1 5 . 1 1 78 78 GLU CA C 78 52.078 52.078 58.810 -6.732 18509 2324 1 5 . 1 1 78 78 GLU H H 78 8.109 8.109 8.804 -0.695 18509 2325 1 5 . 1 1 79 79 ARG N N 79 118.991 118.991 113.363 5.628 18509 2326 1 5 . 1 1 79 79 ARG C C 79 172.123 172.123 174.967 -2.844 18509 2327 1 5 . 1 1 79 79 ARG CA C 79 51.074 51.074 56.636 -5.562 18509 2328 1 5 . 1 1 79 79 ARG H H 79 6.999 6.999 7.775 -0.776 18509 2329 1 5 . 1 1 80 80 HIS N N 80 118.000 118.000 117.070 0.930 18509 2330 1 5 . 1 1 80 80 HIS CA C 80 49.953 49.953 58.316 -8.364 18509 2331 1 5 . 1 1 80 80 HIS H H 80 8.355 8.355 8.313 0.042 18509 2332 1 5 . 1 1 81 81 VAL C C 81 173.460 173.460 175.870 -2.410 18509 2333 1 5 . 1 1 82 82 GLY N N 82 97.322 97.322 107.637 -10.315 18509 2334 1 5 . 1 1 82 82 GLY C C 82 170.370 170.370 172.217 -1.847 18509 2335 1 5 . 1 1 82 82 GLY CA C 82 42.688 42.688 44.020 -1.332 18509 2336 1 5 . 1 1 82 82 GLY H H 82 8.487 8.487 7.252 1.235 18509 2337 1 5 . 1 1 83 83 ASP N N 83 120.890 120.890 125.533 -4.643 18509 2338 1 5 . 1 1 83 83 ASP C C 83 168.737 168.737 174.447 -5.710 18509 2339 1 5 . 1 1 83 83 ASP CA C 83 52.918 52.918 52.873 0.044 18509 2340 1 5 . 1 1 83 83 ASP H H 83 7.127 7.127 7.973 -0.846 18509 2341 1 5 . 1 1 84 84 LEU N N 84 120.154 120.154 125.266 -5.112 18509 2342 1 5 . 1 1 84 84 LEU C C 84 173.212 173.212 175.277 -2.065 18509 2343 1 5 . 1 1 84 84 LEU CA C 84 50.433 50.433 53.772 -3.339 18509 2344 1 5 . 1 1 84 84 LEU H H 84 7.128 7.128 7.509 -0.381 18509 2345 1 5 . 1 1 85 85 GLY N N 85 106.867 106.867 109.888 -3.021 18509 2346 1 5 . 1 1 85 85 GLY C C 85 167.654 167.654 172.176 -4.522 18509 2347 1 5 . 1 1 85 85 GLY CA C 85 43.011 43.011 43.536 -0.525 18509 2348 1 5 . 1 1 85 85 GLY H H 85 8.260 8.260 7.165 1.095 18509 2349 1 5 . 1 1 86 86 ASN N N 86 117.454 117.454 117.537 -0.083 18509 2350 1 5 . 1 1 86 86 ASN C C 86 173.942 173.942 174.896 -0.954 18509 2351 1 5 . 1 1 86 86 ASN CA C 86 49.266 49.266 51.913 -2.647 18509 2352 1 5 . 1 1 86 86 ASN H H 86 8.041 8.041 8.463 -0.422 18509 2353 1 5 . 1 1 87 87 VAL N N 87 113.370 113.370 113.568 -0.198 18509 2354 1 5 . 1 1 87 87 VAL C C 87 171.526 171.526 174.376 -2.850 18509 2355 1 5 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.819 -5.111 18509 2356 1 5 . 1 1 87 87 VAL H H 87 8.960 8.960 8.097 0.863 18509 2357 1 5 . 1 1 88 88 THR N N 88 117.939 117.939 117.913 0.026 18509 2358 1 5 . 1 1 88 88 THR C C 88 170.367 170.367 173.277 -2.910 18509 2359 1 5 . 1 1 88 88 THR CA C 88 58.694 58.694 60.419 -1.725 18509 2360 1 5 . 1 1 88 88 THR H H 88 8.681 8.681 8.193 0.488 18509 2361 1 5 . 1 1 89 89 ALA N N 89 128.674 128.674 131.426 -2.752 18509 2362 1 5 . 1 1 89 89 ALA C C 89 174.480 174.480 176.364 -1.884 18509 2363 1 5 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.342 -3.973 18509 2364 1 5 . 1 1 89 89 ALA H H 89 9.377 9.377 8.309 1.068 18509 2365 1 5 . 1 1 90 90 ASP N N 90 124.235 124.235 125.357 -1.122 18509 2366 1 5 . 1 1 90 90 ASP C C 90 173.825 173.825 178.273 -4.448 18509 2367 1 5 . 1 1 90 90 ASP CA C 90 49.347 49.347 55.012 -5.665 18509 2368 1 5 . 1 1 90 90 ASP H H 90 8.455 8.455 8.141 0.314 18509 2369 1 5 . 1 1 91 91 LYS N N 91 114.942 114.942 118.591 -3.649 18509 2370 1 5 . 1 1 91 91 LYS C C 91 174.101 174.101 176.853 -2.752 18509 2371 1 5 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.813 -3.534 18509 2372 1 5 . 1 1 91 91 LYS H H 91 8.231 8.231 8.697 -0.466 18509 2373 1 5 . 1 1 92 92 ASP N N 92 119.251 119.251 117.702 1.549 18509 2374 1 5 . 1 1 92 92 ASP C C 92 173.020 173.020 175.759 -2.739 18509 2375 1 5 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.120 -1.994 18509 2376 1 5 . 1 1 92 92 ASP H H 92 8.109 8.109 7.618 0.491 18509 2377 1 5 . 1 1 93 93 GLY N N 93 110.868 110.868 108.290 2.578 18509 2378 1 5 . 1 1 93 93 GLY C C 93 169.706 169.706 172.676 -2.970 18509 2379 1 5 . 1 1 93 93 GLY CA C 93 43.763 43.763 44.524 -0.761 18509 2380 1 5 . 1 1 93 93 GLY H H 93 8.405 8.405 8.327 0.078 18509 2381 1 5 . 1 1 94 94 VAL N N 94 118.755 118.755 113.308 5.447 18509 2382 1 5 . 1 1 94 94 VAL C C 94 173.510 173.510 174.698 -1.188 18509 2383 1 5 . 1 1 94 94 VAL CA C 94 58.185 58.185 60.047 -1.863 18509 2384 1 5 . 1 1 94 94 VAL H H 94 7.814 7.814 7.935 -0.121 18509 2385 1 5 . 1 1 95 95 ALA N N 95 131.313 131.313 127.550 3.763 18509 2386 1 5 . 1 1 95 95 ALA C C 95 171.635 171.635 176.732 -5.097 18509 2387 1 5 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.030 -3.116 18509 2388 1 5 . 1 1 95 95 ALA H H 95 9.763 9.763 8.212 1.551 18509 2389 1 5 . 1 1 96 96 ASP N N 96 125.170 125.170 127.216 -2.046 18509 2390 1 5 . 1 1 96 96 ASP C C 96 172.336 172.336 175.859 -3.523 18509 2391 1 5 . 1 1 96 96 ASP H H 96 8.515 8.515 8.587 -0.072 18509 2392 1 5 . 1 1 97 97 VAL N N 97 125.879 125.879 121.865 4.014 18509 2393 1 5 . 1 1 97 97 VAL C C 97 173.488 173.488 174.562 -1.074 18509 2394 1 5 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.520 -3.277 18509 2395 1 5 . 1 1 97 97 VAL H H 97 8.703 8.703 7.618 1.085 18509 2396 1 5 . 1 1 98 98 SER N N 98 123.017 123.017 121.472 1.545 18509 2397 1 5 . 1 1 98 98 SER C C 98 169.715 169.715 172.995 -3.280 18509 2398 1 5 . 1 1 98 98 SER CA C 98 55.068 55.068 58.133 -3.065 18509 2399 1 5 . 1 1 98 98 SER H H 98 8.784 8.784 8.183 0.601 18509 2400 1 5 . 1 1 99 99 ILE N N 99 125.807 125.807 126.875 -1.068 18509 2401 1 5 . 1 1 99 99 ILE C C 99 171.321 171.321 174.883 -3.562 18509 2402 1 5 . 1 1 99 99 ILE CA C 99 57.155 57.155 61.095 -3.940 18509 2403 1 5 . 1 1 99 99 ILE H H 99 9.411 9.411 8.188 1.223 18509 2404 1 5 . 1 1 100 100 GLU N N 100 124.068 124.068 127.872 -3.804 18509 2405 1 5 . 1 1 100 100 GLU C C 100 172.098 172.098 175.088 -2.990 18509 2406 1 5 . 1 1 100 100 GLU CA C 100 52.290 52.290 55.594 -3.304 18509 2407 1 5 . 1 1 100 100 GLU H H 100 8.652 8.652 8.607 0.045 18509 2408 1 5 . 1 1 101 101 ASP N N 101 126.109 126.109 122.416 3.693 18509 2409 1 5 . 1 1 101 101 ASP C C 101 171.144 171.144 174.614 -3.470 18509 2410 1 5 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.131 -1.712 18509 2411 1 5 . 1 1 101 101 ASP H H 101 9.317 9.317 8.015 1.302 18509 2412 1 5 . 1 1 102 102 SER N N 102 118.470 118.470 118.090 0.380 18509 2413 1 5 . 1 1 102 102 SER C C 102 171.596 171.596 174.522 -2.926 18509 2414 1 5 . 1 1 102 102 SER CA C 102 55.245 55.245 58.281 -3.036 18509 2415 1 5 . 1 1 102 102 SER H H 102 8.933 8.933 8.643 0.290 18509 2416 1 5 . 1 1 103 103 VAL N N 103 123.179 123.179 117.167 6.012 18509 2417 1 5 . 1 1 103 103 VAL CA C 103 61.450 61.450 62.581 -1.131 18509 2418 1 5 . 1 1 103 103 VAL H H 103 8.148 8.148 7.563 0.585 18509 2419 1 5 . 1 1 104 104 ILE C C 104 169.576 169.576 175.437 -5.861 18509 2420 1 5 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.757 -0.563 18509 2421 1 5 . 1 1 105 105 SER N N 105 107.618 107.618 115.815 -8.197 18509 2422 1 5 . 1 1 105 105 SER C C 105 170.046 170.046 174.426 -4.380 18509 2423 1 5 . 1 1 105 105 SER CA C 105 52.550 52.550 57.975 -5.425 18509 2424 1 5 . 1 1 105 105 SER H H 105 6.988 6.988 7.592 -0.604 18509 2425 1 5 . 1 1 106 106 LEU N N 106 120.137 120.137 124.658 -4.521 18509 2426 1 5 . 1 1 106 106 LEU H H 106 8.313 8.313 8.676 -0.363 18509 2427 1 5 . 1 1 107 107 SER C C 107 170.701 170.701 172.395 -1.694 18509 2428 1 5 . 1 1 107 107 SER CA C 107 54.540 54.540 57.965 -3.425 18509 2429 1 5 . 1 1 108 108 GLY N N 108 107.603 107.603 110.788 -3.185 18509 2430 1 5 . 1 1 108 108 GLY C C 108 173.128 173.128 172.725 0.403 18509 2431 1 5 . 1 1 108 108 GLY CA C 108 41.287 41.287 45.337 -4.050 18509 2432 1 5 . 1 1 108 108 GLY H H 108 8.717 8.717 7.509 1.208 18509 2433 1 5 . 1 1 109 109 ASP N N 109 120.664 120.664 120.080 0.584 18509 2434 1 5 . 1 1 109 109 ASP C C 109 171.904 171.904 176.890 -4.986 18509 2435 1 5 . 1 1 109 109 ASP H H 109 9.019 9.019 8.853 0.166 18509 2436 1 5 . 1 1 110 110 HIS N N 110 116.324 116.324 119.825 -3.501 18509 2437 1 5 . 1 1 110 110 HIS H H 110 9.283 9.283 9.005 0.278 18509 2438 1 5 . 1 1 111 111 SER N N 111 110.225 110.225 113.678 -3.453 18509 2439 1 5 . 1 1 111 111 SER CA C 111 54.681 54.681 60.446 -5.765 18509 2440 1 5 . 1 1 111 111 SER H H 111 7.156 7.156 7.750 -0.594 18509 2441 1 5 . 1 1 112 112 ILE N N 112 117.053 117.053 112.603 4.450 18509 2442 1 5 . 1 1 112 112 ILE C C 112 171.419 171.419 175.031 -3.612 18509 2443 1 5 . 1 1 112 112 ILE CA C 112 57.239 57.239 60.120 -2.881 18509 2444 1 5 . 1 1 112 112 ILE H H 112 7.837 7.837 7.714 0.123 18509 2445 1 5 . 1 1 113 113 ILE N N 113 121.032 121.032 120.100 0.932 18509 2446 1 5 . 1 1 113 113 ILE C C 113 173.604 173.604 176.809 -3.205 18509 2447 1 5 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.734 -2.417 18509 2448 1 5 . 1 1 113 113 ILE H H 113 7.592 7.592 7.270 0.322 18509 2449 1 5 . 1 1 114 114 GLY N N 114 112.661 112.661 109.533 3.128 18509 2450 1 5 . 1 1 114 114 GLY C C 114 169.739 169.739 173.729 -3.990 18509 2451 1 5 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.692 -2.782 18509 2452 1 5 . 1 1 114 114 GLY H H 114 9.575 9.575 8.625 0.950 18509 2453 1 5 . 1 1 115 115 ARG N N 115 118.398 118.398 122.578 -4.180 18509 2454 1 5 . 1 1 115 115 ARG C C 115 171.079 171.079 176.609 -5.530 18509 2455 1 5 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.658 -2.995 18509 2456 1 5 . 1 1 115 115 ARG H H 115 7.464 7.464 8.171 -0.707 18509 2457 1 5 . 1 1 116 116 THR N N 116 112.218 112.218 119.505 -7.287 18509 2458 1 5 . 1 1 116 116 THR C C 116 169.821 169.821 174.147 -4.326 18509 2459 1 5 . 1 1 116 116 THR CA C 116 59.633 59.633 62.427 -2.794 18509 2460 1 5 . 1 1 116 116 THR H H 116 6.677 6.677 8.693 -2.016 18509 2461 1 5 . 1 1 117 117 LEU N N 117 129.477 129.477 131.343 -1.866 18509 2462 1 5 . 1 1 117 117 LEU C C 117 171.126 171.126 175.403 -4.277 18509 2463 1 5 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.714 -4.299 18509 2464 1 5 . 1 1 117 117 LEU H H 117 8.799 8.799 8.453 0.346 18509 2465 1 5 . 1 1 118 118 VAL N N 118 125.091 125.091 128.689 -3.598 18509 2466 1 5 . 1 1 118 118 VAL C C 118 170.267 170.267 175.069 -4.802 18509 2467 1 5 . 1 1 118 118 VAL CA C 118 58.139 58.139 62.536 -4.397 18509 2468 1 5 . 1 1 118 118 VAL H H 118 8.906 8.906 8.145 0.761 18509 2469 1 5 . 1 1 119 119 VAL N N 119 120.716 120.716 126.286 -5.570 18509 2470 1 5 . 1 1 119 119 VAL C C 119 171.175 171.175 174.137 -2.962 18509 2471 1 5 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.371 -4.100 18509 2472 1 5 . 1 1 119 119 VAL H H 119 7.982 7.982 8.040 -0.058 18509 2473 1 5 . 1 1 120 120 HIS N N 120 125.052 125.052 124.133 0.919 18509 2474 1 5 . 1 1 120 120 HIS C C 120 172.599 172.599 173.868 -1.269 18509 2475 1 5 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.518 -2.124 18509 2476 1 5 . 1 1 120 120 HIS H H 120 8.935 8.935 8.502 0.433 18509 2477 1 5 . 1 1 121 121 GLU N N 121 121.453 121.453 123.011 -1.558 18509 2478 1 5 . 1 1 121 121 GLU C C 121 172.304 172.304 175.561 -3.257 18509 2479 1 5 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.604 -0.514 18509 2480 1 5 . 1 1 121 121 GLU H H 121 9.178 9.178 7.871 1.307 18509 2481 1 5 . 1 1 122 122 LYS N N 122 115.248 115.248 121.005 -5.757 18509 2482 1 5 . 1 1 122 122 LYS C C 122 171.523 171.523 174.588 -3.065 18509 2483 1 5 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.448 -4.829 18509 2484 1 5 . 1 1 122 122 LYS H H 122 8.478 8.478 7.900 0.578 18509 2485 1 5 . 1 1 123 123 ALA N N 123 120.866 120.866 124.174 -3.308 18509 2486 1 5 . 1 1 123 123 ALA C C 123 173.219 173.219 177.153 -3.934 18509 2487 1 5 . 1 1 123 123 ALA CA C 123 48.850 48.850 51.370 -2.520 18509 2488 1 5 . 1 1 123 123 ALA H H 123 7.796 7.796 8.386 -0.590 18509 2489 1 5 . 1 1 124 124 ASP N N 124 121.799 121.799 125.428 -3.629 18509 2490 1 5 . 1 1 124 124 ASP C C 124 174.458 174.458 174.609 -0.151 18509 2491 1 5 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.111 -3.703 18509 2492 1 5 . 1 1 124 124 ASP H H 124 10.165 10.165 8.070 2.095 18509 2493 1 5 . 1 1 125 125 ASP N N 125 129.369 129.369 124.386 4.983 18509 2494 1 5 . 1 1 125 125 ASP C C 125 175.231 175.231 175.913 -0.682 18509 2495 1 5 . 1 1 125 125 ASP CA C 125 50.939 50.939 51.859 -0.920 18509 2496 1 5 . 1 1 125 125 ASP H H 125 10.055 10.055 8.037 2.018 18509 2497 1 5 . 1 1 126 126 LEU N N 126 117.190 117.190 126.768 -9.578 18509 2498 1 5 . 1 1 126 126 LEU C C 126 173.964 173.964 176.842 -2.878 18509 2499 1 5 . 1 1 126 126 LEU H H 126 10.483 10.483 9.265 1.218 18509 2500 1 5 . 1 1 127 127 GLY N N 127 103.809 103.809 105.405 -1.596 18509 2501 1 5 . 1 1 127 127 GLY CA C 127 42.878 42.878 44.802 -1.924 18509 2502 1 5 . 1 1 127 127 GLY H H 127 8.637 8.637 8.661 -0.024 18509 2503 1 5 . 1 1 128 128 LYS N N 128 118.290 118.290 121.523 -3.233 18509 2504 1 5 . 1 1 128 128 LYS CA C 128 51.740 51.740 54.948 -3.208 18509 2505 1 5 . 1 1 128 128 LYS H H 128 7.158 7.158 7.403 -0.245 18509 2506 1 5 . 1 1 129 129 GLY N N 129 108.507 108.507 107.801 0.706 18509 2507 1 5 . 1 1 129 129 GLY C C 129 171.524 171.524 175.055 -3.531 18509 2508 1 5 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.166 -4.053 18509 2509 1 5 . 1 1 129 129 GLY H H 129 8.913 8.913 8.199 0.714 18509 2510 1 5 . 1 1 130 130 GLY N N 130 108.537 108.537 107.445 1.092 18509 2511 1 5 . 1 1 130 130 GLY C C 130 169.994 169.994 173.876 -3.882 18509 2512 1 5 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.667 -2.248 18509 2513 1 5 . 1 1 130 130 GLY H H 130 8.723 8.723 8.068 0.655 18509 2514 1 5 . 1 1 131 131 ASN N N 131 111.951 111.951 117.610 -5.659 18509 2515 1 5 . 1 1 131 131 ASN C C 131 172.236 172.236 174.434 -2.198 18509 2516 1 5 . 1 1 131 131 ASN H H 131 7.152 7.152 7.783 -0.631 18509 2517 1 5 . 1 1 132 132 GLU N N 132 120.461 120.461 120.923 -0.462 18509 2518 1 5 . 1 1 132 132 GLU C C 132 171.084 171.084 177.634 -6.550 18509 2519 1 5 . 1 1 132 132 GLU H H 132 8.935 8.935 8.881 0.054 18509 2520 1 5 . 1 1 133 133 GLU N N 133 120.137 120.137 119.592 0.545 18509 2521 1 5 . 1 1 133 133 GLU C C 133 176.239 176.239 178.639 -2.400 18509 2522 1 5 . 1 1 133 133 GLU H H 133 8.775 8.775 8.645 0.130 18509 2523 1 5 . 1 1 134 134 SER N N 134 114.981 114.981 114.463 0.518 18509 2524 1 5 . 1 1 134 134 SER CA C 134 59.046 59.046 61.594 -2.548 18509 2525 1 5 . 1 1 134 134 SER H H 134 8.117 8.117 7.863 0.254 18509 2526 1 5 . 1 1 135 135 THR N N 135 102.263 102.263 117.860 -15.597 18509 2527 1 5 . 1 1 135 135 THR C C 135 172.804 172.804 175.954 -3.150 18509 2528 1 5 . 1 1 135 135 THR CA C 135 60.029 60.029 65.659 -5.630 18509 2529 1 5 . 1 1 135 135 THR H H 135 7.206 7.206 8.594 -1.388 18509 2530 1 5 . 1 1 136 136 LYS N N 136 122.108 122.108 122.333 -0.225 18509 2531 1 5 . 1 1 136 136 LYS H H 136 7.884 7.884 7.763 0.121 18509 2532 1 5 . 1 1 137 137 THR N N 137 105.718 105.718 114.265 -8.547 18509 2533 1 5 . 1 1 137 137 THR H H 137 8.630 8.630 8.240 0.390 18509 2534 1 5 . 1 1 138 138 GLY N N 138 111.372 111.372 110.284 1.088 18509 2535 1 5 . 1 1 138 138 GLY CA C 138 42.483 42.483 44.864 -2.381 18509 2536 1 5 . 1 1 138 138 GLY H H 138 7.426 7.426 8.117 -0.691 18509 2537 1 5 . 1 1 139 139 ASN N N 139 107.496 107.496 119.824 -12.328 18509 2538 1 5 . 1 1 139 139 ASN H H 139 7.545 7.545 7.967 -0.422 18509 2539 1 5 . 1 1 140 140 ALA N N 140 114.542 114.542 127.864 -13.322 18509 2540 1 5 . 1 1 140 140 ALA C C 140 173.571 173.571 176.224 -2.653 18509 2541 1 5 . 1 1 140 140 ALA H H 140 6.368 6.368 8.277 -1.909 18509 2542 1 5 . 1 1 141 141 GLY N N 141 105.287 105.287 109.154 -3.867 18509 2543 1 5 . 1 1 141 141 GLY C C 141 173.542 173.542 175.663 -2.121 18509 2544 1 5 . 1 1 141 141 GLY H H 141 8.271 8.271 8.725 -0.454 18509 2545 1 5 . 1 1 142 142 SER N N 142 118.771 118.771 122.123 -3.352 18509 2546 1 5 . 1 1 142 142 SER C C 142 170.188 170.188 175.130 -4.942 18509 2547 1 5 . 1 1 142 142 SER H H 142 9.196 9.196 8.634 0.562 18509 2548 1 5 . 1 1 143 143 ARG N N 143 120.189 120.189 118.137 2.052 18509 2549 1 5 . 1 1 143 143 ARG C C 143 171.596 171.596 176.154 -4.558 18509 2550 1 5 . 1 1 143 143 ARG H H 143 8.943 8.943 7.804 1.139 18509 2551 1 5 . 1 1 144 144 LEU N N 144 122.907 122.907 120.397 2.510 18509 2552 1 5 . 1 1 144 144 LEU C C 144 174.393 174.393 175.977 -1.584 18509 2553 1 5 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.145 -2.770 18509 2554 1 5 . 1 1 144 144 LEU H H 144 8.395 8.395 7.439 0.956 18509 2555 1 5 . 1 1 145 145 ALA N N 145 114.159 114.159 118.133 -3.974 18509 2556 1 5 . 1 1 145 145 ALA C C 145 171.752 171.752 175.098 -3.346 18509 2557 1 5 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.445 -3.316 18509 2558 1 5 . 1 1 145 145 ALA H H 145 7.356 7.356 7.485 -0.129 18509 2559 1 5 . 1 1 146 146 CYS N N 146 110.738 110.738 123.204 -12.466 18509 2560 1 5 . 1 1 146 146 CYS C C 146 170.087 170.087 174.595 -4.508 18509 2561 1 5 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.320 -6.243 18509 2562 1 5 . 1 1 146 146 CYS H H 146 9.008 9.008 8.512 0.496 18509 2563 1 5 . 1 1 147 147 GLY N N 147 106.461 106.461 110.620 -4.159 18509 2564 1 5 . 1 1 147 147 GLY C C 147 167.909 167.909 172.267 -4.358 18509 2565 1 5 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.619 -2.945 18509 2566 1 5 . 1 1 147 147 GLY H H 147 8.018 8.018 8.164 -0.146 18509 2567 1 5 . 1 1 148 148 VAL N N 148 124.054 124.054 123.154 0.900 18509 2568 1 5 . 1 1 148 148 VAL C C 148 172.084 172.084 174.842 -2.758 18509 2569 1 5 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.163 -2.528 18509 2570 1 5 . 1 1 148 148 VAL H H 148 8.434 8.434 8.468 -0.034 18509 2571 1 5 . 1 1 149 149 ILE N N 149 126.918 126.918 128.528 -1.610 18509 2572 1 5 . 1 1 149 149 ILE C C 149 171.804 171.804 175.724 -3.920 18509 2573 1 5 . 1 1 149 149 ILE CA C 149 59.184 59.184 60.196 -1.012 18509 2574 1 5 . 1 1 149 149 ILE H H 149 8.613 8.613 8.515 0.098 18509 2575 1 5 . 1 1 150 150 GLY N N 150 116.493 116.493 115.251 1.242 18509 2576 1 5 . 1 1 150 150 GLY C C 150 170.188 170.188 171.955 -1.767 18509 2577 1 5 . 1 1 150 150 GLY CA C 150 40.120 40.120 45.232 -5.112 18509 2578 1 5 . 1 1 150 150 GLY H H 150 9.283 9.283 7.918 1.365 18509 2579 1 5 . 1 1 151 151 ILE N N 151 120.189 120.189 122.050 -1.861 18509 2580 1 5 . 1 1 151 151 ILE C C 151 172.231 172.231 173.747 -1.516 18509 2581 1 5 . 1 1 151 151 ILE CA C 151 60.372 60.372 60.196 0.176 18509 2582 1 5 . 1 1 151 151 ILE H H 151 8.943 8.943 7.872 1.071 18509 2583 1 5 . 1 1 152 152 ALA N N 152 129.719 129.719 130.507 -0.788 18509 2584 1 5 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.538 -4.766 18509 2585 1 5 . 1 1 152 152 ALA H H 152 8.170 8.170 7.591 0.579 18509 2586 1 6 . 1 1 2 2 THR C C 2 170.139 170.139 173.851 -3.712 18509 2587 1 6 . 1 1 3 3 LYS N N 3 123.998 123.998 117.945 6.053 18509 2588 1 6 . 1 1 3 3 LYS C C 3 171.607 171.607 174.163 -2.556 18509 2589 1 6 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.495 -3.317 18509 2590 1 6 . 1 1 3 3 LYS H H 3 8.666 8.666 7.441 1.225 18509 2591 1 6 . 1 1 4 4 ALA N N 4 123.295 123.295 123.396 -0.101 18509 2592 1 6 . 1 1 4 4 ALA C C 4 172.145 172.145 175.440 -3.295 18509 2593 1 6 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.554 -3.050 18509 2594 1 6 . 1 1 4 4 ALA H H 4 9.116 9.116 8.437 0.679 18509 2595 1 6 . 1 1 5 5 VAL N N 5 121.466 121.466 120.148 1.318 18509 2596 1 6 . 1 1 5 5 VAL C C 5 167.836 167.836 174.114 -6.278 18509 2597 1 6 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.233 -4.359 18509 2598 1 6 . 1 1 5 5 VAL H H 5 9.545 9.545 8.965 0.580 18509 2599 1 6 . 1 1 6 6 ALA N N 6 125.984 125.984 129.708 -3.724 18509 2600 1 6 . 1 1 6 6 ALA C C 6 171.607 171.607 176.250 -4.643 18509 2601 1 6 . 1 1 6 6 ALA CA C 6 47.471 47.471 49.740 -2.269 18509 2602 1 6 . 1 1 6 6 ALA H H 6 9.177 9.177 8.237 0.940 18509 2603 1 6 . 1 1 7 7 VAL N N 7 123.600 123.600 118.562 5.038 18509 2604 1 6 . 1 1 7 7 VAL C C 7 172.244 172.244 174.101 -1.857 18509 2605 1 6 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.267 -1.791 18509 2606 1 6 . 1 1 7 7 VAL H H 7 9.116 9.116 7.937 1.179 18509 2607 1 6 . 1 1 8 8 LEU N N 8 126.455 126.455 127.363 -0.908 18509 2608 1 6 . 1 1 8 8 LEU C C 8 172.557 172.557 175.905 -3.348 18509 2609 1 6 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.934 -2.882 18509 2610 1 6 . 1 1 8 8 LEU H H 8 8.916 8.916 8.298 0.618 18509 2611 1 6 . 1 1 9 9 LYS N N 9 120.820 120.820 123.191 -2.371 18509 2612 1 6 . 1 1 9 9 LYS C C 9 172.509 172.509 174.867 -2.358 18509 2613 1 6 . 1 1 9 9 LYS CA C 9 51.897 51.897 56.156 -4.259 18509 2614 1 6 . 1 1 9 9 LYS H H 9 8.315 8.315 8.546 -0.231 18509 2615 1 6 . 1 1 10 10 GLY N N 10 111.249 111.249 112.642 -1.393 18509 2616 1 6 . 1 1 10 10 GLY C C 10 169.847 169.847 173.175 -3.328 18509 2617 1 6 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.350 -3.075 18509 2618 1 6 . 1 1 10 10 GLY H H 10 8.968 8.968 8.390 0.578 18509 2619 1 6 . 1 1 11 11 ASP N N 11 120.904 120.904 120.997 -0.093 18509 2620 1 6 . 1 1 11 11 ASP C C 11 173.132 173.132 177.402 -4.270 18509 2621 1 6 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.802 -4.485 18509 2622 1 6 . 1 1 11 11 ASP H H 11 8.745 8.745 8.352 0.393 18509 2623 1 6 . 1 1 12 12 GLY N N 12 109.862 109.862 107.991 1.871 18509 2624 1 6 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.690 -2.490 18509 2625 1 6 . 1 1 12 12 GLY H H 12 7.985 7.985 8.428 -0.443 18509 2626 1 6 . 1 1 13 13 PRO C C 13 173.640 173.640 175.665 -2.025 18509 2627 1 6 . 1 1 14 14 VAL N N 14 120.414 120.414 117.966 2.448 18509 2628 1 6 . 1 1 14 14 VAL C C 14 172.804 172.804 174.085 -1.281 18509 2629 1 6 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.056 -0.172 18509 2630 1 6 . 1 1 14 14 VAL H H 14 7.476 7.476 8.026 -0.550 18509 2631 1 6 . 1 1 15 15 GLN N N 15 122.664 122.664 126.182 -3.518 18509 2632 1 6 . 1 1 15 15 GLN C C 15 171.168 171.168 174.142 -2.974 18509 2633 1 6 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.336 -3.657 18509 2634 1 6 . 1 1 15 15 GLN H H 15 7.938 7.938 8.888 -0.950 18509 2635 1 6 . 1 1 16 16 GLY N N 16 107.018 107.018 111.229 -4.211 18509 2636 1 6 . 1 1 16 16 GLY C C 16 167.726 167.726 171.892 -4.166 18509 2637 1 6 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.107 -1.482 18509 2638 1 6 . 1 1 16 16 GLY H H 16 8.288 8.288 8.404 -0.116 18509 2639 1 6 . 1 1 17 17 ILE N N 17 120.248 120.248 115.254 4.994 18509 2640 1 6 . 1 1 17 17 ILE C C 17 171.194 171.194 173.539 -2.345 18509 2641 1 6 . 1 1 17 17 ILE CA C 17 58.497 58.497 60.128 -1.631 18509 2642 1 6 . 1 1 17 17 ILE H H 17 7.948 7.948 8.161 -0.213 18509 2643 1 6 . 1 1 18 18 ILE N N 18 125.851 125.851 124.459 1.392 18509 2644 1 6 . 1 1 18 18 ILE C C 18 168.889 168.889 173.411 -4.522 18509 2645 1 6 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.109 -5.678 18509 2646 1 6 . 1 1 18 18 ILE H H 18 8.725 8.725 8.052 0.673 18509 2647 1 6 . 1 1 19 19 ASN N N 19 123.256 123.256 125.820 -2.564 18509 2648 1 6 . 1 1 19 19 ASN C C 19 168.903 168.903 173.120 -4.217 18509 2649 1 6 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.478 -2.390 18509 2650 1 6 . 1 1 19 19 ASN H H 19 8.727 8.727 8.214 0.513 18509 2651 1 6 . 1 1 20 20 PHE N N 20 113.849 113.849 123.755 -9.906 18509 2652 1 6 . 1 1 20 20 PHE C C 20 173.219 173.219 173.401 -0.182 18509 2653 1 6 . 1 1 20 20 PHE CA C 20 52.058 52.058 55.984 -3.926 18509 2654 1 6 . 1 1 20 20 PHE H H 20 8.399 8.399 8.552 -0.153 18509 2655 1 6 . 1 1 21 21 GLU N N 21 121.454 121.454 124.493 -3.039 18509 2656 1 6 . 1 1 21 21 GLU C C 21 170.280 170.280 174.704 -4.424 18509 2657 1 6 . 1 1 21 21 GLU CA C 21 53.044 53.044 53.710 -0.666 18509 2658 1 6 . 1 1 21 21 GLU H H 21 9.526 9.526 7.822 1.704 18509 2659 1 6 . 1 1 22 22 GLN N N 22 130.340 130.340 122.166 8.174 18509 2660 1 6 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.815 -3.635 18509 2661 1 6 . 1 1 22 22 GLN H H 22 9.305 9.305 8.523 0.782 18509 2662 1 6 . 1 1 23 23 LYS N N 23 128.657 128.657 125.065 3.592 18509 2663 1 6 . 1 1 23 23 LYS CA C 23 57.241 57.241 54.738 2.503 18509 2664 1 6 . 1 1 23 23 LYS H H 23 9.088 9.088 8.987 0.101 18509 2665 1 6 . 1 1 24 24 GLU CA C 24 51.392 51.392 59.535 -8.143 18509 2666 1 6 . 1 1 25 25 SER CA C 25 58.078 58.078 57.825 0.252 18509 2667 1 6 . 1 1 27 27 GLY N N 27 108.125 108.125 111.016 -2.891 18509 2668 1 6 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.488 -1.563 18509 2669 1 6 . 1 1 27 27 GLY H H 27 8.032 8.032 7.946 0.086 18509 2670 1 6 . 1 1 28 28 PRO C C 28 173.128 173.128 175.859 -2.731 18509 2671 1 6 . 1 1 29 29 VAL N N 29 121.267 121.267 125.009 -3.742 18509 2672 1 6 . 1 1 29 29 VAL C C 29 172.198 172.198 175.305 -3.107 18509 2673 1 6 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.631 -3.911 18509 2674 1 6 . 1 1 29 29 VAL H H 29 9.089 9.089 8.478 0.611 18509 2675 1 6 . 1 1 30 30 LYS N N 30 127.589 127.589 130.183 -2.594 18509 2676 1 6 . 1 1 30 30 LYS C C 30 172.098 172.098 174.745 -2.647 18509 2677 1 6 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.396 -2.754 18509 2678 1 6 . 1 1 30 30 LYS H H 30 9.200 9.200 8.925 0.275 18509 2679 1 6 . 1 1 31 31 VAL N N 31 126.037 126.037 117.813 8.224 18509 2680 1 6 . 1 1 31 31 VAL C C 31 172.244 172.244 174.551 -2.307 18509 2681 1 6 . 1 1 31 31 VAL CA C 31 57.139 57.139 58.802 -1.663 18509 2682 1 6 . 1 1 31 31 VAL H H 31 9.282 9.282 8.348 0.934 18509 2683 1 6 . 1 1 32 32 TRP N N 32 125.414 125.414 122.157 3.257 18509 2684 1 6 . 1 1 32 32 TRP C C 32 170.156 170.156 173.858 -3.702 18509 2685 1 6 . 1 1 32 32 TRP CA C 32 53.137 53.137 55.506 -2.369 18509 2686 1 6 . 1 1 32 32 TRP H H 32 8.983 8.983 8.101 0.882 18509 2687 1 6 . 1 1 33 33 GLY N N 33 107.848 107.848 110.051 -2.203 18509 2688 1 6 . 1 1 33 33 GLY C C 33 168.400 168.400 172.456 -4.056 18509 2689 1 6 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.932 -3.365 18509 2690 1 6 . 1 1 33 33 GLY H H 33 8.360 8.360 8.525 -0.165 18509 2691 1 6 . 1 1 34 34 SER N N 34 114.377 114.377 117.682 -3.305 18509 2692 1 6 . 1 1 34 34 SER C C 34 169.618 169.618 173.190 -3.572 18509 2693 1 6 . 1 1 34 34 SER CA C 34 53.875 53.875 56.961 -3.086 18509 2694 1 6 . 1 1 34 34 SER H H 34 7.838 7.838 8.438 -0.600 18509 2695 1 6 . 1 1 35 35 ILE N N 35 123.149 123.149 124.868 -1.719 18509 2696 1 6 . 1 1 35 35 ILE C C 35 169.713 169.713 175.213 -5.500 18509 2697 1 6 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.319 -2.550 18509 2698 1 6 . 1 1 35 35 ILE H H 35 8.496 8.496 8.507 -0.011 18509 2699 1 6 . 1 1 36 36 LYS N N 36 123.803 123.803 125.336 -1.533 18509 2700 1 6 . 1 1 36 36 LYS C C 36 172.260 172.260 175.514 -3.254 18509 2701 1 6 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.714 -3.564 18509 2702 1 6 . 1 1 36 36 LYS H H 36 9.091 9.091 9.013 0.078 18509 2703 1 6 . 1 1 37 37 GLY N N 37 105.495 105.495 108.464 -2.969 18509 2704 1 6 . 1 1 37 37 GLY C C 37 171.641 171.641 172.503 -0.862 18509 2705 1 6 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.779 -2.418 18509 2706 1 6 . 1 1 37 37 GLY H H 37 8.237 8.237 8.134 0.103 18509 2707 1 6 . 1 1 38 38 LEU N N 38 120.966 120.966 117.085 3.881 18509 2708 1 6 . 1 1 38 38 LEU C C 38 174.112 174.112 177.187 -3.075 18509 2709 1 6 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.766 -4.295 18509 2710 1 6 . 1 1 38 38 LEU H H 38 8.156 8.156 8.392 -0.236 18509 2711 1 6 . 1 1 39 39 THR N N 39 110.363 110.363 111.679 -1.316 18509 2712 1 6 . 1 1 39 39 THR C C 39 173.102 173.102 174.577 -1.475 18509 2713 1 6 . 1 1 39 39 THR CA C 39 58.194 58.194 62.870 -4.676 18509 2714 1 6 . 1 1 39 39 THR H H 39 8.660 8.660 8.113 0.547 18509 2715 1 6 . 1 1 40 40 GLU N N 40 125.818 125.818 125.897 -0.079 18509 2716 1 6 . 1 1 40 40 GLU C C 40 173.134 173.134 174.300 -1.166 18509 2717 1 6 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.400 -2.044 18509 2718 1 6 . 1 1 40 40 GLU H H 40 8.804 8.804 9.048 -0.244 18509 2719 1 6 . 1 1 41 41 GLY N N 41 113.875 113.875 112.271 1.604 18509 2720 1 6 . 1 1 41 41 GLY C C 41 170.046 170.046 172.764 -2.718 18509 2721 1 6 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.242 -5.188 18509 2722 1 6 . 1 1 41 41 GLY H H 41 8.763 8.763 8.362 0.401 18509 2723 1 6 . 1 1 42 42 LEU N N 42 120.137 120.137 123.298 -3.161 18509 2724 1 6 . 1 1 42 42 LEU C C 42 174.218 174.218 177.015 -2.797 18509 2725 1 6 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.428 -3.273 18509 2726 1 6 . 1 1 42 42 LEU H H 42 8.313 8.313 8.335 -0.022 18509 2727 1 6 . 1 1 43 43 HIS N N 43 114.385 114.385 112.194 2.191 18509 2728 1 6 . 1 1 43 43 HIS C C 43 171.504 171.504 173.929 -2.425 18509 2729 1 6 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.652 -4.667 18509 2730 1 6 . 1 1 43 43 HIS H H 43 8.712 8.712 7.551 1.161 18509 2731 1 6 . 1 1 44 44 GLY N N 44 108.872 108.872 106.467 2.405 18509 2732 1 6 . 1 1 44 44 GLY C C 44 168.656 168.656 172.136 -3.480 18509 2733 1 6 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.851 -1.656 18509 2734 1 6 . 1 1 44 44 GLY H H 44 8.875 8.875 9.255 -0.380 18509 2735 1 6 . 1 1 45 45 PHE N N 45 126.439 126.439 116.366 10.073 18509 2736 1 6 . 1 1 45 45 PHE CA C 45 53.098 53.098 55.672 -2.574 18509 2737 1 6 . 1 1 45 45 PHE H H 45 8.111 8.111 8.237 -0.126 18509 2738 1 6 . 1 1 46 46 HIS N N 46 115.353 115.353 118.588 -3.235 18509 2739 1 6 . 1 1 46 46 HIS C C 46 172.415 172.415 174.054 -1.639 18509 2740 1 6 . 1 1 46 46 HIS CA C 46 49.206 49.206 55.077 -5.871 18509 2741 1 6 . 1 1 46 46 HIS H H 46 8.107 8.107 8.147 -0.040 18509 2742 1 6 . 1 1 47 47 VAL N N 47 120.548 120.548 114.532 6.016 18509 2743 1 6 . 1 1 47 47 VAL C C 47 173.900 173.900 173.565 0.335 18509 2744 1 6 . 1 1 47 47 VAL CA C 47 58.792 58.792 62.449 -3.657 18509 2745 1 6 . 1 1 47 47 VAL H H 47 9.366 9.366 8.237 1.129 18509 2746 1 6 . 1 1 48 48 HIS N N 48 129.236 129.236 123.046 6.190 18509 2747 1 6 . 1 1 48 48 HIS C C 48 171.084 171.084 173.241 -2.157 18509 2748 1 6 . 1 1 48 48 HIS CA C 48 52.756 52.756 55.818 -3.062 18509 2749 1 6 . 1 1 48 48 HIS H H 48 10.210 10.210 8.091 2.119 18509 2750 1 6 . 1 1 49 49 GLU N N 49 118.119 118.119 123.490 -5.371 18509 2751 1 6 . 1 1 49 49 GLU C C 49 171.635 171.635 174.525 -2.890 18509 2752 1 6 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.655 2.104 18509 2753 1 6 . 1 1 49 49 GLU H H 49 8.492 8.492 8.106 0.386 18509 2754 1 6 . 1 1 50 50 PHE N N 50 110.329 110.329 125.473 -15.144 18509 2755 1 6 . 1 1 50 50 PHE C C 50 175.252 175.252 173.774 1.478 18509 2756 1 6 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.275 -5.375 18509 2757 1 6 . 1 1 50 50 PHE H H 50 8.580 8.580 7.876 0.704 18509 2758 1 6 . 1 1 51 51 GLY N N 51 119.251 119.251 112.417 6.834 18509 2759 1 6 . 1 1 51 51 GLY C C 51 168.248 168.248 172.811 -4.563 18509 2760 1 6 . 1 1 51 51 GLY H H 51 10.208 10.208 7.716 2.492 18509 2761 1 6 . 1 1 52 52 ASP N N 52 114.958 114.958 122.700 -7.742 18509 2762 1 6 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.853 -5.962 18509 2763 1 6 . 1 1 52 52 ASP H H 52 5.834 5.834 8.083 -2.249 18509 2764 1 6 . 1 1 53 53 ASN N N 53 128.224 128.224 114.401 13.823 18509 2765 1 6 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.072 -3.839 18509 2766 1 6 . 1 1 53 53 ASN H H 53 9.360 9.360 7.984 1.376 18509 2767 1 6 . 1 1 54 54 THR C C 54 168.656 168.656 173.802 -5.146 18509 2768 1 6 . 1 1 55 55 ALA N N 55 126.661 126.661 121.744 4.917 18509 2769 1 6 . 1 1 55 55 ALA C C 55 174.185 174.185 176.220 -2.035 18509 2770 1 6 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.083 -4.928 18509 2771 1 6 . 1 1 55 55 ALA H H 55 8.390 8.390 7.689 0.701 18509 2772 1 6 . 1 1 56 56 GLY N N 56 107.903 107.903 106.351 1.552 18509 2773 1 6 . 1 1 56 56 GLY C C 56 171.578 171.578 173.216 -1.638 18509 2774 1 6 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.299 -2.719 18509 2775 1 6 . 1 1 56 56 GLY H H 56 7.282 7.282 7.448 -0.166 18509 2776 1 6 . 1 1 57 57 CYS N N 57 117.952 117.952 124.182 -6.230 18509 2777 1 6 . 1 1 57 57 CYS C C 57 175.209 175.209 176.446 -1.237 18509 2778 1 6 . 1 1 57 57 CYS CA C 57 49.088 49.088 55.473 -6.385 18509 2779 1 6 . 1 1 57 57 CYS H H 57 8.900 8.900 8.697 0.203 18509 2780 1 6 . 1 1 58 58 THR N N 58 119.852 119.852 117.767 2.085 18509 2781 1 6 . 1 1 58 58 THR CA C 58 58.239 58.239 65.958 -7.719 18509 2782 1 6 . 1 1 58 58 THR H H 58 8.505 8.505 9.233 -0.728 18509 2783 1 6 . 1 1 59 59 SER C C 59 170.763 170.763 174.707 -3.944 18509 2784 1 6 . 1 1 59 59 SER CA C 59 55.609 55.609 61.098 -5.489 18509 2785 1 6 . 1 1 60 60 ALA N N 60 119.753 119.753 120.882 -1.129 18509 2786 1 6 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.215 -2.275 18509 2787 1 6 . 1 1 60 60 ALA H H 60 6.898 6.898 7.890 -0.992 18509 2788 1 6 . 1 1 61 61 GLY N N 61 101.351 101.351 107.091 -5.740 18509 2789 1 6 . 1 1 61 61 GLY CA C 61 42.805 42.805 46.681 -3.876 18509 2790 1 6 . 1 1 61 61 GLY H H 61 7.730 7.730 7.703 0.027 18509 2791 1 6 . 1 1 62 62 PRO C C 62 172.276 172.276 175.950 -3.674 18509 2792 1 6 . 1 1 63 63 HIS N N 63 115.023 115.023 120.615 -5.592 18509 2793 1 6 . 1 1 63 63 HIS CA C 63 52.119 52.119 56.157 -4.038 18509 2794 1 6 . 1 1 63 63 HIS H H 63 7.474 7.474 7.791 -0.317 18509 2795 1 6 . 1 1 64 64 PHE C C 64 171.731 171.731 173.422 -1.691 18509 2796 1 6 . 1 1 65 65 ASN N N 65 126.978 126.978 121.814 5.164 18509 2797 1 6 . 1 1 65 65 ASN CA C 65 47.753 47.753 50.282 -2.529 18509 2798 1 6 . 1 1 65 65 ASN H H 65 9.426 9.426 8.335 1.091 18509 2799 1 6 . 1 1 67 67 LEU N N 67 117.937 117.937 116.677 1.260 18509 2800 1 6 . 1 1 67 67 LEU C C 67 172.580 172.580 177.603 -5.023 18509 2801 1 6 . 1 1 67 67 LEU CA C 67 50.911 50.911 56.639 -5.728 18509 2802 1 6 . 1 1 67 67 LEU H H 67 7.720 7.720 8.337 -0.617 18509 2803 1 6 . 1 1 68 68 SER N N 68 110.842 110.842 113.578 -2.736 18509 2804 1 6 . 1 1 68 68 SER CA C 68 55.953 55.953 59.633 -3.680 18509 2805 1 6 . 1 1 68 68 SER H H 68 7.428 7.428 7.565 -0.137 18509 2806 1 6 . 1 1 69 69 ARG N N 69 120.782 120.782 120.297 0.485 18509 2807 1 6 . 1 1 69 69 ARG C C 69 173.381 173.381 175.984 -2.603 18509 2808 1 6 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.575 -5.032 18509 2809 1 6 . 1 1 69 69 ARG H H 69 8.508 8.508 7.914 0.594 18509 2810 1 6 . 1 1 70 70 LYS N N 70 118.055 118.055 118.461 -0.406 18509 2811 1 6 . 1 1 70 70 LYS C C 70 169.994 169.994 174.122 -4.128 18509 2812 1 6 . 1 1 70 70 LYS CA C 70 52.596 52.596 59.032 -6.436 18509 2813 1 6 . 1 1 70 70 LYS H H 70 8.745 8.745 8.417 0.328 18509 2814 1 6 . 1 1 71 71 HIS N N 71 111.871 111.871 114.006 -2.135 18509 2815 1 6 . 1 1 71 71 HIS C C 71 171.534 171.534 173.184 -1.650 18509 2816 1 6 . 1 1 71 71 HIS CA C 71 52.549 52.549 54.623 -2.074 18509 2817 1 6 . 1 1 71 71 HIS H H 71 7.152 7.152 7.910 -0.758 18509 2818 1 6 . 1 1 72 72 GLY N N 72 112.910 112.910 111.114 1.796 18509 2819 1 6 . 1 1 72 72 GLY C C 72 168.634 168.634 172.777 -4.143 18509 2820 1 6 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.893 -3.619 18509 2821 1 6 . 1 1 72 72 GLY H H 72 7.209 7.209 8.067 -0.858 18509 2822 1 6 . 1 1 73 73 GLY N N 73 105.207 105.207 107.123 -1.916 18509 2823 1 6 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.252 -2.031 18509 2824 1 6 . 1 1 73 73 GLY H H 73 8.789 8.789 7.978 0.811 18509 2825 1 6 . 1 1 74 74 PRO C C 74 175.753 175.753 176.448 -0.695 18509 2826 1 6 . 1 1 75 75 LYS N N 75 114.868 114.868 117.218 -2.350 18509 2827 1 6 . 1 1 75 75 LYS C C 75 173.640 173.640 175.605 -1.965 18509 2828 1 6 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.938 -5.835 18509 2829 1 6 . 1 1 75 75 LYS H H 75 8.651 8.651 8.253 0.398 18509 2830 1 6 . 1 1 76 76 ASP N N 76 120.414 120.414 116.212 4.202 18509 2831 1 6 . 1 1 76 76 ASP C C 76 172.557 172.557 173.850 -1.293 18509 2832 1 6 . 1 1 76 76 ASP CA C 76 51.309 51.309 53.541 -2.232 18509 2833 1 6 . 1 1 76 76 ASP H H 76 7.461 7.461 7.548 -0.087 18509 2834 1 6 . 1 1 77 77 GLU N N 77 120.820 120.820 120.842 -0.022 18509 2835 1 6 . 1 1 77 77 GLU C C 77 174.101 174.101 174.720 -0.619 18509 2836 1 6 . 1 1 77 77 GLU CA C 77 55.513 55.513 54.780 0.733 18509 2837 1 6 . 1 1 77 77 GLU H H 77 8.315 8.315 8.582 -0.267 18509 2838 1 6 . 1 1 78 78 GLU N N 78 119.251 119.251 123.864 -4.613 18509 2839 1 6 . 1 1 78 78 GLU C C 78 168.285 168.285 174.615 -6.330 18509 2840 1 6 . 1 1 78 78 GLU CA C 78 52.078 52.078 56.949 -4.871 18509 2841 1 6 . 1 1 78 78 GLU H H 78 8.109 8.109 8.455 -0.346 18509 2842 1 6 . 1 1 79 79 ARG N N 79 118.991 118.991 122.152 -3.161 18509 2843 1 6 . 1 1 79 79 ARG C C 79 172.123 172.123 175.330 -3.207 18509 2844 1 6 . 1 1 79 79 ARG CA C 79 51.074 51.074 57.065 -5.991 18509 2845 1 6 . 1 1 79 79 ARG H H 79 6.999 6.999 8.552 -1.553 18509 2846 1 6 . 1 1 80 80 HIS N N 80 118.000 118.000 115.538 2.462 18509 2847 1 6 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.504 -6.551 18509 2848 1 6 . 1 1 80 80 HIS H H 80 8.355 8.355 8.806 -0.451 18509 2849 1 6 . 1 1 81 81 VAL C C 81 173.460 173.460 173.884 -0.424 18509 2850 1 6 . 1 1 82 82 GLY N N 82 97.322 97.322 108.537 -11.215 18509 2851 1 6 . 1 1 82 82 GLY C C 82 170.370 170.370 173.118 -2.748 18509 2852 1 6 . 1 1 82 82 GLY CA C 82 42.688 42.688 44.066 -1.378 18509 2853 1 6 . 1 1 82 82 GLY H H 82 8.487 8.487 8.978 -0.491 18509 2854 1 6 . 1 1 83 83 ASP N N 83 120.890 120.890 120.909 -0.019 18509 2855 1 6 . 1 1 83 83 ASP C C 83 168.737 168.737 175.430 -6.693 18509 2856 1 6 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.836 -0.918 18509 2857 1 6 . 1 1 83 83 ASP H H 83 7.127 7.127 8.369 -1.242 18509 2858 1 6 . 1 1 84 84 LEU N N 84 120.154 120.154 122.057 -1.903 18509 2859 1 6 . 1 1 84 84 LEU C C 84 173.212 173.212 175.275 -2.063 18509 2860 1 6 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.396 -3.963 18509 2861 1 6 . 1 1 84 84 LEU H H 84 7.128 7.128 8.500 -1.372 18509 2862 1 6 . 1 1 85 85 GLY N N 85 106.867 106.867 110.154 -3.287 18509 2863 1 6 . 1 1 85 85 GLY C C 85 167.654 167.654 172.126 -4.472 18509 2864 1 6 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.668 -1.657 18509 2865 1 6 . 1 1 85 85 GLY H H 85 8.260 8.260 7.368 0.892 18509 2866 1 6 . 1 1 86 86 ASN N N 86 117.454 117.454 120.741 -3.287 18509 2867 1 6 . 1 1 86 86 ASN C C 86 173.942 173.942 174.172 -0.230 18509 2868 1 6 . 1 1 86 86 ASN CA C 86 49.266 49.266 53.122 -3.856 18509 2869 1 6 . 1 1 86 86 ASN H H 86 8.041 8.041 8.333 -0.292 18509 2870 1 6 . 1 1 87 87 VAL N N 87 113.370 113.370 125.039 -11.669 18509 2871 1 6 . 1 1 87 87 VAL C C 87 171.526 171.526 174.742 -3.216 18509 2872 1 6 . 1 1 87 87 VAL CA C 87 55.708 55.708 61.549 -5.841 18509 2873 1 6 . 1 1 87 87 VAL H H 87 8.960 8.960 8.482 0.478 18509 2874 1 6 . 1 1 88 88 THR N N 88 117.939 117.939 117.119 0.820 18509 2875 1 6 . 1 1 88 88 THR C C 88 170.367 170.367 173.184 -2.817 18509 2876 1 6 . 1 1 88 88 THR CA C 88 58.694 58.694 60.745 -2.051 18509 2877 1 6 . 1 1 88 88 THR H H 88 8.681 8.681 8.019 0.662 18509 2878 1 6 . 1 1 89 89 ALA N N 89 128.674 128.674 129.788 -1.114 18509 2879 1 6 . 1 1 89 89 ALA C C 89 174.480 174.480 175.999 -1.519 18509 2880 1 6 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.296 -3.927 18509 2881 1 6 . 1 1 89 89 ALA H H 89 9.377 9.377 8.764 0.613 18509 2882 1 6 . 1 1 90 90 ASP N N 90 124.235 124.235 123.784 0.451 18509 2883 1 6 . 1 1 90 90 ASP C C 90 173.825 173.825 176.521 -2.696 18509 2884 1 6 . 1 1 90 90 ASP CA C 90 49.347 49.347 54.685 -5.338 18509 2885 1 6 . 1 1 90 90 ASP H H 90 8.455 8.455 8.745 -0.290 18509 2886 1 6 . 1 1 91 91 LYS N N 91 114.942 114.942 120.511 -5.569 18509 2887 1 6 . 1 1 91 91 LYS C C 91 174.101 174.101 176.339 -2.238 18509 2888 1 6 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.563 -3.284 18509 2889 1 6 . 1 1 91 91 LYS H H 91 8.231 8.231 8.423 -0.192 18509 2890 1 6 . 1 1 92 92 ASP N N 92 119.251 119.251 115.403 3.848 18509 2891 1 6 . 1 1 92 92 ASP C C 92 173.020 173.020 175.319 -2.299 18509 2892 1 6 . 1 1 92 92 ASP CA C 92 51.127 51.127 54.099 -2.972 18509 2893 1 6 . 1 1 92 92 ASP H H 92 8.109 8.109 8.250 -0.141 18509 2894 1 6 . 1 1 93 93 GLY N N 93 110.868 110.868 107.800 3.068 18509 2895 1 6 . 1 1 93 93 GLY C C 93 169.706 169.706 173.299 -3.593 18509 2896 1 6 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.262 -1.499 18509 2897 1 6 . 1 1 93 93 GLY H H 93 8.405 8.405 8.139 0.266 18509 2898 1 6 . 1 1 94 94 VAL N N 94 118.755 118.755 114.406 4.349 18509 2899 1 6 . 1 1 94 94 VAL C C 94 173.510 173.510 173.884 -0.374 18509 2900 1 6 . 1 1 94 94 VAL CA C 94 58.185 58.185 59.786 -1.601 18509 2901 1 6 . 1 1 94 94 VAL H H 94 7.814 7.814 7.656 0.158 18509 2902 1 6 . 1 1 95 95 ALA N N 95 131.313 131.313 129.293 2.020 18509 2903 1 6 . 1 1 95 95 ALA C C 95 171.635 171.635 176.572 -4.937 18509 2904 1 6 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.124 -3.210 18509 2905 1 6 . 1 1 95 95 ALA H H 95 9.763 9.763 8.273 1.490 18509 2906 1 6 . 1 1 96 96 ASP N N 96 125.170 125.170 123.714 1.456 18509 2907 1 6 . 1 1 96 96 ASP C C 96 172.336 172.336 175.526 -3.190 18509 2908 1 6 . 1 1 96 96 ASP H H 96 8.515 8.515 8.100 0.415 18509 2909 1 6 . 1 1 97 97 VAL N N 97 125.879 125.879 126.012 -0.133 18509 2910 1 6 . 1 1 97 97 VAL C C 97 173.488 173.488 175.862 -2.374 18509 2911 1 6 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.335 -3.092 18509 2912 1 6 . 1 1 97 97 VAL H H 97 8.703 8.703 8.061 0.642 18509 2913 1 6 . 1 1 98 98 SER N N 98 123.017 123.017 124.939 -1.922 18509 2914 1 6 . 1 1 98 98 SER C C 98 169.715 169.715 173.655 -3.940 18509 2915 1 6 . 1 1 98 98 SER CA C 98 55.068 55.068 58.697 -3.630 18509 2916 1 6 . 1 1 98 98 SER H H 98 8.784 8.784 8.262 0.522 18509 2917 1 6 . 1 1 99 99 ILE N N 99 125.807 125.807 126.944 -1.137 18509 2918 1 6 . 1 1 99 99 ILE C C 99 171.321 171.321 175.619 -4.298 18509 2919 1 6 . 1 1 99 99 ILE CA C 99 57.155 57.155 61.519 -4.364 18509 2920 1 6 . 1 1 99 99 ILE H H 99 9.411 9.411 8.298 1.113 18509 2921 1 6 . 1 1 100 100 GLU N N 100 124.068 124.068 126.900 -2.832 18509 2922 1 6 . 1 1 100 100 GLU C C 100 172.098 172.098 174.574 -2.476 18509 2923 1 6 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.458 -2.168 18509 2924 1 6 . 1 1 100 100 GLU H H 100 8.652 8.652 8.538 0.114 18509 2925 1 6 . 1 1 101 101 ASP N N 101 126.109 126.109 120.341 5.768 18509 2926 1 6 . 1 1 101 101 ASP C C 101 171.144 171.144 176.183 -5.039 18509 2927 1 6 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.684 -2.265 18509 2928 1 6 . 1 1 101 101 ASP H H 101 9.317 9.317 8.409 0.908 18509 2929 1 6 . 1 1 102 102 SER N N 102 118.470 118.470 117.459 1.011 18509 2930 1 6 . 1 1 102 102 SER C C 102 171.596 171.596 174.462 -2.866 18509 2931 1 6 . 1 1 102 102 SER CA C 102 55.245 55.245 57.362 -2.117 18509 2932 1 6 . 1 1 102 102 SER H H 102 8.933 8.933 8.326 0.607 18509 2933 1 6 . 1 1 103 103 VAL N N 103 123.179 123.179 118.983 4.196 18509 2934 1 6 . 1 1 103 103 VAL CA C 103 61.450 61.450 64.991 -3.541 18509 2935 1 6 . 1 1 103 103 VAL H H 103 8.148 8.148 9.209 -1.061 18509 2936 1 6 . 1 1 104 104 ILE C C 104 169.576 169.576 174.728 -5.152 18509 2937 1 6 . 1 1 104 104 ILE CA C 104 60.194 60.194 61.232 -1.038 18509 2938 1 6 . 1 1 105 105 SER N N 105 107.618 107.618 113.944 -6.326 18509 2939 1 6 . 1 1 105 105 SER C C 105 170.046 170.046 173.201 -3.155 18509 2940 1 6 . 1 1 105 105 SER CA C 105 52.550 52.550 57.513 -4.963 18509 2941 1 6 . 1 1 105 105 SER H H 105 6.988 6.988 8.776 -1.788 18509 2942 1 6 . 1 1 106 106 LEU N N 106 120.137 120.137 117.065 3.072 18509 2943 1 6 . 1 1 106 106 LEU H H 106 8.313 8.313 7.994 0.319 18509 2944 1 6 . 1 1 107 107 SER C C 107 170.701 170.701 174.114 -3.413 18509 2945 1 6 . 1 1 107 107 SER CA C 107 54.540 54.540 58.997 -4.457 18509 2946 1 6 . 1 1 108 108 GLY N N 108 107.603 107.603 110.986 -3.383 18509 2947 1 6 . 1 1 108 108 GLY C C 108 173.128 173.128 172.751 0.377 18509 2948 1 6 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.569 -3.282 18509 2949 1 6 . 1 1 108 108 GLY H H 108 8.717 8.717 7.799 0.918 18509 2950 1 6 . 1 1 109 109 ASP N N 109 120.664 120.664 123.466 -2.802 18509 2951 1 6 . 1 1 109 109 ASP C C 109 171.904 171.904 176.867 -4.963 18509 2952 1 6 . 1 1 109 109 ASP H H 109 9.019 9.019 9.570 -0.551 18509 2953 1 6 . 1 1 110 110 HIS N N 110 116.324 116.324 119.122 -2.798 18509 2954 1 6 . 1 1 110 110 HIS H H 110 9.283 9.283 9.061 0.222 18509 2955 1 6 . 1 1 111 111 SER N N 111 110.225 110.225 107.855 2.370 18509 2956 1 6 . 1 1 111 111 SER CA C 111 54.681 54.681 57.706 -3.025 18509 2957 1 6 . 1 1 111 111 SER H H 111 7.156 7.156 7.571 -0.415 18509 2958 1 6 . 1 1 112 112 ILE N N 112 117.053 117.053 121.183 -4.130 18509 2959 1 6 . 1 1 112 112 ILE C C 112 171.419 171.419 174.947 -3.528 18509 2960 1 6 . 1 1 112 112 ILE CA C 112 57.239 57.239 60.208 -2.969 18509 2961 1 6 . 1 1 112 112 ILE H H 112 7.837 7.837 8.622 -0.785 18509 2962 1 6 . 1 1 113 113 ILE N N 113 121.032 121.032 121.335 -0.303 18509 2963 1 6 . 1 1 113 113 ILE C C 113 173.604 173.604 175.737 -2.133 18509 2964 1 6 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.691 -2.373 18509 2965 1 6 . 1 1 113 113 ILE H H 113 7.592 7.592 7.534 0.058 18509 2966 1 6 . 1 1 114 114 GLY N N 114 112.661 112.661 112.017 0.644 18509 2967 1 6 . 1 1 114 114 GLY C C 114 169.739 169.739 173.060 -3.321 18509 2968 1 6 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.595 -3.685 18509 2969 1 6 . 1 1 114 114 GLY H H 114 9.575 9.575 8.695 0.880 18509 2970 1 6 . 1 1 115 115 ARG N N 115 118.398 118.398 116.871 1.527 18509 2971 1 6 . 1 1 115 115 ARG C C 115 171.079 171.079 175.200 -4.121 18509 2972 1 6 . 1 1 115 115 ARG CA C 115 51.663 51.663 53.437 -1.774 18509 2973 1 6 . 1 1 115 115 ARG H H 115 7.464 7.464 7.448 0.016 18509 2974 1 6 . 1 1 116 116 THR N N 116 112.218 112.218 114.129 -1.911 18509 2975 1 6 . 1 1 116 116 THR C C 116 169.821 169.821 174.835 -5.014 18509 2976 1 6 . 1 1 116 116 THR CA C 116 59.633 59.633 59.697 -0.064 18509 2977 1 6 . 1 1 116 116 THR H H 116 6.677 6.677 8.937 -2.260 18509 2978 1 6 . 1 1 117 117 LEU N N 117 129.477 129.477 122.722 6.755 18509 2979 1 6 . 1 1 117 117 LEU C C 117 171.126 171.126 174.603 -3.477 18509 2980 1 6 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.133 -3.718 18509 2981 1 6 . 1 1 117 117 LEU H H 117 8.799 8.799 9.032 -0.233 18509 2982 1 6 . 1 1 118 118 VAL N N 118 125.091 125.091 127.384 -2.293 18509 2983 1 6 . 1 1 118 118 VAL C C 118 170.267 170.267 175.469 -5.202 18509 2984 1 6 . 1 1 118 118 VAL CA C 118 58.139 58.139 62.389 -4.250 18509 2985 1 6 . 1 1 118 118 VAL H H 118 8.906 8.906 7.861 1.045 18509 2986 1 6 . 1 1 119 119 VAL N N 119 120.716 120.716 126.295 -5.579 18509 2987 1 6 . 1 1 119 119 VAL C C 119 171.175 171.175 173.540 -2.365 18509 2988 1 6 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.678 -4.407 18509 2989 1 6 . 1 1 119 119 VAL H H 119 7.982 7.982 7.609 0.373 18509 2990 1 6 . 1 1 120 120 HIS N N 120 125.052 125.052 118.228 6.824 18509 2991 1 6 . 1 1 120 120 HIS C C 120 172.599 172.599 173.923 -1.324 18509 2992 1 6 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.072 -1.678 18509 2993 1 6 . 1 1 120 120 HIS H H 120 8.935 8.935 8.349 0.586 18509 2994 1 6 . 1 1 121 121 GLU N N 121 121.453 121.453 121.652 -0.199 18509 2995 1 6 . 1 1 121 121 GLU C C 121 172.304 172.304 175.434 -3.130 18509 2996 1 6 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.131 -0.041 18509 2997 1 6 . 1 1 121 121 GLU H H 121 9.178 9.178 8.816 0.362 18509 2998 1 6 . 1 1 122 122 LYS N N 122 115.248 115.248 121.398 -6.150 18509 2999 1 6 . 1 1 122 122 LYS C C 122 171.523 171.523 174.704 -3.181 18509 3000 1 6 . 1 1 122 122 LYS CA C 122 50.619 50.619 54.826 -4.207 18509 3001 1 6 . 1 1 122 122 LYS H H 122 8.478 8.478 7.903 0.575 18509 3002 1 6 . 1 1 123 123 ALA N N 123 120.866 120.866 123.710 -2.844 18509 3003 1 6 . 1 1 123 123 ALA C C 123 173.219 173.219 176.929 -3.710 18509 3004 1 6 . 1 1 123 123 ALA CA C 123 48.850 48.850 50.908 -2.058 18509 3005 1 6 . 1 1 123 123 ALA H H 123 7.796 7.796 8.384 -0.588 18509 3006 1 6 . 1 1 124 124 ASP N N 124 121.799 121.799 125.813 -4.014 18509 3007 1 6 . 1 1 124 124 ASP C C 124 174.458 174.458 176.565 -2.107 18509 3008 1 6 . 1 1 124 124 ASP CA C 124 49.408 49.408 54.937 -5.529 18509 3009 1 6 . 1 1 124 124 ASP H H 124 10.165 10.165 8.395 1.770 18509 3010 1 6 . 1 1 125 125 ASP N N 125 129.369 129.369 127.785 1.584 18509 3011 1 6 . 1 1 125 125 ASP C C 125 175.231 175.231 176.621 -1.390 18509 3012 1 6 . 1 1 125 125 ASP CA C 125 50.939 50.939 54.391 -3.452 18509 3013 1 6 . 1 1 125 125 ASP H H 125 10.055 10.055 8.167 1.888 18509 3014 1 6 . 1 1 126 126 LEU N N 126 117.190 117.190 124.552 -7.362 18509 3015 1 6 . 1 1 126 126 LEU C C 126 173.964 173.964 178.575 -4.611 18509 3016 1 6 . 1 1 126 126 LEU H H 126 10.483 10.483 8.345 2.138 18509 3017 1 6 . 1 1 127 127 GLY N N 127 103.809 103.809 102.553 1.256 18509 3018 1 6 . 1 1 127 127 GLY CA C 127 42.878 42.878 45.126 -2.248 18509 3019 1 6 . 1 1 127 127 GLY H H 127 8.637 8.637 7.987 0.650 18509 3020 1 6 . 1 1 128 128 LYS N N 128 118.290 118.290 119.814 -1.524 18509 3021 1 6 . 1 1 128 128 LYS CA C 128 51.740 51.740 56.881 -5.141 18509 3022 1 6 . 1 1 128 128 LYS H H 128 7.158 7.158 8.266 -1.108 18509 3023 1 6 . 1 1 129 129 GLY N N 129 108.507 108.507 107.516 0.991 18509 3024 1 6 . 1 1 129 129 GLY C C 129 171.524 171.524 174.900 -3.376 18509 3025 1 6 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.507 -4.394 18509 3026 1 6 . 1 1 129 129 GLY H H 129 8.913 8.913 9.116 -0.203 18509 3027 1 6 . 1 1 130 130 GLY N N 130 108.537 108.537 109.284 -0.747 18509 3028 1 6 . 1 1 130 130 GLY C C 130 169.994 169.994 173.043 -3.049 18509 3029 1 6 . 1 1 130 130 GLY CA C 130 42.419 42.419 45.143 -2.724 18509 3030 1 6 . 1 1 130 130 GLY H H 130 8.723 8.723 8.474 0.249 18509 3031 1 6 . 1 1 131 131 ASN N N 131 111.951 111.951 117.513 -5.562 18509 3032 1 6 . 1 1 131 131 ASN C C 131 172.236 172.236 174.106 -1.870 18509 3033 1 6 . 1 1 131 131 ASN H H 131 7.152 7.152 7.771 -0.619 18509 3034 1 6 . 1 1 132 132 GLU N N 132 120.461 120.461 119.953 0.508 18509 3035 1 6 . 1 1 132 132 GLU C C 132 171.084 171.084 178.043 -6.959 18509 3036 1 6 . 1 1 132 132 GLU H H 132 8.935 8.935 8.846 0.089 18509 3037 1 6 . 1 1 133 133 GLU N N 133 120.137 120.137 119.666 0.471 18509 3038 1 6 . 1 1 133 133 GLU C C 133 176.239 176.239 178.518 -2.279 18509 3039 1 6 . 1 1 133 133 GLU H H 133 8.775 8.775 8.610 0.165 18509 3040 1 6 . 1 1 134 134 SER N N 134 114.981 114.981 113.676 1.305 18509 3041 1 6 . 1 1 134 134 SER CA C 134 59.046 59.046 61.720 -2.674 18509 3042 1 6 . 1 1 134 134 SER H H 134 8.117 8.117 8.149 -0.032 18509 3043 1 6 . 1 1 135 135 THR N N 135 102.263 102.263 114.547 -12.284 18509 3044 1 6 . 1 1 135 135 THR C C 135 172.804 172.804 175.056 -2.252 18509 3045 1 6 . 1 1 135 135 THR CA C 135 60.029 60.029 63.558 -3.529 18509 3046 1 6 . 1 1 135 135 THR H H 135 7.206 7.206 7.948 -0.742 18509 3047 1 6 . 1 1 136 136 LYS N N 136 122.108 122.108 119.390 2.718 18509 3048 1 6 . 1 1 136 136 LYS H H 136 7.884 7.884 7.419 0.465 18509 3049 1 6 . 1 1 137 137 THR N N 137 105.718 105.718 114.492 -8.774 18509 3050 1 6 . 1 1 137 137 THR H H 137 8.630 8.630 7.960 0.670 18509 3051 1 6 . 1 1 138 138 GLY N N 138 111.372 111.372 110.665 0.707 18509 3052 1 6 . 1 1 138 138 GLY CA C 138 42.483 42.483 44.979 -2.496 18509 3053 1 6 . 1 1 138 138 GLY H H 138 7.426 7.426 7.861 -0.435 18509 3054 1 6 . 1 1 139 139 ASN N N 139 107.496 107.496 118.838 -11.342 18509 3055 1 6 . 1 1 139 139 ASN H H 139 7.545 7.545 7.940 -0.395 18509 3056 1 6 . 1 1 140 140 ALA N N 140 114.542 114.542 126.510 -11.968 18509 3057 1 6 . 1 1 140 140 ALA C C 140 173.571 173.571 175.943 -2.372 18509 3058 1 6 . 1 1 140 140 ALA H H 140 6.368 6.368 7.855 -1.487 18509 3059 1 6 . 1 1 141 141 GLY N N 141 105.287 105.287 106.865 -1.578 18509 3060 1 6 . 1 1 141 141 GLY C C 141 173.542 173.542 175.983 -2.441 18509 3061 1 6 . 1 1 141 141 GLY H H 141 8.271 8.271 8.900 -0.629 18509 3062 1 6 . 1 1 142 142 SER N N 142 118.771 118.771 121.231 -2.460 18509 3063 1 6 . 1 1 142 142 SER C C 142 170.188 170.188 175.534 -5.346 18509 3064 1 6 . 1 1 142 142 SER H H 142 9.196 9.196 8.551 0.645 18509 3065 1 6 . 1 1 143 143 ARG N N 143 120.189 120.189 115.262 4.927 18509 3066 1 6 . 1 1 143 143 ARG C C 143 171.596 171.596 178.077 -6.481 18509 3067 1 6 . 1 1 143 143 ARG H H 143 8.943 8.943 7.843 1.100 18509 3068 1 6 . 1 1 144 144 LEU N N 144 122.907 122.907 121.740 1.167 18509 3069 1 6 . 1 1 144 144 LEU C C 144 174.393 174.393 175.404 -1.011 18509 3070 1 6 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.947 -3.572 18509 3071 1 6 . 1 1 144 144 LEU H H 144 8.395 8.395 8.098 0.297 18509 3072 1 6 . 1 1 145 145 ALA N N 145 114.159 114.159 116.583 -2.424 18509 3073 1 6 . 1 1 145 145 ALA C C 145 171.752 171.752 174.731 -2.979 18509 3074 1 6 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.104 -2.975 18509 3075 1 6 . 1 1 145 145 ALA H H 145 7.356 7.356 7.226 0.130 18509 3076 1 6 . 1 1 146 146 CYS N N 146 110.738 110.738 121.020 -10.282 18509 3077 1 6 . 1 1 146 146 CYS C C 146 170.087 170.087 173.318 -3.231 18509 3078 1 6 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.772 -6.695 18509 3079 1 6 . 1 1 146 146 CYS H H 146 9.008 9.008 7.938 1.070 18509 3080 1 6 . 1 1 147 147 GLY N N 147 106.461 106.461 111.913 -5.452 18509 3081 1 6 . 1 1 147 147 GLY C C 147 167.909 167.909 172.040 -4.131 18509 3082 1 6 . 1 1 147 147 GLY CA C 147 42.674 42.674 44.218 -1.544 18509 3083 1 6 . 1 1 147 147 GLY H H 147 8.018 8.018 7.757 0.261 18509 3084 1 6 . 1 1 148 148 VAL N N 148 124.054 124.054 118.417 5.637 18509 3085 1 6 . 1 1 148 148 VAL C C 148 172.084 172.084 174.853 -2.769 18509 3086 1 6 . 1 1 148 148 VAL CA C 148 59.635 59.635 61.884 -2.249 18509 3087 1 6 . 1 1 148 148 VAL H H 148 8.434 8.434 8.321 0.113 18509 3088 1 6 . 1 1 149 149 ILE N N 149 126.918 126.918 128.477 -1.559 18509 3089 1 6 . 1 1 149 149 ILE C C 149 171.804 171.804 174.552 -2.748 18509 3090 1 6 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.166 0.018 18509 3091 1 6 . 1 1 149 149 ILE H H 149 8.613 8.613 8.332 0.281 18509 3092 1 6 . 1 1 150 150 GLY N N 150 116.493 116.493 115.286 1.207 18509 3093 1 6 . 1 1 150 150 GLY C C 150 170.188 170.188 172.355 -2.167 18509 3094 1 6 . 1 1 150 150 GLY CA C 150 40.120 40.120 45.083 -4.963 18509 3095 1 6 . 1 1 150 150 GLY H H 150 9.283 9.283 7.930 1.353 18509 3096 1 6 . 1 1 151 151 ILE N N 151 120.189 120.189 122.789 -2.600 18509 3097 1 6 . 1 1 151 151 ILE C C 151 172.231 172.231 174.669 -2.438 18509 3098 1 6 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.474 -1.102 18509 3099 1 6 . 1 1 151 151 ILE H H 151 8.943 8.943 8.009 0.934 18509 3100 1 6 . 1 1 152 152 ALA N N 152 129.719 129.719 131.574 -1.855 18509 3101 1 6 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.109 -4.337 18509 3102 1 6 . 1 1 152 152 ALA H H 152 8.170 8.170 7.982 0.188 18509 3103 1 7 . 1 1 2 2 THR C C 2 170.139 170.139 174.350 -4.211 18509 3104 1 7 . 1 1 3 3 LYS N N 3 123.998 123.998 117.427 6.571 18509 3105 1 7 . 1 1 3 3 LYS C C 3 171.607 171.607 174.081 -2.474 18509 3106 1 7 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.527 -3.349 18509 3107 1 7 . 1 1 3 3 LYS H H 3 8.666 8.666 7.490 1.176 18509 3108 1 7 . 1 1 4 4 ALA N N 4 123.295 123.295 123.040 0.255 18509 3109 1 7 . 1 1 4 4 ALA C C 4 172.145 172.145 175.258 -3.113 18509 3110 1 7 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.513 -3.009 18509 3111 1 7 . 1 1 4 4 ALA H H 4 9.116 9.116 8.220 0.896 18509 3112 1 7 . 1 1 5 5 VAL N N 5 121.466 121.466 119.748 1.718 18509 3113 1 7 . 1 1 5 5 VAL C C 5 167.836 167.836 174.138 -6.302 18509 3114 1 7 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.123 -4.248 18509 3115 1 7 . 1 1 5 5 VAL H H 5 9.545 9.545 8.769 0.776 18509 3116 1 7 . 1 1 6 6 ALA N N 6 125.984 125.984 129.218 -3.234 18509 3117 1 7 . 1 1 6 6 ALA C C 6 171.607 171.607 176.247 -4.640 18509 3118 1 7 . 1 1 6 6 ALA CA C 6 47.471 47.471 49.925 -2.454 18509 3119 1 7 . 1 1 6 6 ALA H H 6 9.177 9.177 8.469 0.708 18509 3120 1 7 . 1 1 7 7 VAL N N 7 123.600 123.600 120.662 2.938 18509 3121 1 7 . 1 1 7 7 VAL C C 7 172.244 172.244 174.033 -1.789 18509 3122 1 7 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.850 -2.374 18509 3123 1 7 . 1 1 7 7 VAL H H 7 9.116 9.116 8.333 0.783 18509 3124 1 7 . 1 1 8 8 LEU N N 8 126.455 126.455 129.111 -2.656 18509 3125 1 7 . 1 1 8 8 LEU C C 8 172.557 172.557 176.502 -3.945 18509 3126 1 7 . 1 1 8 8 LEU CA C 8 51.052 51.052 54.382 -3.330 18509 3127 1 7 . 1 1 8 8 LEU H H 8 8.916 8.916 8.517 0.399 18509 3128 1 7 . 1 1 9 9 LYS N N 9 120.820 120.820 124.807 -3.987 18509 3129 1 7 . 1 1 9 9 LYS C C 9 172.509 172.509 174.748 -2.239 18509 3130 1 7 . 1 1 9 9 LYS CA C 9 51.897 51.897 56.086 -4.189 18509 3131 1 7 . 1 1 9 9 LYS H H 9 8.315 8.315 8.013 0.302 18509 3132 1 7 . 1 1 10 10 GLY N N 10 111.249 111.249 111.838 -0.589 18509 3133 1 7 . 1 1 10 10 GLY C C 10 169.847 169.847 172.549 -2.702 18509 3134 1 7 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.309 -3.034 18509 3135 1 7 . 1 1 10 10 GLY H H 10 8.968 8.968 8.459 0.509 18509 3136 1 7 . 1 1 11 11 ASP N N 11 120.904 120.904 120.564 0.340 18509 3137 1 7 . 1 1 11 11 ASP C C 11 173.132 173.132 176.080 -2.948 18509 3138 1 7 . 1 1 11 11 ASP CA C 11 51.317 51.317 54.141 -2.824 18509 3139 1 7 . 1 1 11 11 ASP H H 11 8.745 8.745 8.050 0.695 18509 3140 1 7 . 1 1 12 12 GLY N N 12 109.862 109.862 113.534 -3.672 18509 3141 1 7 . 1 1 12 12 GLY CA C 12 41.200 41.200 45.146 -3.946 18509 3142 1 7 . 1 1 12 12 GLY H H 12 7.985 7.985 7.772 0.213 18509 3143 1 7 . 1 1 13 13 PRO C C 13 173.640 173.640 177.412 -3.772 18509 3144 1 7 . 1 1 14 14 VAL N N 14 120.414 120.414 115.223 5.191 18509 3145 1 7 . 1 1 14 14 VAL C C 14 172.804 172.804 175.128 -2.324 18509 3146 1 7 . 1 1 14 14 VAL CA C 14 59.884 59.884 61.924 -2.040 18509 3147 1 7 . 1 1 14 14 VAL H H 14 7.476 7.476 8.236 -0.760 18509 3148 1 7 . 1 1 15 15 GLN N N 15 122.664 122.664 122.466 0.198 18509 3149 1 7 . 1 1 15 15 GLN C C 15 171.168 171.168 174.778 -3.610 18509 3150 1 7 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.139 -3.460 18509 3151 1 7 . 1 1 15 15 GLN H H 15 7.938 7.938 8.744 -0.806 18509 3152 1 7 . 1 1 16 16 GLY N N 16 107.018 107.018 110.427 -3.409 18509 3153 1 7 . 1 1 16 16 GLY C C 16 167.726 167.726 172.118 -4.392 18509 3154 1 7 . 1 1 16 16 GLY CA C 16 43.625 43.625 44.528 -0.903 18509 3155 1 7 . 1 1 16 16 GLY H H 16 8.288 8.288 8.310 -0.022 18509 3156 1 7 . 1 1 17 17 ILE N N 17 120.248 120.248 114.577 5.671 18509 3157 1 7 . 1 1 17 17 ILE C C 17 171.194 171.194 173.459 -2.265 18509 3158 1 7 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.815 -1.318 18509 3159 1 7 . 1 1 17 17 ILE H H 17 7.948 7.948 7.705 0.243 18509 3160 1 7 . 1 1 18 18 ILE N N 18 125.851 125.851 124.226 1.625 18509 3161 1 7 . 1 1 18 18 ILE C C 18 168.889 168.889 174.864 -5.975 18509 3162 1 7 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.014 -5.583 18509 3163 1 7 . 1 1 18 18 ILE H H 18 8.725 8.725 8.152 0.573 18509 3164 1 7 . 1 1 19 19 ASN N N 19 123.256 123.256 125.641 -2.385 18509 3165 1 7 . 1 1 19 19 ASN C C 19 168.903 168.903 173.863 -4.960 18509 3166 1 7 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.377 -2.288 18509 3167 1 7 . 1 1 19 19 ASN H H 19 8.727 8.727 7.764 0.963 18509 3168 1 7 . 1 1 20 20 PHE N N 20 113.849 113.849 119.253 -5.404 18509 3169 1 7 . 1 1 20 20 PHE C C 20 173.219 173.219 174.567 -1.348 18509 3170 1 7 . 1 1 20 20 PHE CA C 20 52.058 52.058 55.243 -3.185 18509 3171 1 7 . 1 1 20 20 PHE H H 20 8.399 8.399 8.220 0.179 18509 3172 1 7 . 1 1 21 21 GLU N N 21 121.454 121.454 119.438 2.016 18509 3173 1 7 . 1 1 21 21 GLU C C 21 170.280 170.280 176.813 -6.533 18509 3174 1 7 . 1 1 21 21 GLU CA C 21 53.044 53.044 53.895 -0.852 18509 3175 1 7 . 1 1 21 21 GLU H H 21 9.526 9.526 8.534 0.992 18509 3176 1 7 . 1 1 22 22 GLN N N 22 130.340 130.340 123.192 7.148 18509 3177 1 7 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.626 -3.446 18509 3178 1 7 . 1 1 22 22 GLN H H 22 9.305 9.305 8.527 0.778 18509 3179 1 7 . 1 1 23 23 LYS N N 23 128.657 128.657 126.906 1.751 18509 3180 1 7 . 1 1 23 23 LYS CA C 23 57.241 57.241 56.438 0.803 18509 3181 1 7 . 1 1 23 23 LYS H H 23 9.088 9.088 8.029 1.059 18509 3182 1 7 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.901 -7.509 18509 3183 1 7 . 1 1 25 25 SER CA C 25 58.078 58.078 58.945 -0.867 18509 3184 1 7 . 1 1 27 27 GLY N N 27 108.125 108.125 107.137 0.988 18509 3185 1 7 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.899 -1.974 18509 3186 1 7 . 1 1 27 27 GLY H H 27 8.032 8.032 8.204 -0.172 18509 3187 1 7 . 1 1 28 28 PRO C C 28 173.128 173.128 176.440 -3.312 18509 3188 1 7 . 1 1 29 29 VAL N N 29 121.267 121.267 119.647 1.620 18509 3189 1 7 . 1 1 29 29 VAL C C 29 172.198 172.198 176.074 -3.876 18509 3190 1 7 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.664 -3.944 18509 3191 1 7 . 1 1 29 29 VAL H H 29 9.089 9.089 8.400 0.689 18509 3192 1 7 . 1 1 30 30 LYS N N 30 127.589 127.589 128.965 -1.376 18509 3193 1 7 . 1 1 30 30 LYS C C 30 172.098 172.098 175.274 -3.176 18509 3194 1 7 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.806 -3.164 18509 3195 1 7 . 1 1 30 30 LYS H H 30 9.200 9.200 9.439 -0.239 18509 3196 1 7 . 1 1 31 31 VAL N N 31 126.037 126.037 123.241 2.796 18509 3197 1 7 . 1 1 31 31 VAL C C 31 172.244 172.244 174.890 -2.646 18509 3198 1 7 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.936 -2.797 18509 3199 1 7 . 1 1 31 31 VAL H H 31 9.282 9.282 7.898 1.384 18509 3200 1 7 . 1 1 32 32 TRP N N 32 125.414 125.414 123.196 2.218 18509 3201 1 7 . 1 1 32 32 TRP C C 32 170.156 170.156 173.858 -3.702 18509 3202 1 7 . 1 1 32 32 TRP CA C 32 53.137 53.137 55.631 -2.494 18509 3203 1 7 . 1 1 32 32 TRP H H 32 8.983 8.983 7.945 1.038 18509 3204 1 7 . 1 1 33 33 GLY N N 33 107.848 107.848 109.507 -1.659 18509 3205 1 7 . 1 1 33 33 GLY C C 33 168.400 168.400 172.030 -3.630 18509 3206 1 7 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.476 -2.909 18509 3207 1 7 . 1 1 33 33 GLY H H 33 8.360 8.360 8.471 -0.111 18509 3208 1 7 . 1 1 34 34 SER N N 34 114.377 114.377 116.017 -1.640 18509 3209 1 7 . 1 1 34 34 SER C C 34 169.618 169.618 173.530 -3.912 18509 3210 1 7 . 1 1 34 34 SER CA C 34 53.875 53.875 55.620 -1.745 18509 3211 1 7 . 1 1 34 34 SER H H 34 7.838 7.838 7.921 -0.083 18509 3212 1 7 . 1 1 35 35 ILE N N 35 123.149 123.149 122.981 0.168 18509 3213 1 7 . 1 1 35 35 ILE C C 35 169.713 169.713 174.169 -4.456 18509 3214 1 7 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.346 -2.577 18509 3215 1 7 . 1 1 35 35 ILE H H 35 8.496 8.496 8.114 0.382 18509 3216 1 7 . 1 1 36 36 LYS N N 36 123.803 123.803 124.126 -0.323 18509 3217 1 7 . 1 1 36 36 LYS C C 36 172.260 172.260 175.403 -3.143 18509 3218 1 7 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.057 -2.907 18509 3219 1 7 . 1 1 36 36 LYS H H 36 9.091 9.091 9.304 -0.213 18509 3220 1 7 . 1 1 37 37 GLY N N 37 105.495 105.495 110.518 -5.023 18509 3221 1 7 . 1 1 37 37 GLY C C 37 171.641 171.641 172.319 -0.678 18509 3222 1 7 . 1 1 37 37 GLY CA C 37 42.361 42.361 45.044 -2.683 18509 3223 1 7 . 1 1 37 37 GLY H H 37 8.237 8.237 7.969 0.268 18509 3224 1 7 . 1 1 38 38 LEU N N 38 120.966 120.966 120.110 0.856 18509 3225 1 7 . 1 1 38 38 LEU C C 38 174.112 174.112 176.372 -2.260 18509 3226 1 7 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.904 -4.433 18509 3227 1 7 . 1 1 38 38 LEU H H 38 8.156 8.156 8.322 -0.166 18509 3228 1 7 . 1 1 39 39 THR N N 39 110.363 110.363 116.556 -6.193 18509 3229 1 7 . 1 1 39 39 THR C C 39 173.102 173.102 173.935 -0.833 18509 3230 1 7 . 1 1 39 39 THR CA C 39 58.194 58.194 62.443 -4.249 18509 3231 1 7 . 1 1 39 39 THR H H 39 8.660 8.660 8.299 0.361 18509 3232 1 7 . 1 1 40 40 GLU N N 40 125.818 125.818 126.789 -0.971 18509 3233 1 7 . 1 1 40 40 GLU C C 40 173.134 173.134 173.983 -0.849 18509 3234 1 7 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.785 -2.429 18509 3235 1 7 . 1 1 40 40 GLU H H 40 8.804 8.804 8.059 0.745 18509 3236 1 7 . 1 1 41 41 GLY N N 41 113.875 113.875 111.061 2.814 18509 3237 1 7 . 1 1 41 41 GLY C C 41 170.046 170.046 172.605 -2.559 18509 3238 1 7 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.155 -5.101 18509 3239 1 7 . 1 1 41 41 GLY H H 41 8.763 8.763 8.388 0.375 18509 3240 1 7 . 1 1 42 42 LEU N N 42 120.137 120.137 122.464 -2.327 18509 3241 1 7 . 1 1 42 42 LEU C C 42 174.218 174.218 176.787 -2.569 18509 3242 1 7 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.705 -2.550 18509 3243 1 7 . 1 1 42 42 LEU H H 42 8.313 8.313 8.491 -0.178 18509 3244 1 7 . 1 1 43 43 HIS N N 43 114.385 114.385 116.133 -1.748 18509 3245 1 7 . 1 1 43 43 HIS C C 43 171.504 171.504 173.582 -2.078 18509 3246 1 7 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.167 -4.182 18509 3247 1 7 . 1 1 43 43 HIS H H 43 8.712 8.712 7.417 1.295 18509 3248 1 7 . 1 1 44 44 GLY N N 44 108.872 108.872 106.800 2.072 18509 3249 1 7 . 1 1 44 44 GLY C C 44 168.656 168.656 172.670 -4.014 18509 3250 1 7 . 1 1 44 44 GLY CA C 44 44.195 44.195 44.162 0.033 18509 3251 1 7 . 1 1 44 44 GLY H H 44 8.875 8.875 8.183 0.692 18509 3252 1 7 . 1 1 45 45 PHE N N 45 126.439 126.439 123.358 3.081 18509 3253 1 7 . 1 1 45 45 PHE CA C 45 53.098 53.098 57.985 -4.887 18509 3254 1 7 . 1 1 45 45 PHE H H 45 8.111 8.111 7.448 0.663 18509 3255 1 7 . 1 1 46 46 HIS N N 46 115.353 115.353 120.151 -4.798 18509 3256 1 7 . 1 1 46 46 HIS C C 46 172.415 172.415 173.693 -1.278 18509 3257 1 7 . 1 1 46 46 HIS CA C 46 49.206 49.206 55.164 -5.958 18509 3258 1 7 . 1 1 46 46 HIS H H 46 8.107 8.107 8.408 -0.301 18509 3259 1 7 . 1 1 47 47 VAL N N 47 120.548 120.548 120.675 -0.127 18509 3260 1 7 . 1 1 47 47 VAL C C 47 173.900 173.900 173.977 -0.077 18509 3261 1 7 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.128 -2.336 18509 3262 1 7 . 1 1 47 47 VAL H H 47 9.366 9.366 8.132 1.234 18509 3263 1 7 . 1 1 48 48 HIS N N 48 129.236 129.236 121.265 7.971 18509 3264 1 7 . 1 1 48 48 HIS C C 48 171.084 171.084 173.283 -2.199 18509 3265 1 7 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.973 -2.217 18509 3266 1 7 . 1 1 48 48 HIS H H 48 10.210 10.210 8.685 1.525 18509 3267 1 7 . 1 1 49 49 GLU N N 49 118.119 118.119 124.150 -6.031 18509 3268 1 7 . 1 1 49 49 GLU C C 49 171.635 171.635 174.127 -2.492 18509 3269 1 7 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.888 1.871 18509 3270 1 7 . 1 1 49 49 GLU H H 49 8.492 8.492 8.457 0.035 18509 3271 1 7 . 1 1 50 50 PHE N N 50 110.329 110.329 123.599 -13.270 18509 3272 1 7 . 1 1 50 50 PHE C C 50 175.252 175.252 173.736 1.516 18509 3273 1 7 . 1 1 50 50 PHE CA C 50 52.900 52.900 59.660 -6.760 18509 3274 1 7 . 1 1 50 50 PHE H H 50 8.580 8.580 8.081 0.499 18509 3275 1 7 . 1 1 51 51 GLY N N 51 119.251 119.251 109.200 10.051 18509 3276 1 7 . 1 1 51 51 GLY C C 51 168.248 168.248 172.920 -4.672 18509 3277 1 7 . 1 1 51 51 GLY H H 51 10.208 10.208 7.910 2.298 18509 3278 1 7 . 1 1 52 52 ASP N N 52 114.958 114.958 124.524 -9.566 18509 3279 1 7 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.875 -5.984 18509 3280 1 7 . 1 1 52 52 ASP H H 52 5.834 5.834 9.045 -3.211 18509 3281 1 7 . 1 1 53 53 ASN N N 53 128.224 128.224 114.336 13.888 18509 3282 1 7 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.829 -4.596 18509 3283 1 7 . 1 1 53 53 ASN H H 53 9.360 9.360 7.752 1.608 18509 3284 1 7 . 1 1 54 54 THR C C 54 168.656 168.656 175.556 -6.900 18509 3285 1 7 . 1 1 55 55 ALA N N 55 126.661 126.661 122.443 4.218 18509 3286 1 7 . 1 1 55 55 ALA C C 55 174.185 174.185 176.558 -2.373 18509 3287 1 7 . 1 1 55 55 ALA CA C 55 46.155 46.155 52.416 -6.261 18509 3288 1 7 . 1 1 55 55 ALA H H 55 8.390 8.390 8.342 0.048 18509 3289 1 7 . 1 1 56 56 GLY N N 56 107.903 107.903 106.186 1.717 18509 3290 1 7 . 1 1 56 56 GLY C C 56 171.578 171.578 173.253 -1.675 18509 3291 1 7 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.095 -2.515 18509 3292 1 7 . 1 1 56 56 GLY H H 56 7.282 7.282 7.281 0.001 18509 3293 1 7 . 1 1 57 57 CYS N N 57 117.952 117.952 123.967 -6.015 18509 3294 1 7 . 1 1 57 57 CYS C C 57 175.209 175.209 174.936 0.273 18509 3295 1 7 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.323 -7.235 18509 3296 1 7 . 1 1 57 57 CYS H H 57 8.900 8.900 8.327 0.573 18509 3297 1 7 . 1 1 58 58 THR N N 58 119.852 119.852 119.277 0.575 18509 3298 1 7 . 1 1 58 58 THR CA C 58 58.239 58.239 65.523 -7.284 18509 3299 1 7 . 1 1 58 58 THR H H 58 8.505 8.505 9.047 -0.542 18509 3300 1 7 . 1 1 59 59 SER C C 59 170.763 170.763 174.243 -3.480 18509 3301 1 7 . 1 1 59 59 SER CA C 59 55.609 55.609 61.019 -5.410 18509 3302 1 7 . 1 1 60 60 ALA N N 60 119.753 119.753 119.479 0.274 18509 3303 1 7 . 1 1 60 60 ALA CA C 60 49.940 49.940 51.741 -1.801 18509 3304 1 7 . 1 1 60 60 ALA H H 60 6.898 6.898 7.695 -0.797 18509 3305 1 7 . 1 1 61 61 GLY N N 61 101.351 101.351 107.491 -6.140 18509 3306 1 7 . 1 1 61 61 GLY CA C 61 42.805 42.805 43.833 -1.028 18509 3307 1 7 . 1 1 61 61 GLY H H 61 7.730 7.730 7.288 0.442 18509 3308 1 7 . 1 1 62 62 PRO C C 62 172.276 172.276 175.216 -2.940 18509 3309 1 7 . 1 1 63 63 HIS N N 63 115.023 115.023 119.689 -4.666 18509 3310 1 7 . 1 1 63 63 HIS CA C 63 52.119 52.119 54.972 -2.853 18509 3311 1 7 . 1 1 63 63 HIS H H 63 7.474 7.474 8.285 -0.811 18509 3312 1 7 . 1 1 64 64 PHE C C 64 171.731 171.731 175.269 -3.538 18509 3313 1 7 . 1 1 65 65 ASN N N 65 126.978 126.978 120.555 6.423 18509 3314 1 7 . 1 1 65 65 ASN CA C 65 47.753 47.753 49.614 -1.861 18509 3315 1 7 . 1 1 65 65 ASN H H 65 9.426 9.426 8.519 0.907 18509 3316 1 7 . 1 1 67 67 LEU N N 67 117.937 117.937 114.503 3.434 18509 3317 1 7 . 1 1 67 67 LEU C C 67 172.580 172.580 177.385 -4.805 18509 3318 1 7 . 1 1 67 67 LEU CA C 67 50.911 50.911 55.640 -4.729 18509 3319 1 7 . 1 1 67 67 LEU H H 67 7.720 7.720 8.038 -0.318 18509 3320 1 7 . 1 1 68 68 SER N N 68 110.842 110.842 113.733 -2.891 18509 3321 1 7 . 1 1 68 68 SER CA C 68 55.953 55.953 59.428 -3.475 18509 3322 1 7 . 1 1 68 68 SER H H 68 7.428 7.428 7.882 -0.454 18509 3323 1 7 . 1 1 69 69 ARG N N 69 120.782 120.782 116.961 3.821 18509 3324 1 7 . 1 1 69 69 ARG C C 69 173.381 173.381 176.780 -3.399 18509 3325 1 7 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.092 -4.549 18509 3326 1 7 . 1 1 69 69 ARG H H 69 8.508 8.508 7.267 1.241 18509 3327 1 7 . 1 1 70 70 LYS N N 70 118.055 118.055 119.958 -1.903 18509 3328 1 7 . 1 1 70 70 LYS C C 70 169.994 169.994 175.989 -5.995 18509 3329 1 7 . 1 1 70 70 LYS CA C 70 52.596 52.596 59.580 -6.984 18509 3330 1 7 . 1 1 70 70 LYS H H 70 8.745 8.745 8.070 0.675 18509 3331 1 7 . 1 1 71 71 HIS N N 71 111.871 111.871 118.103 -6.232 18509 3332 1 7 . 1 1 71 71 HIS C C 71 171.534 171.534 173.986 -2.452 18509 3333 1 7 . 1 1 71 71 HIS CA C 71 52.549 52.549 56.711 -4.162 18509 3334 1 7 . 1 1 71 71 HIS H H 71 7.152 7.152 8.627 -1.475 18509 3335 1 7 . 1 1 72 72 GLY N N 72 112.910 112.910 107.961 4.949 18509 3336 1 7 . 1 1 72 72 GLY C C 72 168.634 168.634 173.205 -4.571 18509 3337 1 7 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.959 -3.684 18509 3338 1 7 . 1 1 72 72 GLY H H 72 7.209 7.209 8.773 -1.564 18509 3339 1 7 . 1 1 73 73 GLY N N 73 105.207 105.207 110.532 -5.325 18509 3340 1 7 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.266 -3.045 18509 3341 1 7 . 1 1 73 73 GLY H H 73 8.789 8.789 8.462 0.327 18509 3342 1 7 . 1 1 74 74 PRO C C 74 175.753 175.753 176.358 -0.605 18509 3343 1 7 . 1 1 75 75 LYS N N 75 114.868 114.868 115.120 -0.252 18509 3344 1 7 . 1 1 75 75 LYS C C 75 173.640 173.640 175.972 -2.332 18509 3345 1 7 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.037 -4.934 18509 3346 1 7 . 1 1 75 75 LYS H H 75 8.651 8.651 7.839 0.812 18509 3347 1 7 . 1 1 76 76 ASP N N 76 120.414 120.414 117.389 3.025 18509 3348 1 7 . 1 1 76 76 ASP C C 76 172.557 172.557 173.622 -1.065 18509 3349 1 7 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.152 -2.843 18509 3350 1 7 . 1 1 76 76 ASP H H 76 7.461 7.461 7.935 -0.474 18509 3351 1 7 . 1 1 77 77 GLU N N 77 120.820 120.820 123.661 -2.841 18509 3352 1 7 . 1 1 77 77 GLU C C 77 174.101 174.101 175.067 -0.966 18509 3353 1 7 . 1 1 77 77 GLU CA C 77 55.513 55.513 54.250 1.263 18509 3354 1 7 . 1 1 77 77 GLU H H 77 8.315 8.315 8.066 0.249 18509 3355 1 7 . 1 1 78 78 GLU N N 78 119.251 119.251 120.150 -0.899 18509 3356 1 7 . 1 1 78 78 GLU C C 78 168.285 168.285 177.073 -8.788 18509 3357 1 7 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.989 -5.911 18509 3358 1 7 . 1 1 78 78 GLU H H 78 8.109 8.109 8.644 -0.535 18509 3359 1 7 . 1 1 79 79 ARG N N 79 118.991 118.991 116.456 2.535 18509 3360 1 7 . 1 1 79 79 ARG C C 79 172.123 172.123 174.706 -2.583 18509 3361 1 7 . 1 1 79 79 ARG CA C 79 51.074 51.074 54.107 -3.033 18509 3362 1 7 . 1 1 79 79 ARG H H 79 6.999 6.999 7.657 -0.658 18509 3363 1 7 . 1 1 80 80 HIS N N 80 118.000 118.000 119.640 -1.640 18509 3364 1 7 . 1 1 80 80 HIS CA C 80 49.953 49.953 54.246 -4.293 18509 3365 1 7 . 1 1 80 80 HIS H H 80 8.355 8.355 7.905 0.450 18509 3366 1 7 . 1 1 81 81 VAL C C 81 173.460 173.460 175.412 -1.952 18509 3367 1 7 . 1 1 82 82 GLY N N 82 97.322 97.322 108.919 -11.597 18509 3368 1 7 . 1 1 82 82 GLY C C 82 170.370 170.370 173.201 -2.831 18509 3369 1 7 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.025 -2.337 18509 3370 1 7 . 1 1 82 82 GLY H H 82 8.487 8.487 7.666 0.821 18509 3371 1 7 . 1 1 83 83 ASP N N 83 120.890 120.890 117.896 2.994 18509 3372 1 7 . 1 1 83 83 ASP C C 83 168.737 168.737 174.776 -6.039 18509 3373 1 7 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.479 -0.561 18509 3374 1 7 . 1 1 83 83 ASP H H 83 7.127 7.127 7.203 -0.076 18509 3375 1 7 . 1 1 84 84 LEU N N 84 120.154 120.154 114.494 5.660 18509 3376 1 7 . 1 1 84 84 LEU C C 84 173.212 173.212 175.793 -2.581 18509 3377 1 7 . 1 1 84 84 LEU CA C 84 50.433 50.433 52.951 -2.518 18509 3378 1 7 . 1 1 84 84 LEU H H 84 7.128 7.128 8.278 -1.150 18509 3379 1 7 . 1 1 85 85 GLY N N 85 106.867 106.867 105.710 1.157 18509 3380 1 7 . 1 1 85 85 GLY C C 85 167.654 167.654 173.811 -6.157 18509 3381 1 7 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.828 -1.817 18509 3382 1 7 . 1 1 85 85 GLY H H 85 8.260 8.260 8.320 -0.060 18509 3383 1 7 . 1 1 86 86 ASN N N 86 117.454 117.454 119.485 -2.031 18509 3384 1 7 . 1 1 86 86 ASN C C 86 173.942 173.942 174.757 -0.815 18509 3385 1 7 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.453 -3.187 18509 3386 1 7 . 1 1 86 86 ASN H H 86 8.041 8.041 7.888 0.153 18509 3387 1 7 . 1 1 87 87 VAL N N 87 113.370 113.370 114.602 -1.232 18509 3388 1 7 . 1 1 87 87 VAL C C 87 171.526 171.526 174.861 -3.335 18509 3389 1 7 . 1 1 87 87 VAL CA C 87 55.708 55.708 59.910 -4.202 18509 3390 1 7 . 1 1 87 87 VAL H H 87 8.960 8.960 8.289 0.671 18509 3391 1 7 . 1 1 88 88 THR N N 88 117.939 117.939 117.566 0.373 18509 3392 1 7 . 1 1 88 88 THR C C 88 170.367 170.367 173.232 -2.865 18509 3393 1 7 . 1 1 88 88 THR CA C 88 58.694 58.694 61.270 -2.575 18509 3394 1 7 . 1 1 88 88 THR H H 88 8.681 8.681 8.362 0.319 18509 3395 1 7 . 1 1 89 89 ALA N N 89 128.674 128.674 131.853 -3.179 18509 3396 1 7 . 1 1 89 89 ALA C C 89 174.480 174.480 175.983 -1.503 18509 3397 1 7 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.330 -3.961 18509 3398 1 7 . 1 1 89 89 ALA H H 89 9.377 9.377 8.693 0.684 18509 3399 1 7 . 1 1 90 90 ASP N N 90 124.235 124.235 125.195 -0.960 18509 3400 1 7 . 1 1 90 90 ASP C C 90 173.825 173.825 176.961 -3.136 18509 3401 1 7 . 1 1 90 90 ASP CA C 90 49.347 49.347 55.202 -5.855 18509 3402 1 7 . 1 1 90 90 ASP H H 90 8.455 8.455 8.193 0.262 18509 3403 1 7 . 1 1 91 91 LYS N N 91 114.942 114.942 119.430 -4.488 18509 3404 1 7 . 1 1 91 91 LYS C C 91 174.101 174.101 175.392 -1.291 18509 3405 1 7 . 1 1 91 91 LYS CA C 91 55.279 55.279 57.571 -2.292 18509 3406 1 7 . 1 1 91 91 LYS H H 91 8.231 8.231 8.248 -0.017 18509 3407 1 7 . 1 1 92 92 ASP N N 92 119.251 119.251 116.729 2.522 18509 3408 1 7 . 1 1 92 92 ASP C C 92 173.020 173.020 175.622 -2.602 18509 3409 1 7 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.041 -1.915 18509 3410 1 7 . 1 1 92 92 ASP H H 92 8.109 8.109 7.450 0.659 18509 3411 1 7 . 1 1 93 93 GLY N N 93 110.868 110.868 109.307 1.561 18509 3412 1 7 . 1 1 93 93 GLY C C 93 169.706 169.706 173.132 -3.426 18509 3413 1 7 . 1 1 93 93 GLY CA C 93 43.763 43.763 44.947 -1.184 18509 3414 1 7 . 1 1 93 93 GLY H H 93 8.405 8.405 8.814 -0.409 18509 3415 1 7 . 1 1 94 94 VAL N N 94 118.755 118.755 123.201 -4.446 18509 3416 1 7 . 1 1 94 94 VAL C C 94 173.510 173.510 174.475 -0.965 18509 3417 1 7 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.380 -3.195 18509 3418 1 7 . 1 1 94 94 VAL H H 94 7.814 7.814 7.789 0.025 18509 3419 1 7 . 1 1 95 95 ALA N N 95 131.313 131.313 130.321 0.992 18509 3420 1 7 . 1 1 95 95 ALA C C 95 171.635 171.635 175.770 -4.135 18509 3421 1 7 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.310 -3.396 18509 3422 1 7 . 1 1 95 95 ALA H H 95 9.763 9.763 7.790 1.973 18509 3423 1 7 . 1 1 96 96 ASP N N 96 125.170 125.170 121.939 3.231 18509 3424 1 7 . 1 1 96 96 ASP C C 96 172.336 172.336 175.270 -2.934 18509 3425 1 7 . 1 1 96 96 ASP H H 96 8.515 8.515 8.524 -0.009 18509 3426 1 7 . 1 1 97 97 VAL N N 97 125.879 125.879 122.719 3.160 18509 3427 1 7 . 1 1 97 97 VAL C C 97 173.488 173.488 175.377 -1.889 18509 3428 1 7 . 1 1 97 97 VAL CA C 97 58.243 58.243 60.309 -2.067 18509 3429 1 7 . 1 1 97 97 VAL H H 97 8.703 8.703 8.464 0.239 18509 3430 1 7 . 1 1 98 98 SER N N 98 123.017 123.017 125.488 -2.471 18509 3431 1 7 . 1 1 98 98 SER C C 98 169.715 169.715 173.077 -3.362 18509 3432 1 7 . 1 1 98 98 SER CA C 98 55.068 55.068 57.348 -2.280 18509 3433 1 7 . 1 1 98 98 SER H H 98 8.784 8.784 8.144 0.640 18509 3434 1 7 . 1 1 99 99 ILE N N 99 125.807 125.807 122.173 3.634 18509 3435 1 7 . 1 1 99 99 ILE C C 99 171.321 171.321 175.202 -3.881 18509 3436 1 7 . 1 1 99 99 ILE CA C 99 57.155 57.155 59.668 -2.513 18509 3437 1 7 . 1 1 99 99 ILE H H 99 9.411 9.411 8.388 1.023 18509 3438 1 7 . 1 1 100 100 GLU N N 100 124.068 124.068 126.600 -2.532 18509 3439 1 7 . 1 1 100 100 GLU C C 100 172.098 172.098 174.581 -2.483 18509 3440 1 7 . 1 1 100 100 GLU CA C 100 52.290 52.290 56.304 -4.014 18509 3441 1 7 . 1 1 100 100 GLU H H 100 8.652 8.652 8.760 -0.108 18509 3442 1 7 . 1 1 101 101 ASP N N 101 126.109 126.109 121.230 4.879 18509 3443 1 7 . 1 1 101 101 ASP C C 101 171.144 171.144 175.072 -3.928 18509 3444 1 7 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.360 -1.941 18509 3445 1 7 . 1 1 101 101 ASP H H 101 9.317 9.317 8.178 1.139 18509 3446 1 7 . 1 1 102 102 SER N N 102 118.470 118.470 115.091 3.379 18509 3447 1 7 . 1 1 102 102 SER C C 102 171.596 171.596 174.266 -2.670 18509 3448 1 7 . 1 1 102 102 SER CA C 102 55.245 55.245 57.867 -2.622 18509 3449 1 7 . 1 1 102 102 SER H H 102 8.933 8.933 8.565 0.368 18509 3450 1 7 . 1 1 103 103 VAL N N 103 123.179 123.179 122.539 0.640 18509 3451 1 7 . 1 1 103 103 VAL CA C 103 61.450 61.450 63.022 -1.572 18509 3452 1 7 . 1 1 103 103 VAL H H 103 8.148 8.148 7.923 0.225 18509 3453 1 7 . 1 1 104 104 ILE C C 104 169.576 169.576 175.151 -5.575 18509 3454 1 7 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.452 -0.258 18509 3455 1 7 . 1 1 105 105 SER N N 105 107.618 107.618 117.220 -9.602 18509 3456 1 7 . 1 1 105 105 SER C C 105 170.046 170.046 174.629 -4.583 18509 3457 1 7 . 1 1 105 105 SER CA C 105 52.550 52.550 58.906 -6.356 18509 3458 1 7 . 1 1 105 105 SER H H 105 6.988 6.988 7.460 -0.472 18509 3459 1 7 . 1 1 106 106 LEU N N 106 120.137 120.137 124.654 -4.517 18509 3460 1 7 . 1 1 106 106 LEU H H 106 8.313 8.313 8.327 -0.014 18509 3461 1 7 . 1 1 107 107 SER C C 107 170.701 170.701 174.925 -4.224 18509 3462 1 7 . 1 1 107 107 SER CA C 107 54.540 54.540 58.394 -3.854 18509 3463 1 7 . 1 1 108 108 GLY N N 108 107.603 107.603 113.995 -6.392 18509 3464 1 7 . 1 1 108 108 GLY C C 108 173.128 173.128 173.908 -0.780 18509 3465 1 7 . 1 1 108 108 GLY CA C 108 41.287 41.287 43.767 -2.480 18509 3466 1 7 . 1 1 108 108 GLY H H 108 8.717 8.717 8.209 0.508 18509 3467 1 7 . 1 1 109 109 ASP N N 109 120.664 120.664 118.308 2.356 18509 3468 1 7 . 1 1 109 109 ASP C C 109 171.904 171.904 175.666 -3.762 18509 3469 1 7 . 1 1 109 109 ASP H H 109 9.019 9.019 7.839 1.180 18509 3470 1 7 . 1 1 110 110 HIS N N 110 116.324 116.324 119.872 -3.548 18509 3471 1 7 . 1 1 110 110 HIS H H 110 9.283 9.283 7.982 1.301 18509 3472 1 7 . 1 1 111 111 SER N N 111 110.225 110.225 112.367 -2.142 18509 3473 1 7 . 1 1 111 111 SER CA C 111 54.681 54.681 57.095 -2.414 18509 3474 1 7 . 1 1 111 111 SER H H 111 7.156 7.156 8.636 -1.480 18509 3475 1 7 . 1 1 112 112 ILE N N 112 117.053 117.053 119.215 -2.162 18509 3476 1 7 . 1 1 112 112 ILE C C 112 171.419 171.419 175.433 -4.014 18509 3477 1 7 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.966 -4.727 18509 3478 1 7 . 1 1 112 112 ILE H H 112 7.837 7.837 8.249 -0.412 18509 3479 1 7 . 1 1 113 113 ILE N N 113 121.032 121.032 118.760 2.272 18509 3480 1 7 . 1 1 113 113 ILE C C 113 173.604 173.604 175.906 -2.302 18509 3481 1 7 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.556 -2.238 18509 3482 1 7 . 1 1 113 113 ILE H H 113 7.592 7.592 7.412 0.180 18509 3483 1 7 . 1 1 114 114 GLY N N 114 112.661 112.661 116.156 -3.495 18509 3484 1 7 . 1 1 114 114 GLY C C 114 169.739 169.739 173.909 -4.170 18509 3485 1 7 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.181 -2.271 18509 3486 1 7 . 1 1 114 114 GLY H H 114 9.575 9.575 8.652 0.923 18509 3487 1 7 . 1 1 115 115 ARG N N 115 118.398 118.398 123.679 -5.281 18509 3488 1 7 . 1 1 115 115 ARG C C 115 171.079 171.079 175.227 -4.148 18509 3489 1 7 . 1 1 115 115 ARG CA C 115 51.663 51.663 56.395 -4.732 18509 3490 1 7 . 1 1 115 115 ARG H H 115 7.464 7.464 8.040 -0.576 18509 3491 1 7 . 1 1 116 116 THR N N 116 112.218 112.218 113.159 -0.941 18509 3492 1 7 . 1 1 116 116 THR C C 116 169.821 169.821 172.402 -2.581 18509 3493 1 7 . 1 1 116 116 THR CA C 116 59.633 59.633 61.609 -1.976 18509 3494 1 7 . 1 1 116 116 THR H H 116 6.677 6.677 8.832 -2.155 18509 3495 1 7 . 1 1 117 117 LEU N N 117 129.477 129.477 127.669 1.808 18509 3496 1 7 . 1 1 117 117 LEU C C 117 171.126 171.126 175.357 -4.231 18509 3497 1 7 . 1 1 117 117 LEU CA C 117 50.415 50.415 53.715 -3.300 18509 3498 1 7 . 1 1 117 117 LEU H H 117 8.799 8.799 8.339 0.460 18509 3499 1 7 . 1 1 118 118 VAL N N 118 125.091 125.091 123.247 1.844 18509 3500 1 7 . 1 1 118 118 VAL C C 118 170.267 170.267 174.542 -4.275 18509 3501 1 7 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.556 -3.417 18509 3502 1 7 . 1 1 118 118 VAL H H 118 8.906 8.906 8.472 0.434 18509 3503 1 7 . 1 1 119 119 VAL N N 119 120.716 120.716 125.092 -4.376 18509 3504 1 7 . 1 1 119 119 VAL C C 119 171.175 171.175 174.469 -3.294 18509 3505 1 7 . 1 1 119 119 VAL CA C 119 55.271 55.271 60.723 -5.452 18509 3506 1 7 . 1 1 119 119 VAL H H 119 7.982 7.982 7.714 0.268 18509 3507 1 7 . 1 1 120 120 HIS N N 120 125.052 125.052 119.816 5.236 18509 3508 1 7 . 1 1 120 120 HIS C C 120 172.599 172.599 173.597 -0.998 18509 3509 1 7 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.032 -0.638 18509 3510 1 7 . 1 1 120 120 HIS H H 120 8.935 8.935 7.975 0.960 18509 3511 1 7 . 1 1 121 121 GLU N N 121 121.453 121.453 123.001 -1.548 18509 3512 1 7 . 1 1 121 121 GLU C C 121 172.304 172.304 175.775 -3.471 18509 3513 1 7 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.846 -0.756 18509 3514 1 7 . 1 1 121 121 GLU H H 121 9.178 9.178 8.610 0.568 18509 3515 1 7 . 1 1 122 122 LYS N N 122 115.248 115.248 121.845 -6.597 18509 3516 1 7 . 1 1 122 122 LYS C C 122 171.523 171.523 174.531 -3.008 18509 3517 1 7 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.417 -4.798 18509 3518 1 7 . 1 1 122 122 LYS H H 122 8.478 8.478 7.873 0.605 18509 3519 1 7 . 1 1 123 123 ALA N N 123 120.866 120.866 123.602 -2.736 18509 3520 1 7 . 1 1 123 123 ALA C C 123 173.219 173.219 177.302 -4.083 18509 3521 1 7 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.950 -4.100 18509 3522 1 7 . 1 1 123 123 ALA H H 123 7.796 7.796 8.528 -0.732 18509 3523 1 7 . 1 1 124 124 ASP N N 124 121.799 121.799 123.438 -1.639 18509 3524 1 7 . 1 1 124 124 ASP C C 124 174.458 174.458 175.444 -0.986 18509 3525 1 7 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.437 -4.029 18509 3526 1 7 . 1 1 124 124 ASP H H 124 10.165 10.165 8.164 2.001 18509 3527 1 7 . 1 1 125 125 ASP N N 125 129.369 129.369 121.243 8.126 18509 3528 1 7 . 1 1 125 125 ASP C C 125 175.231 175.231 177.165 -1.934 18509 3529 1 7 . 1 1 125 125 ASP CA C 125 50.939 50.939 55.738 -4.799 18509 3530 1 7 . 1 1 125 125 ASP H H 125 10.055 10.055 8.109 1.946 18509 3531 1 7 . 1 1 126 126 LEU N N 126 117.190 117.190 124.753 -7.563 18509 3532 1 7 . 1 1 126 126 LEU C C 126 173.964 173.964 178.356 -4.392 18509 3533 1 7 . 1 1 126 126 LEU H H 126 10.483 10.483 8.391 2.092 18509 3534 1 7 . 1 1 127 127 GLY N N 127 103.809 103.809 101.048 2.761 18509 3535 1 7 . 1 1 127 127 GLY CA C 127 42.878 42.878 44.820 -1.942 18509 3536 1 7 . 1 1 127 127 GLY H H 127 8.637 8.637 8.167 0.470 18509 3537 1 7 . 1 1 128 128 LYS N N 128 118.290 118.290 119.819 -1.529 18509 3538 1 7 . 1 1 128 128 LYS CA C 128 51.740 51.740 56.447 -4.707 18509 3539 1 7 . 1 1 128 128 LYS H H 128 7.158 7.158 7.123 0.035 18509 3540 1 7 . 1 1 129 129 GLY N N 129 108.507 108.507 107.652 0.855 18509 3541 1 7 . 1 1 129 129 GLY C C 129 171.524 171.524 175.152 -3.628 18509 3542 1 7 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.728 -4.615 18509 3543 1 7 . 1 1 129 129 GLY H H 129 8.913 8.913 8.382 0.531 18509 3544 1 7 . 1 1 130 130 GLY N N 130 108.537 108.537 108.562 -0.025 18509 3545 1 7 . 1 1 130 130 GLY C C 130 169.994 169.994 173.327 -3.333 18509 3546 1 7 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.910 -2.491 18509 3547 1 7 . 1 1 130 130 GLY H H 130 8.723 8.723 8.326 0.397 18509 3548 1 7 . 1 1 131 131 ASN N N 131 111.951 111.951 118.478 -6.527 18509 3549 1 7 . 1 1 131 131 ASN C C 131 172.236 172.236 174.420 -2.184 18509 3550 1 7 . 1 1 131 131 ASN H H 131 7.152 7.152 8.229 -1.077 18509 3551 1 7 . 1 1 132 132 GLU N N 132 120.461 120.461 119.035 1.426 18509 3552 1 7 . 1 1 132 132 GLU C C 132 171.084 171.084 176.777 -5.693 18509 3553 1 7 . 1 1 132 132 GLU H H 132 8.935 8.935 8.732 0.203 18509 3554 1 7 . 1 1 133 133 GLU N N 133 120.137 120.137 118.298 1.839 18509 3555 1 7 . 1 1 133 133 GLU C C 133 176.239 176.239 178.311 -2.072 18509 3556 1 7 . 1 1 133 133 GLU H H 133 8.775 8.775 8.504 0.271 18509 3557 1 7 . 1 1 134 134 SER N N 134 114.981 114.981 115.496 -0.515 18509 3558 1 7 . 1 1 134 134 SER CA C 134 59.046 59.046 61.151 -2.105 18509 3559 1 7 . 1 1 134 134 SER H H 134 8.117 8.117 8.161 -0.044 18509 3560 1 7 . 1 1 135 135 THR N N 135 102.263 102.263 115.859 -13.596 18509 3561 1 7 . 1 1 135 135 THR C C 135 172.804 172.804 174.448 -1.644 18509 3562 1 7 . 1 1 135 135 THR CA C 135 60.029 60.029 63.522 -3.493 18509 3563 1 7 . 1 1 135 135 THR H H 135 7.206 7.206 7.894 -0.688 18509 3564 1 7 . 1 1 136 136 LYS N N 136 122.108 122.108 121.164 0.944 18509 3565 1 7 . 1 1 136 136 LYS H H 136 7.884 7.884 7.444 0.440 18509 3566 1 7 . 1 1 137 137 THR N N 137 105.718 105.718 109.544 -3.826 18509 3567 1 7 . 1 1 137 137 THR H H 137 8.630 8.630 7.565 1.065 18509 3568 1 7 . 1 1 138 138 GLY N N 138 111.372 111.372 110.772 0.600 18509 3569 1 7 . 1 1 138 138 GLY CA C 138 42.483 42.483 44.890 -2.407 18509 3570 1 7 . 1 1 138 138 GLY H H 138 7.426 7.426 7.866 -0.440 18509 3571 1 7 . 1 1 139 139 ASN N N 139 107.496 107.496 122.947 -15.451 18509 3572 1 7 . 1 1 139 139 ASN H H 139 7.545 7.545 8.228 -0.683 18509 3573 1 7 . 1 1 140 140 ALA N N 140 114.542 114.542 123.873 -9.331 18509 3574 1 7 . 1 1 140 140 ALA C C 140 173.571 173.571 177.153 -3.582 18509 3575 1 7 . 1 1 140 140 ALA H H 140 6.368 6.368 7.988 -1.620 18509 3576 1 7 . 1 1 141 141 GLY N N 141 105.287 105.287 110.637 -5.350 18509 3577 1 7 . 1 1 141 141 GLY C C 141 173.542 173.542 174.020 -0.478 18509 3578 1 7 . 1 1 141 141 GLY H H 141 8.271 8.271 8.359 -0.088 18509 3579 1 7 . 1 1 142 142 SER N N 142 118.771 118.771 115.357 3.414 18509 3580 1 7 . 1 1 142 142 SER C C 142 170.188 170.188 175.090 -4.902 18509 3581 1 7 . 1 1 142 142 SER H H 142 9.196 9.196 7.595 1.601 18509 3582 1 7 . 1 1 143 143 ARG N N 143 120.189 120.189 120.495 -0.306 18509 3583 1 7 . 1 1 143 143 ARG C C 143 171.596 171.596 177.600 -6.004 18509 3584 1 7 . 1 1 143 143 ARG H H 143 8.943 8.943 7.772 1.171 18509 3585 1 7 . 1 1 144 144 LEU N N 144 122.907 122.907 119.840 3.067 18509 3586 1 7 . 1 1 144 144 LEU C C 144 174.393 174.393 175.381 -0.988 18509 3587 1 7 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.491 -3.116 18509 3588 1 7 . 1 1 144 144 LEU H H 144 8.395 8.395 7.919 0.476 18509 3589 1 7 . 1 1 145 145 ALA N N 145 114.159 114.159 114.638 -0.479 18509 3590 1 7 . 1 1 145 145 ALA C C 145 171.752 171.752 174.979 -3.227 18509 3591 1 7 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.538 -3.409 18509 3592 1 7 . 1 1 145 145 ALA H H 145 7.356 7.356 7.320 0.036 18509 3593 1 7 . 1 1 146 146 CYS N N 146 110.738 110.738 119.998 -9.260 18509 3594 1 7 . 1 1 146 146 CYS C C 146 170.087 170.087 174.048 -3.961 18509 3595 1 7 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.330 -6.253 18509 3596 1 7 . 1 1 146 146 CYS H H 146 9.008 9.008 8.207 0.801 18509 3597 1 7 . 1 1 147 147 GLY N N 147 106.461 106.461 107.605 -1.144 18509 3598 1 7 . 1 1 147 147 GLY C C 147 167.909 167.909 172.394 -4.485 18509 3599 1 7 . 1 1 147 147 GLY CA C 147 42.674 42.674 44.825 -2.151 18509 3600 1 7 . 1 1 147 147 GLY H H 147 8.018 8.018 7.998 0.020 18509 3601 1 7 . 1 1 148 148 VAL N N 148 124.054 124.054 120.884 3.170 18509 3602 1 7 . 1 1 148 148 VAL C C 148 172.084 172.084 175.216 -3.132 18509 3603 1 7 . 1 1 148 148 VAL CA C 148 59.635 59.635 63.031 -3.396 18509 3604 1 7 . 1 1 148 148 VAL H H 148 8.434 8.434 8.507 -0.073 18509 3605 1 7 . 1 1 149 149 ILE N N 149 126.918 126.918 129.227 -2.309 18509 3606 1 7 . 1 1 149 149 ILE C C 149 171.804 171.804 174.472 -2.668 18509 3607 1 7 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.219 -0.035 18509 3608 1 7 . 1 1 149 149 ILE H H 149 8.613 8.613 8.423 0.190 18509 3609 1 7 . 1 1 150 150 GLY N N 150 116.493 116.493 115.257 1.236 18509 3610 1 7 . 1 1 150 150 GLY C C 150 170.188 170.188 171.794 -1.606 18509 3611 1 7 . 1 1 150 150 GLY CA C 150 40.120 40.120 45.188 -5.068 18509 3612 1 7 . 1 1 150 150 GLY H H 150 9.283 9.283 8.161 1.122 18509 3613 1 7 . 1 1 151 151 ILE N N 151 120.189 120.189 122.397 -2.208 18509 3614 1 7 . 1 1 151 151 ILE C C 151 172.231 172.231 174.639 -2.408 18509 3615 1 7 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.480 -1.108 18509 3616 1 7 . 1 1 151 151 ILE H H 151 8.943 8.943 8.517 0.426 18509 3617 1 7 . 1 1 152 152 ALA N N 152 129.719 129.719 131.525 -1.806 18509 3618 1 7 . 1 1 152 152 ALA CA C 152 46.772 46.772 50.499 -3.727 18509 3619 1 7 . 1 1 152 152 ALA H H 152 8.170 8.170 7.972 0.198 18509 3620 1 8 . 1 1 2 2 THR C C 2 170.139 170.139 173.450 -3.311 18509 3621 1 8 . 1 1 3 3 LYS N N 3 123.998 123.998 120.222 3.776 18509 3622 1 8 . 1 1 3 3 LYS C C 3 171.607 171.607 174.362 -2.755 18509 3623 1 8 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.525 -3.347 18509 3624 1 8 . 1 1 3 3 LYS H H 3 8.666 8.666 7.661 1.005 18509 3625 1 8 . 1 1 4 4 ALA N N 4 123.295 123.295 121.027 2.268 18509 3626 1 8 . 1 1 4 4 ALA C C 4 172.145 172.145 175.317 -3.172 18509 3627 1 8 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.478 -2.974 18509 3628 1 8 . 1 1 4 4 ALA H H 4 9.116 9.116 8.433 0.683 18509 3629 1 8 . 1 1 5 5 VAL N N 5 121.466 121.466 114.303 7.163 18509 3630 1 8 . 1 1 5 5 VAL C C 5 167.836 167.836 174.073 -6.237 18509 3631 1 8 . 1 1 5 5 VAL CA C 5 56.875 56.875 59.199 -2.324 18509 3632 1 8 . 1 1 5 5 VAL H H 5 9.545 9.545 8.942 0.603 18509 3633 1 8 . 1 1 6 6 ALA N N 6 125.984 125.984 121.959 4.025 18509 3634 1 8 . 1 1 6 6 ALA C C 6 171.607 171.607 175.832 -4.225 18509 3635 1 8 . 1 1 6 6 ALA CA C 6 47.471 47.471 51.019 -3.548 18509 3636 1 8 . 1 1 6 6 ALA H H 6 9.177 9.177 8.347 0.830 18509 3637 1 8 . 1 1 7 7 VAL N N 7 123.600 123.600 124.131 -0.531 18509 3638 1 8 . 1 1 7 7 VAL C C 7 172.244 172.244 174.589 -2.345 18509 3639 1 8 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.364 -2.888 18509 3640 1 8 . 1 1 7 7 VAL H H 7 9.116 9.116 8.386 0.730 18509 3641 1 8 . 1 1 8 8 LEU N N 8 126.455 126.455 128.697 -2.242 18509 3642 1 8 . 1 1 8 8 LEU C C 8 172.557 172.557 175.943 -3.386 18509 3643 1 8 . 1 1 8 8 LEU CA C 8 51.052 51.052 54.259 -3.207 18509 3644 1 8 . 1 1 8 8 LEU H H 8 8.916 8.916 8.770 0.146 18509 3645 1 8 . 1 1 9 9 LYS N N 9 120.820 120.820 122.053 -1.233 18509 3646 1 8 . 1 1 9 9 LYS C C 9 172.509 172.509 174.884 -2.375 18509 3647 1 8 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.924 -4.027 18509 3648 1 8 . 1 1 9 9 LYS H H 9 8.315 8.315 8.116 0.199 18509 3649 1 8 . 1 1 10 10 GLY N N 10 111.249 111.249 112.561 -1.312 18509 3650 1 8 . 1 1 10 10 GLY C C 10 169.847 169.847 173.649 -3.802 18509 3651 1 8 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.095 -2.820 18509 3652 1 8 . 1 1 10 10 GLY H H 10 8.968 8.968 8.139 0.829 18509 3653 1 8 . 1 1 11 11 ASP N N 11 120.904 120.904 120.487 0.417 18509 3654 1 8 . 1 1 11 11 ASP C C 11 173.132 173.132 177.324 -4.192 18509 3655 1 8 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.967 -4.650 18509 3656 1 8 . 1 1 11 11 ASP H H 11 8.745 8.745 8.461 0.284 18509 3657 1 8 . 1 1 12 12 GLY N N 12 109.862 109.862 109.241 0.621 18509 3658 1 8 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.239 -2.039 18509 3659 1 8 . 1 1 12 12 GLY H H 12 7.985 7.985 8.239 -0.254 18509 3660 1 8 . 1 1 13 13 PRO C C 13 173.640 173.640 175.672 -2.032 18509 3661 1 8 . 1 1 14 14 VAL N N 14 120.414 120.414 119.008 1.406 18509 3662 1 8 . 1 1 14 14 VAL C C 14 172.804 172.804 175.047 -2.243 18509 3663 1 8 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.058 -0.174 18509 3664 1 8 . 1 1 14 14 VAL H H 14 7.476 7.476 7.895 -0.419 18509 3665 1 8 . 1 1 15 15 GLN N N 15 122.664 122.664 126.172 -3.508 18509 3666 1 8 . 1 1 15 15 GLN C C 15 171.168 171.168 175.300 -4.132 18509 3667 1 8 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.863 -4.184 18509 3668 1 8 . 1 1 15 15 GLN H H 15 7.938 7.938 8.527 -0.589 18509 3669 1 8 . 1 1 16 16 GLY N N 16 107.018 107.018 109.344 -2.326 18509 3670 1 8 . 1 1 16 16 GLY C C 16 167.726 167.726 171.879 -4.153 18509 3671 1 8 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.453 -1.829 18509 3672 1 8 . 1 1 16 16 GLY H H 16 8.288 8.288 8.197 0.091 18509 3673 1 8 . 1 1 17 17 ILE N N 17 120.248 120.248 115.601 4.647 18509 3674 1 8 . 1 1 17 17 ILE C C 17 171.194 171.194 173.906 -2.712 18509 3675 1 8 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.649 -1.152 18509 3676 1 8 . 1 1 17 17 ILE H H 17 7.948 7.948 7.864 0.084 18509 3677 1 8 . 1 1 18 18 ILE N N 18 125.851 125.851 125.181 0.670 18509 3678 1 8 . 1 1 18 18 ILE C C 18 168.889 168.889 175.351 -6.462 18509 3679 1 8 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.512 -6.081 18509 3680 1 8 . 1 1 18 18 ILE H H 18 8.725 8.725 8.492 0.233 18509 3681 1 8 . 1 1 19 19 ASN N N 19 123.256 123.256 125.230 -1.974 18509 3682 1 8 . 1 1 19 19 ASN C C 19 168.903 168.903 174.328 -5.425 18509 3683 1 8 . 1 1 19 19 ASN CA C 19 49.088 49.088 52.404 -3.316 18509 3684 1 8 . 1 1 19 19 ASN H H 19 8.727 8.727 8.780 -0.053 18509 3685 1 8 . 1 1 20 20 PHE N N 20 113.849 113.849 121.214 -7.365 18509 3686 1 8 . 1 1 20 20 PHE C C 20 173.219 173.219 174.835 -1.616 18509 3687 1 8 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.254 -5.196 18509 3688 1 8 . 1 1 20 20 PHE H H 20 8.399 8.399 8.806 -0.407 18509 3689 1 8 . 1 1 21 21 GLU N N 21 121.454 121.454 124.268 -2.814 18509 3690 1 8 . 1 1 21 21 GLU C C 21 170.280 170.280 175.707 -5.427 18509 3691 1 8 . 1 1 21 21 GLU CA C 21 53.044 53.044 55.028 -1.984 18509 3692 1 8 . 1 1 21 21 GLU H H 21 9.526 9.526 8.668 0.858 18509 3693 1 8 . 1 1 22 22 GLN N N 22 130.340 130.340 122.089 8.251 18509 3694 1 8 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.584 -3.405 18509 3695 1 8 . 1 1 22 22 GLN H H 22 9.305 9.305 8.522 0.783 18509 3696 1 8 . 1 1 23 23 LYS N N 23 128.657 128.657 126.792 1.865 18509 3697 1 8 . 1 1 23 23 LYS CA C 23 57.241 57.241 55.431 1.810 18509 3698 1 8 . 1 1 23 23 LYS H H 23 9.088 9.088 8.951 0.137 18509 3699 1 8 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.961 -7.569 18509 3700 1 8 . 1 1 25 25 SER CA C 25 58.078 58.078 58.444 -0.366 18509 3701 1 8 . 1 1 27 27 GLY N N 27 108.125 108.125 111.074 -2.949 18509 3702 1 8 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.549 -1.624 18509 3703 1 8 . 1 1 27 27 GLY H H 27 8.032 8.032 8.126 -0.094 18509 3704 1 8 . 1 1 28 28 PRO C C 28 173.128 173.128 176.460 -3.332 18509 3705 1 8 . 1 1 29 29 VAL N N 29 121.267 121.267 123.407 -2.140 18509 3706 1 8 . 1 1 29 29 VAL C C 29 172.198 172.198 175.038 -2.840 18509 3707 1 8 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.857 -4.137 18509 3708 1 8 . 1 1 29 29 VAL H H 29 9.089 9.089 8.240 0.849 18509 3709 1 8 . 1 1 30 30 LYS N N 30 127.589 127.589 129.002 -1.413 18509 3710 1 8 . 1 1 30 30 LYS C C 30 172.098 172.098 174.394 -2.296 18509 3711 1 8 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.125 -2.483 18509 3712 1 8 . 1 1 30 30 LYS H H 30 9.200 9.200 9.153 0.047 18509 3713 1 8 . 1 1 31 31 VAL N N 31 126.037 126.037 120.289 5.748 18509 3714 1 8 . 1 1 31 31 VAL C C 31 172.244 172.244 174.200 -1.956 18509 3715 1 8 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.284 -2.145 18509 3716 1 8 . 1 1 31 31 VAL H H 31 9.282 9.282 8.252 1.030 18509 3717 1 8 . 1 1 32 32 TRP N N 32 125.414 125.414 124.278 1.136 18509 3718 1 8 . 1 1 32 32 TRP C C 32 170.156 170.156 174.111 -3.955 18509 3719 1 8 . 1 1 32 32 TRP CA C 32 53.137 53.137 57.765 -4.628 18509 3720 1 8 . 1 1 32 32 TRP H H 32 8.983 8.983 8.454 0.529 18509 3721 1 8 . 1 1 33 33 GLY N N 33 107.848 107.848 113.261 -5.413 18509 3722 1 8 . 1 1 33 33 GLY C C 33 168.400 168.400 172.101 -3.701 18509 3723 1 8 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.456 -3.889 18509 3724 1 8 . 1 1 33 33 GLY H H 33 8.360 8.360 8.169 0.191 18509 3725 1 8 . 1 1 34 34 SER N N 34 114.377 114.377 118.326 -3.949 18509 3726 1 8 . 1 1 34 34 SER C C 34 169.618 169.618 173.784 -4.166 18509 3727 1 8 . 1 1 34 34 SER CA C 34 53.875 53.875 56.513 -2.638 18509 3728 1 8 . 1 1 34 34 SER H H 34 7.838 7.838 8.217 -0.379 18509 3729 1 8 . 1 1 35 35 ILE N N 35 123.149 123.149 115.811 7.338 18509 3730 1 8 . 1 1 35 35 ILE C C 35 169.713 169.713 173.966 -4.253 18509 3731 1 8 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.335 -2.566 18509 3732 1 8 . 1 1 35 35 ILE H H 35 8.496 8.496 7.959 0.537 18509 3733 1 8 . 1 1 36 36 LYS N N 36 123.803 123.803 122.549 1.254 18509 3734 1 8 . 1 1 36 36 LYS C C 36 172.260 172.260 175.266 -3.006 18509 3735 1 8 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.394 -3.244 18509 3736 1 8 . 1 1 36 36 LYS H H 36 9.091 9.091 8.335 0.756 18509 3737 1 8 . 1 1 37 37 GLY N N 37 105.495 105.495 109.314 -3.819 18509 3738 1 8 . 1 1 37 37 GLY C C 37 171.641 171.641 173.022 -1.381 18509 3739 1 8 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.427 -1.066 18509 3740 1 8 . 1 1 37 37 GLY H H 37 8.237 8.237 8.111 0.126 18509 3741 1 8 . 1 1 38 38 LEU N N 38 120.966 120.966 118.494 2.472 18509 3742 1 8 . 1 1 38 38 LEU C C 38 174.112 174.112 177.740 -3.628 18509 3743 1 8 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.764 -4.293 18509 3744 1 8 . 1 1 38 38 LEU H H 38 8.156 8.156 8.010 0.146 18509 3745 1 8 . 1 1 39 39 THR N N 39 110.363 110.363 115.045 -4.682 18509 3746 1 8 . 1 1 39 39 THR C C 39 173.102 173.102 174.245 -1.143 18509 3747 1 8 . 1 1 39 39 THR CA C 39 58.194 58.194 63.828 -5.635 18509 3748 1 8 . 1 1 39 39 THR H H 39 8.660 8.660 8.338 0.322 18509 3749 1 8 . 1 1 40 40 GLU N N 40 125.818 125.818 126.213 -0.395 18509 3750 1 8 . 1 1 40 40 GLU C C 40 173.134 173.134 175.434 -2.300 18509 3751 1 8 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.219 -0.863 18509 3752 1 8 . 1 1 40 40 GLU H H 40 8.804 8.804 7.903 0.901 18509 3753 1 8 . 1 1 41 41 GLY N N 41 113.875 113.875 107.669 6.206 18509 3754 1 8 . 1 1 41 41 GLY C C 41 170.046 170.046 172.745 -2.699 18509 3755 1 8 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.475 -5.421 18509 3756 1 8 . 1 1 41 41 GLY H H 41 8.763 8.763 8.563 0.200 18509 3757 1 8 . 1 1 42 42 LEU N N 42 120.137 120.137 114.688 5.449 18509 3758 1 8 . 1 1 42 42 LEU C C 42 174.218 174.218 174.434 -0.216 18509 3759 1 8 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.330 -2.175 18509 3760 1 8 . 1 1 42 42 LEU H H 42 8.313 8.313 8.107 0.206 18509 3761 1 8 . 1 1 43 43 HIS N N 43 114.385 114.385 119.733 -5.348 18509 3762 1 8 . 1 1 43 43 HIS C C 43 171.504 171.504 174.085 -2.581 18509 3763 1 8 . 1 1 43 43 HIS CA C 43 50.985 50.985 56.263 -5.278 18509 3764 1 8 . 1 1 43 43 HIS H H 43 8.712 8.712 8.295 0.417 18509 3765 1 8 . 1 1 44 44 GLY N N 44 108.872 108.872 107.791 1.081 18509 3766 1 8 . 1 1 44 44 GLY C C 44 168.656 168.656 172.570 -3.914 18509 3767 1 8 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.270 -1.075 18509 3768 1 8 . 1 1 44 44 GLY H H 44 8.875 8.875 9.483 -0.608 18509 3769 1 8 . 1 1 45 45 PHE N N 45 126.439 126.439 120.906 5.533 18509 3770 1 8 . 1 1 45 45 PHE CA C 45 53.098 53.098 57.360 -4.262 18509 3771 1 8 . 1 1 45 45 PHE H H 45 8.111 8.111 7.644 0.467 18509 3772 1 8 . 1 1 46 46 HIS N N 46 115.353 115.353 124.577 -9.224 18509 3773 1 8 . 1 1 46 46 HIS C C 46 172.415 172.415 174.003 -1.588 18509 3774 1 8 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.486 -5.280 18509 3775 1 8 . 1 1 46 46 HIS H H 46 8.107 8.107 6.976 1.131 18509 3776 1 8 . 1 1 47 47 VAL N N 47 120.548 120.548 125.253 -4.705 18509 3777 1 8 . 1 1 47 47 VAL C C 47 173.900 173.900 173.980 -0.080 18509 3778 1 8 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.740 -2.948 18509 3779 1 8 . 1 1 47 47 VAL H H 47 9.366 9.366 8.026 1.340 18509 3780 1 8 . 1 1 48 48 HIS N N 48 129.236 129.236 126.244 2.992 18509 3781 1 8 . 1 1 48 48 HIS C C 48 171.084 171.084 174.298 -3.214 18509 3782 1 8 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.473 -1.717 18509 3783 1 8 . 1 1 48 48 HIS H H 48 10.210 10.210 8.384 1.826 18509 3784 1 8 . 1 1 49 49 GLU N N 49 118.119 118.119 126.984 -8.865 18509 3785 1 8 . 1 1 49 49 GLU C C 49 171.635 171.635 175.810 -4.175 18509 3786 1 8 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.824 1.935 18509 3787 1 8 . 1 1 49 49 GLU H H 49 8.492 8.492 8.048 0.444 18509 3788 1 8 . 1 1 50 50 PHE N N 50 110.329 110.329 122.120 -11.791 18509 3789 1 8 . 1 1 50 50 PHE C C 50 175.252 175.252 174.776 0.476 18509 3790 1 8 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.722 -5.822 18509 3791 1 8 . 1 1 50 50 PHE H H 50 8.580 8.580 8.388 0.192 18509 3792 1 8 . 1 1 51 51 GLY N N 51 119.251 119.251 113.210 6.041 18509 3793 1 8 . 1 1 51 51 GLY C C 51 168.248 168.248 174.427 -6.179 18509 3794 1 8 . 1 1 51 51 GLY H H 51 10.208 10.208 8.004 2.204 18509 3795 1 8 . 1 1 52 52 ASP N N 52 114.958 114.958 119.652 -4.694 18509 3796 1 8 . 1 1 52 52 ASP CA C 52 48.891 48.891 55.971 -7.080 18509 3797 1 8 . 1 1 52 52 ASP H H 52 5.834 5.834 8.622 -2.788 18509 3798 1 8 . 1 1 53 53 ASN N N 53 128.224 128.224 118.989 9.235 18509 3799 1 8 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.349 -4.116 18509 3800 1 8 . 1 1 53 53 ASN H H 53 9.360 9.360 7.707 1.653 18509 3801 1 8 . 1 1 54 54 THR C C 54 168.656 168.656 174.793 -6.137 18509 3802 1 8 . 1 1 55 55 ALA N N 55 126.661 126.661 118.189 8.472 18509 3803 1 8 . 1 1 55 55 ALA C C 55 174.185 174.185 175.814 -1.629 18509 3804 1 8 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.082 -4.927 18509 3805 1 8 . 1 1 55 55 ALA H H 55 8.390 8.390 7.966 0.424 18509 3806 1 8 . 1 1 56 56 GLY N N 56 107.903 107.903 105.628 2.275 18509 3807 1 8 . 1 1 56 56 GLY C C 56 171.578 171.578 173.376 -1.798 18509 3808 1 8 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.254 -2.674 18509 3809 1 8 . 1 1 56 56 GLY H H 56 7.282 7.282 7.474 -0.192 18509 3810 1 8 . 1 1 57 57 CYS N N 57 117.952 117.952 127.183 -9.231 18509 3811 1 8 . 1 1 57 57 CYS C C 57 175.209 175.209 175.091 0.118 18509 3812 1 8 . 1 1 57 57 CYS CA C 57 49.088 49.088 58.422 -9.334 18509 3813 1 8 . 1 1 57 57 CYS H H 57 8.900 8.900 8.962 -0.062 18509 3814 1 8 . 1 1 58 58 THR N N 58 119.852 119.852 119.984 -0.132 18509 3815 1 8 . 1 1 58 58 THR CA C 58 58.239 58.239 65.802 -7.563 18509 3816 1 8 . 1 1 58 58 THR H H 58 8.505 8.505 8.062 0.443 18509 3817 1 8 . 1 1 59 59 SER C C 59 170.763 170.763 175.584 -4.821 18509 3818 1 8 . 1 1 59 59 SER CA C 59 55.609 55.609 60.783 -5.174 18509 3819 1 8 . 1 1 60 60 ALA N N 60 119.753 119.753 123.861 -4.108 18509 3820 1 8 . 1 1 60 60 ALA CA C 60 49.940 49.940 51.865 -1.925 18509 3821 1 8 . 1 1 60 60 ALA H H 60 6.898 6.898 7.772 -0.874 18509 3822 1 8 . 1 1 61 61 GLY N N 61 101.351 101.351 109.253 -7.902 18509 3823 1 8 . 1 1 61 61 GLY CA C 61 42.805 42.805 45.303 -2.498 18509 3824 1 8 . 1 1 61 61 GLY H H 61 7.730 7.730 8.096 -0.366 18509 3825 1 8 . 1 1 62 62 PRO C C 62 172.276 172.276 176.014 -3.738 18509 3826 1 8 . 1 1 63 63 HIS N N 63 115.023 115.023 118.262 -3.239 18509 3827 1 8 . 1 1 63 63 HIS CA C 63 52.119 52.119 53.928 -1.809 18509 3828 1 8 . 1 1 63 63 HIS H H 63 7.474 7.474 7.955 -0.481 18509 3829 1 8 . 1 1 64 64 PHE C C 64 171.731 171.731 174.463 -2.732 18509 3830 1 8 . 1 1 65 65 ASN N N 65 126.978 126.978 119.979 6.999 18509 3831 1 8 . 1 1 65 65 ASN CA C 65 47.753 47.753 50.038 -2.285 18509 3832 1 8 . 1 1 65 65 ASN H H 65 9.426 9.426 8.645 0.781 18509 3833 1 8 . 1 1 67 67 LEU N N 67 117.937 117.937 116.841 1.096 18509 3834 1 8 . 1 1 67 67 LEU C C 67 172.580 172.580 177.398 -4.818 18509 3835 1 8 . 1 1 67 67 LEU CA C 67 50.911 50.911 55.024 -4.113 18509 3836 1 8 . 1 1 67 67 LEU H H 67 7.720 7.720 8.219 -0.499 18509 3837 1 8 . 1 1 68 68 SER N N 68 110.842 110.842 116.904 -6.062 18509 3838 1 8 . 1 1 68 68 SER CA C 68 55.953 55.953 59.108 -3.155 18509 3839 1 8 . 1 1 68 68 SER H H 68 7.428 7.428 7.759 -0.331 18509 3840 1 8 . 1 1 69 69 ARG N N 69 120.782 120.782 118.057 2.725 18509 3841 1 8 . 1 1 69 69 ARG C C 69 173.381 173.381 176.167 -2.786 18509 3842 1 8 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.039 -4.496 18509 3843 1 8 . 1 1 69 69 ARG H H 69 8.508 8.508 8.062 0.446 18509 3844 1 8 . 1 1 70 70 LYS N N 70 118.055 118.055 120.344 -2.289 18509 3845 1 8 . 1 1 70 70 LYS C C 70 169.994 169.994 176.416 -6.422 18509 3846 1 8 . 1 1 70 70 LYS CA C 70 52.596 52.596 55.474 -2.878 18509 3847 1 8 . 1 1 70 70 LYS H H 70 8.745 8.745 8.041 0.704 18509 3848 1 8 . 1 1 71 71 HIS N N 71 111.871 111.871 115.834 -3.963 18509 3849 1 8 . 1 1 71 71 HIS C C 71 171.534 171.534 174.431 -2.897 18509 3850 1 8 . 1 1 71 71 HIS CA C 71 52.549 52.549 56.231 -3.682 18509 3851 1 8 . 1 1 71 71 HIS H H 71 7.152 7.152 7.851 -0.699 18509 3852 1 8 . 1 1 72 72 GLY N N 72 112.910 112.910 112.172 0.738 18509 3853 1 8 . 1 1 72 72 GLY C C 72 168.634 168.634 173.820 -5.186 18509 3854 1 8 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.926 -3.652 18509 3855 1 8 . 1 1 72 72 GLY H H 72 7.209 7.209 7.912 -0.703 18509 3856 1 8 . 1 1 73 73 GLY N N 73 105.207 105.207 108.049 -2.842 18509 3857 1 8 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.576 -2.355 18509 3858 1 8 . 1 1 73 73 GLY H H 73 8.789 8.789 7.832 0.957 18509 3859 1 8 . 1 1 74 74 PRO C C 74 175.753 175.753 176.523 -0.770 18509 3860 1 8 . 1 1 75 75 LYS N N 75 114.868 114.868 114.439 0.429 18509 3861 1 8 . 1 1 75 75 LYS C C 75 173.640 173.640 175.096 -1.456 18509 3862 1 8 . 1 1 75 75 LYS CA C 75 51.103 51.103 55.115 -4.012 18509 3863 1 8 . 1 1 75 75 LYS H H 75 8.651 8.651 7.392 1.259 18509 3864 1 8 . 1 1 76 76 ASP N N 76 120.414 120.414 118.915 1.499 18509 3865 1 8 . 1 1 76 76 ASP C C 76 172.557 172.557 175.113 -2.556 18509 3866 1 8 . 1 1 76 76 ASP CA C 76 51.309 51.309 55.298 -3.989 18509 3867 1 8 . 1 1 76 76 ASP H H 76 7.461 7.461 8.172 -0.711 18509 3868 1 8 . 1 1 77 77 GLU N N 77 120.820 120.820 120.383 0.437 18509 3869 1 8 . 1 1 77 77 GLU C C 77 174.101 174.101 177.297 -3.196 18509 3870 1 8 . 1 1 77 77 GLU CA C 77 55.513 55.513 55.306 0.207 18509 3871 1 8 . 1 1 77 77 GLU H H 77 8.315 8.315 8.153 0.162 18509 3872 1 8 . 1 1 78 78 GLU N N 78 119.251 119.251 123.931 -4.680 18509 3873 1 8 . 1 1 78 78 GLU C C 78 168.285 168.285 175.794 -7.509 18509 3874 1 8 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.700 -5.622 18509 3875 1 8 . 1 1 78 78 GLU H H 78 8.109 8.109 8.308 -0.199 18509 3876 1 8 . 1 1 79 79 ARG N N 79 118.991 118.991 116.891 2.100 18509 3877 1 8 . 1 1 79 79 ARG C C 79 172.123 172.123 174.977 -2.854 18509 3878 1 8 . 1 1 79 79 ARG CA C 79 51.074 51.074 56.386 -5.312 18509 3879 1 8 . 1 1 79 79 ARG H H 79 6.999 6.999 7.988 -0.989 18509 3880 1 8 . 1 1 80 80 HIS N N 80 118.000 118.000 119.357 -1.357 18509 3881 1 8 . 1 1 80 80 HIS CA C 80 49.953 49.953 54.522 -4.569 18509 3882 1 8 . 1 1 80 80 HIS H H 80 8.355 8.355 7.979 0.376 18509 3883 1 8 . 1 1 81 81 VAL C C 81 173.460 173.460 175.081 -1.621 18509 3884 1 8 . 1 1 82 82 GLY N N 82 97.322 97.322 114.385 -17.063 18509 3885 1 8 . 1 1 82 82 GLY C C 82 170.370 170.370 172.096 -1.726 18509 3886 1 8 . 1 1 82 82 GLY CA C 82 42.688 42.688 44.906 -2.218 18509 3887 1 8 . 1 1 82 82 GLY H H 82 8.487 8.487 7.742 0.745 18509 3888 1 8 . 1 1 83 83 ASP N N 83 120.890 120.890 120.735 0.155 18509 3889 1 8 . 1 1 83 83 ASP C C 83 168.737 168.737 173.902 -5.165 18509 3890 1 8 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.465 -0.547 18509 3891 1 8 . 1 1 83 83 ASP H H 83 7.127 7.127 8.221 -1.094 18509 3892 1 8 . 1 1 84 84 LEU N N 84 120.154 120.154 119.397 0.757 18509 3893 1 8 . 1 1 84 84 LEU C C 84 173.212 173.212 175.075 -1.863 18509 3894 1 8 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.246 -3.813 18509 3895 1 8 . 1 1 84 84 LEU H H 84 7.128 7.128 8.423 -1.295 18509 3896 1 8 . 1 1 85 85 GLY N N 85 106.867 106.867 106.456 0.411 18509 3897 1 8 . 1 1 85 85 GLY C C 85 167.654 167.654 173.880 -6.226 18509 3898 1 8 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.532 -2.522 18509 3899 1 8 . 1 1 85 85 GLY H H 85 8.260 8.260 8.346 -0.086 18509 3900 1 8 . 1 1 86 86 ASN N N 86 117.454 117.454 117.892 -0.438 18509 3901 1 8 . 1 1 86 86 ASN C C 86 173.942 173.942 174.087 -0.145 18509 3902 1 8 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.365 -3.099 18509 3903 1 8 . 1 1 86 86 ASN H H 86 8.041 8.041 8.100 -0.059 18509 3904 1 8 . 1 1 87 87 VAL N N 87 113.370 113.370 119.079 -5.709 18509 3905 1 8 . 1 1 87 87 VAL C C 87 171.526 171.526 175.169 -3.643 18509 3906 1 8 . 1 1 87 87 VAL CA C 87 55.708 55.708 61.298 -5.590 18509 3907 1 8 . 1 1 87 87 VAL H H 87 8.960 8.960 8.471 0.489 18509 3908 1 8 . 1 1 88 88 THR N N 88 117.939 117.939 118.089 -0.150 18509 3909 1 8 . 1 1 88 88 THR C C 88 170.367 170.367 172.969 -2.602 18509 3910 1 8 . 1 1 88 88 THR CA C 88 58.694 58.694 61.473 -2.779 18509 3911 1 8 . 1 1 88 88 THR H H 88 8.681 8.681 8.117 0.564 18509 3912 1 8 . 1 1 89 89 ALA N N 89 128.674 128.674 127.971 0.703 18509 3913 1 8 . 1 1 89 89 ALA C C 89 174.480 174.480 174.681 -0.201 18509 3914 1 8 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.301 -3.933 18509 3915 1 8 . 1 1 89 89 ALA H H 89 9.377 9.377 8.751 0.626 18509 3916 1 8 . 1 1 90 90 ASP N N 90 124.235 124.235 117.998 6.237 18509 3917 1 8 . 1 1 90 90 ASP C C 90 173.825 173.825 177.146 -3.321 18509 3918 1 8 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.457 -3.110 18509 3919 1 8 . 1 1 90 90 ASP H H 90 8.455 8.455 7.992 0.463 18509 3920 1 8 . 1 1 91 91 LYS N N 91 114.942 114.942 118.166 -3.224 18509 3921 1 8 . 1 1 91 91 LYS C C 91 174.101 174.101 177.721 -3.620 18509 3922 1 8 . 1 1 91 91 LYS CA C 91 55.279 55.279 59.124 -3.845 18509 3923 1 8 . 1 1 91 91 LYS H H 91 8.231 8.231 8.595 -0.364 18509 3924 1 8 . 1 1 92 92 ASP N N 92 119.251 119.251 119.465 -0.214 18509 3925 1 8 . 1 1 92 92 ASP C C 92 173.020 173.020 175.421 -2.401 18509 3926 1 8 . 1 1 92 92 ASP CA C 92 51.127 51.127 55.331 -4.204 18509 3927 1 8 . 1 1 92 92 ASP H H 92 8.109 8.109 7.652 0.457 18509 3928 1 8 . 1 1 93 93 GLY N N 93 110.868 110.868 105.261 5.607 18509 3929 1 8 . 1 1 93 93 GLY C C 93 169.706 169.706 172.829 -3.123 18509 3930 1 8 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.074 -1.310 18509 3931 1 8 . 1 1 93 93 GLY H H 93 8.405 8.405 7.807 0.598 18509 3932 1 8 . 1 1 94 94 VAL N N 94 118.755 118.755 124.222 -5.467 18509 3933 1 8 . 1 1 94 94 VAL C C 94 173.510 173.510 173.556 -0.046 18509 3934 1 8 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.429 -3.244 18509 3935 1 8 . 1 1 94 94 VAL H H 94 7.814 7.814 7.957 -0.143 18509 3936 1 8 . 1 1 95 95 ALA N N 95 131.313 131.313 132.290 -0.977 18509 3937 1 8 . 1 1 95 95 ALA C C 95 171.635 171.635 175.720 -4.085 18509 3938 1 8 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.825 -3.912 18509 3939 1 8 . 1 1 95 95 ALA H H 95 9.763 9.763 8.716 1.047 18509 3940 1 8 . 1 1 96 96 ASP N N 96 125.170 125.170 122.263 2.907 18509 3941 1 8 . 1 1 96 96 ASP C C 96 172.336 172.336 175.993 -3.657 18509 3942 1 8 . 1 1 96 96 ASP H H 96 8.515 8.515 8.633 -0.118 18509 3943 1 8 . 1 1 97 97 VAL N N 97 125.879 125.879 120.848 5.031 18509 3944 1 8 . 1 1 97 97 VAL C C 97 173.488 173.488 175.191 -1.703 18509 3945 1 8 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.687 -3.443 18509 3946 1 8 . 1 1 97 97 VAL H H 97 8.703 8.703 7.963 0.740 18509 3947 1 8 . 1 1 98 98 SER N N 98 123.017 123.017 123.287 -0.270 18509 3948 1 8 . 1 1 98 98 SER C C 98 169.715 169.715 173.809 -4.094 18509 3949 1 8 . 1 1 98 98 SER CA C 98 55.068 55.068 58.098 -3.030 18509 3950 1 8 . 1 1 98 98 SER H H 98 8.784 8.784 8.122 0.662 18509 3951 1 8 . 1 1 99 99 ILE N N 99 125.807 125.807 121.400 4.407 18509 3952 1 8 . 1 1 99 99 ILE C C 99 171.321 171.321 175.079 -3.758 18509 3953 1 8 . 1 1 99 99 ILE CA C 99 57.155 57.155 60.799 -3.644 18509 3954 1 8 . 1 1 99 99 ILE H H 99 9.411 9.411 7.919 1.492 18509 3955 1 8 . 1 1 100 100 GLU N N 100 124.068 124.068 126.365 -2.297 18509 3956 1 8 . 1 1 100 100 GLU C C 100 172.098 172.098 174.348 -2.250 18509 3957 1 8 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.855 -2.565 18509 3958 1 8 . 1 1 100 100 GLU H H 100 8.652 8.652 8.477 0.175 18509 3959 1 8 . 1 1 101 101 ASP N N 101 126.109 126.109 121.181 4.928 18509 3960 1 8 . 1 1 101 101 ASP C C 101 171.144 171.144 176.256 -5.112 18509 3961 1 8 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.653 -2.234 18509 3962 1 8 . 1 1 101 101 ASP H H 101 9.317 9.317 8.121 1.196 18509 3963 1 8 . 1 1 102 102 SER N N 102 118.470 118.470 116.376 2.094 18509 3964 1 8 . 1 1 102 102 SER C C 102 171.596 171.596 174.136 -2.540 18509 3965 1 8 . 1 1 102 102 SER CA C 102 55.245 55.245 56.671 -1.426 18509 3966 1 8 . 1 1 102 102 SER H H 102 8.933 8.933 8.216 0.717 18509 3967 1 8 . 1 1 103 103 VAL N N 103 123.179 123.179 119.853 3.326 18509 3968 1 8 . 1 1 103 103 VAL CA C 103 61.450 61.450 63.316 -1.866 18509 3969 1 8 . 1 1 103 103 VAL H H 103 8.148 8.148 9.288 -1.140 18509 3970 1 8 . 1 1 104 104 ILE C C 104 169.576 169.576 175.136 -5.560 18509 3971 1 8 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.170 0.023 18509 3972 1 8 . 1 1 105 105 SER N N 105 107.618 107.618 119.724 -12.106 18509 3973 1 8 . 1 1 105 105 SER C C 105 170.046 170.046 173.392 -3.346 18509 3974 1 8 . 1 1 105 105 SER CA C 105 52.550 52.550 58.350 -5.800 18509 3975 1 8 . 1 1 105 105 SER H H 105 6.988 6.988 8.028 -1.040 18509 3976 1 8 . 1 1 106 106 LEU N N 106 120.137 120.137 123.754 -3.617 18509 3977 1 8 . 1 1 106 106 LEU H H 106 8.313 8.313 7.935 0.378 18509 3978 1 8 . 1 1 107 107 SER C C 107 170.701 170.701 174.495 -3.794 18509 3979 1 8 . 1 1 107 107 SER CA C 107 54.540 54.540 58.969 -4.429 18509 3980 1 8 . 1 1 108 108 GLY N N 108 107.603 107.603 111.829 -4.226 18509 3981 1 8 . 1 1 108 108 GLY C C 108 173.128 173.128 173.533 -0.405 18509 3982 1 8 . 1 1 108 108 GLY CA C 108 41.287 41.287 43.981 -2.694 18509 3983 1 8 . 1 1 108 108 GLY H H 108 8.717 8.717 8.098 0.619 18509 3984 1 8 . 1 1 109 109 ASP N N 109 120.664 120.664 123.324 -2.660 18509 3985 1 8 . 1 1 109 109 ASP C C 109 171.904 171.904 175.620 -3.716 18509 3986 1 8 . 1 1 109 109 ASP H H 109 9.019 9.019 8.686 0.333 18509 3987 1 8 . 1 1 110 110 HIS N N 110 116.324 116.324 119.416 -3.092 18509 3988 1 8 . 1 1 110 110 HIS H H 110 9.283 9.283 8.780 0.503 18509 3989 1 8 . 1 1 111 111 SER N N 111 110.225 110.225 114.031 -3.806 18509 3990 1 8 . 1 1 111 111 SER CA C 111 54.681 54.681 61.589 -6.908 18509 3991 1 8 . 1 1 111 111 SER H H 111 7.156 7.156 7.755 -0.599 18509 3992 1 8 . 1 1 112 112 ILE N N 112 117.053 117.053 111.787 5.266 18509 3993 1 8 . 1 1 112 112 ILE C C 112 171.419 171.419 174.781 -3.362 18509 3994 1 8 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.781 -4.542 18509 3995 1 8 . 1 1 112 112 ILE H H 112 7.837 7.837 7.680 0.157 18509 3996 1 8 . 1 1 113 113 ILE N N 113 121.032 121.032 121.281 -0.249 18509 3997 1 8 . 1 1 113 113 ILE C C 113 173.604 173.604 175.204 -1.600 18509 3998 1 8 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.626 -2.308 18509 3999 1 8 . 1 1 113 113 ILE H H 113 7.592 7.592 7.785 -0.193 18509 4000 1 8 . 1 1 114 114 GLY N N 114 112.661 112.661 116.786 -4.125 18509 4001 1 8 . 1 1 114 114 GLY C C 114 169.739 169.739 173.095 -3.356 18509 4002 1 8 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.134 -3.224 18509 4003 1 8 . 1 1 114 114 GLY H H 114 9.575 9.575 8.210 1.365 18509 4004 1 8 . 1 1 115 115 ARG N N 115 118.398 118.398 122.125 -3.727 18509 4005 1 8 . 1 1 115 115 ARG C C 115 171.079 171.079 175.677 -4.598 18509 4006 1 8 . 1 1 115 115 ARG CA C 115 51.663 51.663 55.422 -3.759 18509 4007 1 8 . 1 1 115 115 ARG H H 115 7.464 7.464 7.568 -0.104 18509 4008 1 8 . 1 1 116 116 THR N N 116 112.218 112.218 123.618 -11.400 18509 4009 1 8 . 1 1 116 116 THR C C 116 169.821 169.821 173.614 -3.793 18509 4010 1 8 . 1 1 116 116 THR CA C 116 59.633 59.633 62.988 -3.355 18509 4011 1 8 . 1 1 116 116 THR H H 116 6.677 6.677 8.082 -1.405 18509 4012 1 8 . 1 1 117 117 LEU N N 117 129.477 129.477 129.693 -0.216 18509 4013 1 8 . 1 1 117 117 LEU C C 117 171.126 171.126 175.548 -4.422 18509 4014 1 8 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.681 -4.266 18509 4015 1 8 . 1 1 117 117 LEU H H 117 8.799 8.799 8.733 0.066 18509 4016 1 8 . 1 1 118 118 VAL N N 118 125.091 125.091 124.782 0.309 18509 4017 1 8 . 1 1 118 118 VAL C C 118 170.267 170.267 174.315 -4.048 18509 4018 1 8 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.037 -2.898 18509 4019 1 8 . 1 1 118 118 VAL H H 118 8.906 8.906 8.283 0.623 18509 4020 1 8 . 1 1 119 119 VAL N N 119 120.716 120.716 125.073 -4.357 18509 4021 1 8 . 1 1 119 119 VAL C C 119 171.175 171.175 173.492 -2.317 18509 4022 1 8 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.132 -3.861 18509 4023 1 8 . 1 1 119 119 VAL H H 119 7.982 7.982 8.230 -0.248 18509 4024 1 8 . 1 1 120 120 HIS N N 120 125.052 125.052 116.051 9.001 18509 4025 1 8 . 1 1 120 120 HIS C C 120 172.599 172.599 173.255 -0.656 18509 4026 1 8 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.251 -0.857 18509 4027 1 8 . 1 1 120 120 HIS H H 120 8.935 8.935 8.497 0.438 18509 4028 1 8 . 1 1 121 121 GLU N N 121 121.453 121.453 121.667 -0.214 18509 4029 1 8 . 1 1 121 121 GLU C C 121 172.304 172.304 175.337 -3.033 18509 4030 1 8 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.376 -0.286 18509 4031 1 8 . 1 1 121 121 GLU H H 121 9.178 9.178 8.765 0.413 18509 4032 1 8 . 1 1 122 122 LYS N N 122 115.248 115.248 120.609 -5.361 18509 4033 1 8 . 1 1 122 122 LYS C C 122 171.523 171.523 174.451 -2.928 18509 4034 1 8 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.034 -4.415 18509 4035 1 8 . 1 1 122 122 LYS H H 122 8.478 8.478 7.912 0.566 18509 4036 1 8 . 1 1 123 123 ALA N N 123 120.866 120.866 122.839 -1.973 18509 4037 1 8 . 1 1 123 123 ALA C C 123 173.219 173.219 177.308 -4.089 18509 4038 1 8 . 1 1 123 123 ALA CA C 123 48.850 48.850 53.121 -4.271 18509 4039 1 8 . 1 1 123 123 ALA H H 123 7.796 7.796 8.536 -0.740 18509 4040 1 8 . 1 1 124 124 ASP N N 124 121.799 121.799 123.516 -1.717 18509 4041 1 8 . 1 1 124 124 ASP C C 124 174.458 174.458 175.352 -0.894 18509 4042 1 8 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.276 -3.868 18509 4043 1 8 . 1 1 124 124 ASP H H 124 10.165 10.165 8.802 1.363 18509 4044 1 8 . 1 1 125 125 ASP N N 125 129.369 129.369 119.022 10.347 18509 4045 1 8 . 1 1 125 125 ASP C C 125 175.231 175.231 176.311 -1.080 18509 4046 1 8 . 1 1 125 125 ASP CA C 125 50.939 50.939 53.461 -2.522 18509 4047 1 8 . 1 1 125 125 ASP H H 125 10.055 10.055 7.942 2.113 18509 4048 1 8 . 1 1 126 126 LEU N N 126 117.190 117.190 122.806 -5.616 18509 4049 1 8 . 1 1 126 126 LEU C C 126 173.964 173.964 178.589 -4.625 18509 4050 1 8 . 1 1 126 126 LEU H H 126 10.483 10.483 8.800 1.683 18509 4051 1 8 . 1 1 127 127 GLY N N 127 103.809 103.809 104.697 -0.888 18509 4052 1 8 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.300 -3.422 18509 4053 1 8 . 1 1 127 127 GLY H H 127 8.637 8.637 8.777 -0.140 18509 4054 1 8 . 1 1 128 128 LYS N N 128 118.290 118.290 118.781 -0.491 18509 4055 1 8 . 1 1 128 128 LYS CA C 128 51.740 51.740 55.995 -4.255 18509 4056 1 8 . 1 1 128 128 LYS H H 128 7.158 7.158 7.746 -0.588 18509 4057 1 8 . 1 1 129 129 GLY N N 129 108.507 108.507 108.895 -0.388 18509 4058 1 8 . 1 1 129 129 GLY C C 129 171.524 171.524 174.440 -2.916 18509 4059 1 8 . 1 1 129 129 GLY CA C 129 42.113 42.113 44.989 -2.876 18509 4060 1 8 . 1 1 129 129 GLY H H 129 8.913 8.913 7.968 0.945 18509 4061 1 8 . 1 1 130 130 GLY N N 130 108.537 108.537 109.926 -1.389 18509 4062 1 8 . 1 1 130 130 GLY C C 130 169.994 169.994 174.076 -4.082 18509 4063 1 8 . 1 1 130 130 GLY CA C 130 42.419 42.419 45.687 -3.268 18509 4064 1 8 . 1 1 130 130 GLY H H 130 8.723 8.723 8.253 0.470 18509 4065 1 8 . 1 1 131 131 ASN N N 131 111.951 111.951 121.532 -9.581 18509 4066 1 8 . 1 1 131 131 ASN C C 131 172.236 172.236 176.484 -4.248 18509 4067 1 8 . 1 1 131 131 ASN H H 131 7.152 7.152 8.079 -0.927 18509 4068 1 8 . 1 1 132 132 GLU N N 132 120.461 120.461 122.724 -2.263 18509 4069 1 8 . 1 1 132 132 GLU C C 132 171.084 171.084 176.874 -5.790 18509 4070 1 8 . 1 1 132 132 GLU H H 132 8.935 8.935 8.805 0.130 18509 4071 1 8 . 1 1 133 133 GLU N N 133 120.137 120.137 117.848 2.289 18509 4072 1 8 . 1 1 133 133 GLU C C 133 176.239 176.239 178.812 -2.573 18509 4073 1 8 . 1 1 133 133 GLU H H 133 8.775 8.775 8.384 0.391 18509 4074 1 8 . 1 1 134 134 SER N N 134 114.981 114.981 115.862 -0.881 18509 4075 1 8 . 1 1 134 134 SER CA C 134 59.046 59.046 60.997 -1.951 18509 4076 1 8 . 1 1 134 134 SER H H 134 8.117 8.117 8.247 -0.130 18509 4077 1 8 . 1 1 135 135 THR N N 135 102.263 102.263 116.235 -13.972 18509 4078 1 8 . 1 1 135 135 THR C C 135 172.804 172.804 175.081 -2.277 18509 4079 1 8 . 1 1 135 135 THR CA C 135 60.029 60.029 63.852 -3.823 18509 4080 1 8 . 1 1 135 135 THR H H 135 7.206 7.206 8.281 -1.075 18509 4081 1 8 . 1 1 136 136 LYS N N 136 122.108 122.108 118.430 3.678 18509 4082 1 8 . 1 1 136 136 LYS H H 136 7.884 7.884 7.625 0.259 18509 4083 1 8 . 1 1 137 137 THR N N 137 105.718 105.718 109.019 -3.301 18509 4084 1 8 . 1 1 137 137 THR H H 137 8.630 8.630 7.843 0.787 18509 4085 1 8 . 1 1 138 138 GLY N N 138 111.372 111.372 111.036 0.336 18509 4086 1 8 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.012 -2.529 18509 4087 1 8 . 1 1 138 138 GLY H H 138 7.426 7.426 7.784 -0.358 18509 4088 1 8 . 1 1 139 139 ASN N N 139 107.496 107.496 121.646 -14.150 18509 4089 1 8 . 1 1 139 139 ASN H H 139 7.545 7.545 8.310 -0.765 18509 4090 1 8 . 1 1 140 140 ALA N N 140 114.542 114.542 128.235 -13.693 18509 4091 1 8 . 1 1 140 140 ALA C C 140 173.571 173.571 176.965 -3.394 18509 4092 1 8 . 1 1 140 140 ALA H H 140 6.368 6.368 7.826 -1.458 18509 4093 1 8 . 1 1 141 141 GLY N N 141 105.287 105.287 109.677 -4.390 18509 4094 1 8 . 1 1 141 141 GLY C C 141 173.542 173.542 173.683 -0.141 18509 4095 1 8 . 1 1 141 141 GLY H H 141 8.271 8.271 7.746 0.525 18509 4096 1 8 . 1 1 142 142 SER N N 142 118.771 118.771 117.669 1.102 18509 4097 1 8 . 1 1 142 142 SER C C 142 170.188 170.188 174.871 -4.683 18509 4098 1 8 . 1 1 142 142 SER H H 142 9.196 9.196 8.265 0.931 18509 4099 1 8 . 1 1 143 143 ARG N N 143 120.189 120.189 116.425 3.764 18509 4100 1 8 . 1 1 143 143 ARG C C 143 171.596 171.596 176.694 -5.098 18509 4101 1 8 . 1 1 143 143 ARG H H 143 8.943 8.943 8.029 0.914 18509 4102 1 8 . 1 1 144 144 LEU N N 144 122.907 122.907 123.802 -0.895 18509 4103 1 8 . 1 1 144 144 LEU C C 144 174.393 174.393 175.931 -1.538 18509 4104 1 8 . 1 1 144 144 LEU CA C 144 53.375 53.375 57.043 -3.668 18509 4105 1 8 . 1 1 144 144 LEU H H 144 8.395 8.395 8.094 0.301 18509 4106 1 8 . 1 1 145 145 ALA N N 145 114.159 114.159 115.722 -1.563 18509 4107 1 8 . 1 1 145 145 ALA C C 145 171.752 171.752 175.100 -3.348 18509 4108 1 8 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.257 -3.128 18509 4109 1 8 . 1 1 145 145 ALA H H 145 7.356 7.356 7.556 -0.200 18509 4110 1 8 . 1 1 146 146 CYS N N 146 110.738 110.738 120.683 -9.945 18509 4111 1 8 . 1 1 146 146 CYS C C 146 170.087 170.087 174.183 -4.096 18509 4112 1 8 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.155 -6.078 18509 4113 1 8 . 1 1 146 146 CYS H H 146 9.008 9.008 7.990 1.018 18509 4114 1 8 . 1 1 147 147 GLY N N 147 106.461 106.461 108.778 -2.317 18509 4115 1 8 . 1 1 147 147 GLY C C 147 167.909 167.909 172.388 -4.479 18509 4116 1 8 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.426 -2.752 18509 4117 1 8 . 1 1 147 147 GLY H H 147 8.018 8.018 8.068 -0.050 18509 4118 1 8 . 1 1 148 148 VAL N N 148 124.054 124.054 122.590 1.464 18509 4119 1 8 . 1 1 148 148 VAL C C 148 172.084 172.084 175.788 -3.704 18509 4120 1 8 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.394 -2.759 18509 4121 1 8 . 1 1 148 148 VAL H H 148 8.434 8.434 8.318 0.116 18509 4122 1 8 . 1 1 149 149 ILE N N 149 126.918 126.918 124.702 2.216 18509 4123 1 8 . 1 1 149 149 ILE C C 149 171.804 171.804 174.386 -2.582 18509 4124 1 8 . 1 1 149 149 ILE CA C 149 59.184 59.184 60.397 -1.213 18509 4125 1 8 . 1 1 149 149 ILE H H 149 8.613 8.613 8.692 -0.079 18509 4126 1 8 . 1 1 150 150 GLY N N 150 116.493 116.493 111.673 4.820 18509 4127 1 8 . 1 1 150 150 GLY C C 150 170.188 170.188 172.770 -2.582 18509 4128 1 8 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.008 -3.888 18509 4129 1 8 . 1 1 150 150 GLY H H 150 9.283 9.283 8.707 0.576 18509 4130 1 8 . 1 1 151 151 ILE N N 151 120.189 120.189 123.255 -3.066 18509 4131 1 8 . 1 1 151 151 ILE C C 151 172.231 172.231 174.706 -2.475 18509 4132 1 8 . 1 1 151 151 ILE CA C 151 60.372 60.372 62.920 -2.549 18509 4133 1 8 . 1 1 151 151 ILE H H 151 8.943 8.943 8.289 0.654 18509 4134 1 8 . 1 1 152 152 ALA N N 152 129.719 129.719 130.882 -1.163 18509 4135 1 8 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.782 -5.010 18509 4136 1 8 . 1 1 152 152 ALA H H 152 8.170 8.170 8.145 0.025 18509 4137 1 9 . 1 1 2 2 THR C C 2 170.139 170.139 173.958 -3.819 18509 4138 1 9 . 1 1 3 3 LYS N N 3 123.998 123.998 119.717 4.281 18509 4139 1 9 . 1 1 3 3 LYS C C 3 171.607 171.607 174.300 -2.693 18509 4140 1 9 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.782 -3.604 18509 4141 1 9 . 1 1 3 3 LYS H H 3 8.666 8.666 7.564 1.102 18509 4142 1 9 . 1 1 4 4 ALA N N 4 123.295 123.295 122.089 1.206 18509 4143 1 9 . 1 1 4 4 ALA C C 4 172.145 172.145 175.121 -2.976 18509 4144 1 9 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.885 -3.381 18509 4145 1 9 . 1 1 4 4 ALA H H 4 9.116 9.116 8.162 0.954 18509 4146 1 9 . 1 1 5 5 VAL N N 5 121.466 121.466 119.222 2.244 18509 4147 1 9 . 1 1 5 5 VAL C C 5 167.836 167.836 174.115 -6.279 18509 4148 1 9 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.187 -4.312 18509 4149 1 9 . 1 1 5 5 VAL H H 5 9.545 9.545 8.859 0.686 18509 4150 1 9 . 1 1 6 6 ALA N N 6 125.984 125.984 130.815 -4.831 18509 4151 1 9 . 1 1 6 6 ALA C C 6 171.607 171.607 175.705 -4.098 18509 4152 1 9 . 1 1 6 6 ALA CA C 6 47.471 47.471 49.993 -2.522 18509 4153 1 9 . 1 1 6 6 ALA H H 6 9.177 9.177 8.173 1.004 18509 4154 1 9 . 1 1 7 7 VAL N N 7 123.600 123.600 119.907 3.693 18509 4155 1 9 . 1 1 7 7 VAL C C 7 172.244 172.244 174.539 -2.295 18509 4156 1 9 . 1 1 7 7 VAL CA C 7 58.476 58.476 59.976 -1.500 18509 4157 1 9 . 1 1 7 7 VAL H H 7 9.116 9.116 7.885 1.231 18509 4158 1 9 . 1 1 8 8 LEU N N 8 126.455 126.455 125.334 1.121 18509 4159 1 9 . 1 1 8 8 LEU C C 8 172.557 172.557 176.125 -3.568 18509 4160 1 9 . 1 1 8 8 LEU CA C 8 51.052 51.052 54.172 -3.120 18509 4161 1 9 . 1 1 8 8 LEU H H 8 8.916 8.916 8.737 0.179 18509 4162 1 9 . 1 1 9 9 LYS N N 9 120.820 120.820 121.755 -0.935 18509 4163 1 9 . 1 1 9 9 LYS C C 9 172.509 172.509 175.231 -2.722 18509 4164 1 9 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.658 -3.761 18509 4165 1 9 . 1 1 9 9 LYS H H 9 8.315 8.315 7.978 0.337 18509 4166 1 9 . 1 1 10 10 GLY N N 10 111.249 111.249 110.905 0.344 18509 4167 1 9 . 1 1 10 10 GLY C C 10 169.847 169.847 173.314 -3.467 18509 4168 1 9 . 1 1 10 10 GLY CA C 10 42.275 42.275 44.983 -2.708 18509 4169 1 9 . 1 1 10 10 GLY H H 10 8.968 8.968 8.064 0.904 18509 4170 1 9 . 1 1 11 11 ASP N N 11 120.904 120.904 119.800 1.104 18509 4171 1 9 . 1 1 11 11 ASP C C 11 173.132 173.132 177.055 -3.923 18509 4172 1 9 . 1 1 11 11 ASP CA C 11 51.317 51.317 56.037 -4.720 18509 4173 1 9 . 1 1 11 11 ASP H H 11 8.745 8.745 8.512 0.233 18509 4174 1 9 . 1 1 12 12 GLY N N 12 109.862 109.862 109.487 0.375 18509 4175 1 9 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.311 -2.111 18509 4176 1 9 . 1 1 12 12 GLY H H 12 7.985 7.985 8.308 -0.323 18509 4177 1 9 . 1 1 13 13 PRO C C 13 173.640 173.640 175.860 -2.220 18509 4178 1 9 . 1 1 14 14 VAL N N 14 120.414 120.414 118.922 1.492 18509 4179 1 9 . 1 1 14 14 VAL C C 14 172.804 172.804 174.945 -2.141 18509 4180 1 9 . 1 1 14 14 VAL CA C 14 59.884 59.884 59.732 0.152 18509 4181 1 9 . 1 1 14 14 VAL H H 14 7.476 7.476 8.055 -0.579 18509 4182 1 9 . 1 1 15 15 GLN N N 15 122.664 122.664 126.521 -3.857 18509 4183 1 9 . 1 1 15 15 GLN C C 15 171.168 171.168 175.003 -3.835 18509 4184 1 9 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.480 -3.801 18509 4185 1 9 . 1 1 15 15 GLN H H 15 7.938 7.938 8.100 -0.162 18509 4186 1 9 . 1 1 16 16 GLY N N 16 107.018 107.018 110.338 -3.320 18509 4187 1 9 . 1 1 16 16 GLY C C 16 167.726 167.726 171.797 -4.071 18509 4188 1 9 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.431 -1.806 18509 4189 1 9 . 1 1 16 16 GLY H H 16 8.288 8.288 8.192 0.096 18509 4190 1 9 . 1 1 17 17 ILE N N 17 120.248 120.248 115.691 4.557 18509 4191 1 9 . 1 1 17 17 ILE C C 17 171.194 171.194 174.179 -2.985 18509 4192 1 9 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.225 -0.728 18509 4193 1 9 . 1 1 17 17 ILE H H 17 7.948 7.948 7.816 0.132 18509 4194 1 9 . 1 1 18 18 ILE N N 18 125.851 125.851 125.932 -0.081 18509 4195 1 9 . 1 1 18 18 ILE C C 18 168.889 168.889 174.983 -6.094 18509 4196 1 9 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.156 -5.725 18509 4197 1 9 . 1 1 18 18 ILE H H 18 8.725 8.725 7.866 0.859 18509 4198 1 9 . 1 1 19 19 ASN N N 19 123.256 123.256 121.538 1.718 18509 4199 1 9 . 1 1 19 19 ASN C C 19 168.903 168.903 173.400 -4.497 18509 4200 1 9 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.833 -2.745 18509 4201 1 9 . 1 1 19 19 ASN H H 19 8.727 8.727 7.899 0.828 18509 4202 1 9 . 1 1 20 20 PHE N N 20 113.849 113.849 118.675 -4.826 18509 4203 1 9 . 1 1 20 20 PHE C C 20 173.219 173.219 174.162 -0.943 18509 4204 1 9 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.238 -5.180 18509 4205 1 9 . 1 1 20 20 PHE H H 20 8.399 8.399 8.347 0.052 18509 4206 1 9 . 1 1 21 21 GLU N N 21 121.454 121.454 123.477 -2.023 18509 4207 1 9 . 1 1 21 21 GLU C C 21 170.280 170.280 174.480 -4.200 18509 4208 1 9 . 1 1 21 21 GLU CA C 21 53.044 53.044 55.556 -2.512 18509 4209 1 9 . 1 1 21 21 GLU H H 21 9.526 9.526 8.553 0.973 18509 4210 1 9 . 1 1 22 22 GLN N N 22 130.340 130.340 120.926 9.414 18509 4211 1 9 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.241 -3.061 18509 4212 1 9 . 1 1 22 22 GLN H H 22 9.305 9.305 8.501 0.804 18509 4213 1 9 . 1 1 23 23 LYS N N 23 128.657 128.657 125.132 3.525 18509 4214 1 9 . 1 1 23 23 LYS CA C 23 57.241 57.241 54.816 2.425 18509 4215 1 9 . 1 1 23 23 LYS H H 23 9.088 9.088 8.187 0.901 18509 4216 1 9 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.528 -7.136 18509 4217 1 9 . 1 1 25 25 SER CA C 25 58.078 58.078 59.073 -0.995 18509 4218 1 9 . 1 1 27 27 GLY N N 27 108.125 108.125 110.858 -2.733 18509 4219 1 9 . 1 1 27 27 GLY CA C 27 42.925 42.925 45.170 -2.245 18509 4220 1 9 . 1 1 27 27 GLY H H 27 8.032 8.032 7.966 0.066 18509 4221 1 9 . 1 1 28 28 PRO C C 28 173.128 173.128 176.390 -3.262 18509 4222 1 9 . 1 1 29 29 VAL N N 29 121.267 121.267 125.149 -3.882 18509 4223 1 9 . 1 1 29 29 VAL C C 29 172.198 172.198 175.118 -2.920 18509 4224 1 9 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.580 -3.860 18509 4225 1 9 . 1 1 29 29 VAL H H 29 9.089 9.089 7.707 1.382 18509 4226 1 9 . 1 1 30 30 LYS N N 30 127.589 127.589 126.544 1.045 18509 4227 1 9 . 1 1 30 30 LYS C C 30 172.098 172.098 176.016 -3.918 18509 4228 1 9 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.659 -3.017 18509 4229 1 9 . 1 1 30 30 LYS H H 30 9.200 9.200 8.424 0.776 18509 4230 1 9 . 1 1 31 31 VAL N N 31 126.037 126.037 119.852 6.185 18509 4231 1 9 . 1 1 31 31 VAL C C 31 172.244 172.244 173.799 -1.555 18509 4232 1 9 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.466 -2.327 18509 4233 1 9 . 1 1 31 31 VAL H H 31 9.282 9.282 8.845 0.437 18509 4234 1 9 . 1 1 32 32 TRP N N 32 125.414 125.414 119.578 5.836 18509 4235 1 9 . 1 1 32 32 TRP C C 32 170.156 170.156 174.662 -4.506 18509 4236 1 9 . 1 1 32 32 TRP CA C 32 53.137 53.137 54.785 -1.648 18509 4237 1 9 . 1 1 32 32 TRP H H 32 8.983 8.983 7.425 1.558 18509 4238 1 9 . 1 1 33 33 GLY N N 33 107.848 107.848 107.954 -0.106 18509 4239 1 9 . 1 1 33 33 GLY C C 33 168.400 168.400 172.204 -3.804 18509 4240 1 9 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.178 -3.611 18509 4241 1 9 . 1 1 33 33 GLY H H 33 8.360 8.360 8.114 0.246 18509 4242 1 9 . 1 1 34 34 SER N N 34 114.377 114.377 118.328 -3.951 18509 4243 1 9 . 1 1 34 34 SER C C 34 169.618 169.618 174.300 -4.682 18509 4244 1 9 . 1 1 34 34 SER CA C 34 53.875 53.875 56.474 -2.599 18509 4245 1 9 . 1 1 34 34 SER H H 34 7.838 7.838 8.187 -0.349 18509 4246 1 9 . 1 1 35 35 ILE N N 35 123.149 123.149 119.140 4.009 18509 4247 1 9 . 1 1 35 35 ILE C C 35 169.713 169.713 174.616 -4.903 18509 4248 1 9 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.512 -2.743 18509 4249 1 9 . 1 1 35 35 ILE H H 35 8.496 8.496 8.834 -0.338 18509 4250 1 9 . 1 1 36 36 LYS N N 36 123.803 123.803 126.102 -2.299 18509 4251 1 9 . 1 1 36 36 LYS C C 36 172.260 172.260 175.909 -3.649 18509 4252 1 9 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.407 -3.257 18509 4253 1 9 . 1 1 36 36 LYS H H 36 9.091 9.091 7.970 1.121 18509 4254 1 9 . 1 1 37 37 GLY N N 37 105.495 105.495 108.828 -3.333 18509 4255 1 9 . 1 1 37 37 GLY C C 37 171.641 171.641 172.198 -0.557 18509 4256 1 9 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.839 -1.478 18509 4257 1 9 . 1 1 37 37 GLY H H 37 8.237 8.237 8.329 -0.092 18509 4258 1 9 . 1 1 38 38 LEU N N 38 120.966 120.966 118.537 2.429 18509 4259 1 9 . 1 1 38 38 LEU C C 38 174.112 174.112 177.667 -3.555 18509 4260 1 9 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.559 -4.088 18509 4261 1 9 . 1 1 38 38 LEU H H 38 8.156 8.156 7.930 0.226 18509 4262 1 9 . 1 1 39 39 THR N N 39 110.363 110.363 115.900 -5.537 18509 4263 1 9 . 1 1 39 39 THR C C 39 173.102 173.102 173.837 -0.735 18509 4264 1 9 . 1 1 39 39 THR CA C 39 58.194 58.194 63.563 -5.369 18509 4265 1 9 . 1 1 39 39 THR H H 39 8.660 8.660 8.334 0.326 18509 4266 1 9 . 1 1 40 40 GLU N N 40 125.818 125.818 125.577 0.241 18509 4267 1 9 . 1 1 40 40 GLU C C 40 173.134 173.134 174.476 -1.342 18509 4268 1 9 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.489 -1.133 18509 4269 1 9 . 1 1 40 40 GLU H H 40 8.804 8.804 7.967 0.837 18509 4270 1 9 . 1 1 41 41 GLY N N 41 113.875 113.875 108.341 5.534 18509 4271 1 9 . 1 1 41 41 GLY C C 41 170.046 170.046 172.928 -2.882 18509 4272 1 9 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.449 -4.395 18509 4273 1 9 . 1 1 41 41 GLY H H 41 8.763 8.763 8.446 0.317 18509 4274 1 9 . 1 1 42 42 LEU N N 42 120.137 120.137 112.466 7.671 18509 4275 1 9 . 1 1 42 42 LEU C C 42 174.218 174.218 174.735 -0.517 18509 4276 1 9 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.023 -1.868 18509 4277 1 9 . 1 1 42 42 LEU H H 42 8.313 8.313 7.708 0.605 18509 4278 1 9 . 1 1 43 43 HIS N N 43 114.385 114.385 118.521 -4.136 18509 4279 1 9 . 1 1 43 43 HIS C C 43 171.504 171.504 175.837 -4.333 18509 4280 1 9 . 1 1 43 43 HIS CA C 43 50.985 50.985 54.677 -3.692 18509 4281 1 9 . 1 1 43 43 HIS H H 43 8.712 8.712 8.536 0.176 18509 4282 1 9 . 1 1 44 44 GLY N N 44 108.872 108.872 109.243 -0.371 18509 4283 1 9 . 1 1 44 44 GLY C C 44 168.656 168.656 174.420 -5.764 18509 4284 1 9 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.880 -1.685 18509 4285 1 9 . 1 1 44 44 GLY H H 44 8.875 8.875 7.996 0.879 18509 4286 1 9 . 1 1 45 45 PHE N N 45 126.439 126.439 123.582 2.857 18509 4287 1 9 . 1 1 45 45 PHE CA C 45 53.098 53.098 56.218 -3.120 18509 4288 1 9 . 1 1 45 45 PHE H H 45 8.111 8.111 7.588 0.523 18509 4289 1 9 . 1 1 46 46 HIS N N 46 115.353 115.353 120.380 -5.027 18509 4290 1 9 . 1 1 46 46 HIS C C 46 172.415 172.415 174.249 -1.834 18509 4291 1 9 . 1 1 46 46 HIS CA C 46 49.206 49.206 55.325 -6.119 18509 4292 1 9 . 1 1 46 46 HIS H H 46 8.107 8.107 9.267 -1.160 18509 4293 1 9 . 1 1 47 47 VAL N N 47 120.548 120.548 118.977 1.571 18509 4294 1 9 . 1 1 47 47 VAL C C 47 173.900 173.900 174.289 -0.389 18509 4295 1 9 . 1 1 47 47 VAL CA C 47 58.792 58.792 59.599 -0.807 18509 4296 1 9 . 1 1 47 47 VAL H H 47 9.366 9.366 8.263 1.103 18509 4297 1 9 . 1 1 48 48 HIS N N 48 129.236 129.236 122.127 7.109 18509 4298 1 9 . 1 1 48 48 HIS C C 48 171.084 171.084 174.787 -3.703 18509 4299 1 9 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.466 -1.710 18509 4300 1 9 . 1 1 48 48 HIS H H 48 10.210 10.210 8.708 1.502 18509 4301 1 9 . 1 1 49 49 GLU N N 49 118.119 118.119 128.339 -10.220 18509 4302 1 9 . 1 1 49 49 GLU C C 49 171.635 171.635 174.704 -3.069 18509 4303 1 9 . 1 1 49 49 GLU CA C 49 57.759 57.759 54.712 3.047 18509 4304 1 9 . 1 1 49 49 GLU H H 49 8.492 8.492 8.956 -0.464 18509 4305 1 9 . 1 1 50 50 PHE N N 50 110.329 110.329 118.265 -7.936 18509 4306 1 9 . 1 1 50 50 PHE C C 50 175.252 175.252 175.040 0.212 18509 4307 1 9 . 1 1 50 50 PHE CA C 50 52.900 52.900 56.305 -3.405 18509 4308 1 9 . 1 1 50 50 PHE H H 50 8.580 8.580 7.190 1.390 18509 4309 1 9 . 1 1 51 51 GLY N N 51 119.251 119.251 108.825 10.426 18509 4310 1 9 . 1 1 51 51 GLY C C 51 168.248 168.248 172.966 -4.718 18509 4311 1 9 . 1 1 51 51 GLY H H 51 10.208 10.208 7.409 2.799 18509 4312 1 9 . 1 1 52 52 ASP N N 52 114.958 114.958 123.223 -8.265 18509 4313 1 9 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.411 -5.520 18509 4314 1 9 . 1 1 52 52 ASP H H 52 5.834 5.834 8.386 -2.552 18509 4315 1 9 . 1 1 53 53 ASN N N 53 128.224 128.224 116.032 12.192 18509 4316 1 9 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.901 -4.668 18509 4317 1 9 . 1 1 53 53 ASN H H 53 9.360 9.360 8.069 1.291 18509 4318 1 9 . 1 1 54 54 THR C C 54 168.656 168.656 173.842 -5.186 18509 4319 1 9 . 1 1 55 55 ALA N N 55 126.661 126.661 119.148 7.513 18509 4320 1 9 . 1 1 55 55 ALA C C 55 174.185 174.185 175.628 -1.443 18509 4321 1 9 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.532 -5.377 18509 4322 1 9 . 1 1 55 55 ALA H H 55 8.390 8.390 7.978 0.412 18509 4323 1 9 . 1 1 56 56 GLY N N 56 107.903 107.903 104.864 3.039 18509 4324 1 9 . 1 1 56 56 GLY C C 56 171.578 171.578 172.278 -0.700 18509 4325 1 9 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.562 -2.982 18509 4326 1 9 . 1 1 56 56 GLY H H 56 7.282 7.282 7.610 -0.328 18509 4327 1 9 . 1 1 57 57 CYS N N 57 117.952 117.952 120.814 -2.862 18509 4328 1 9 . 1 1 57 57 CYS C C 57 175.209 175.209 175.318 -0.109 18509 4329 1 9 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.668 -7.580 18509 4330 1 9 . 1 1 57 57 CYS H H 57 8.900 8.900 8.401 0.499 18509 4331 1 9 . 1 1 58 58 THR N N 58 119.852 119.852 121.703 -1.851 18509 4332 1 9 . 1 1 58 58 THR CA C 58 58.239 58.239 65.253 -7.014 18509 4333 1 9 . 1 1 58 58 THR H H 58 8.505 8.505 8.725 -0.220 18509 4334 1 9 . 1 1 59 59 SER C C 59 170.763 170.763 174.781 -4.018 18509 4335 1 9 . 1 1 59 59 SER CA C 59 55.609 55.609 60.623 -5.014 18509 4336 1 9 . 1 1 60 60 ALA N N 60 119.753 119.753 121.996 -2.243 18509 4337 1 9 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.812 -2.872 18509 4338 1 9 . 1 1 60 60 ALA H H 60 6.898 6.898 7.503 -0.605 18509 4339 1 9 . 1 1 61 61 GLY N N 61 101.351 101.351 108.489 -7.138 18509 4340 1 9 . 1 1 61 61 GLY CA C 61 42.805 42.805 46.804 -3.999 18509 4341 1 9 . 1 1 61 61 GLY H H 61 7.730 7.730 8.135 -0.405 18509 4342 1 9 . 1 1 62 62 PRO C C 62 172.276 172.276 175.856 -3.580 18509 4343 1 9 . 1 1 63 63 HIS N N 63 115.023 115.023 118.565 -3.542 18509 4344 1 9 . 1 1 63 63 HIS CA C 63 52.119 52.119 55.662 -3.543 18509 4345 1 9 . 1 1 63 63 HIS H H 63 7.474 7.474 7.518 -0.044 18509 4346 1 9 . 1 1 64 64 PHE C C 64 171.731 171.731 173.120 -1.389 18509 4347 1 9 . 1 1 65 65 ASN N N 65 126.978 126.978 118.167 8.811 18509 4348 1 9 . 1 1 65 65 ASN CA C 65 47.753 47.753 48.918 -1.165 18509 4349 1 9 . 1 1 65 65 ASN H H 65 9.426 9.426 8.575 0.851 18509 4350 1 9 . 1 1 67 67 LEU N N 67 117.937 117.937 116.898 1.039 18509 4351 1 9 . 1 1 67 67 LEU C C 67 172.580 172.580 177.301 -4.721 18509 4352 1 9 . 1 1 67 67 LEU CA C 67 50.911 50.911 56.250 -5.339 18509 4353 1 9 . 1 1 67 67 LEU H H 67 7.720 7.720 7.809 -0.089 18509 4354 1 9 . 1 1 68 68 SER N N 68 110.842 110.842 113.317 -2.475 18509 4355 1 9 . 1 1 68 68 SER CA C 68 55.953 55.953 60.312 -4.359 18509 4356 1 9 . 1 1 68 68 SER H H 68 7.428 7.428 7.438 -0.010 18509 4357 1 9 . 1 1 69 69 ARG N N 69 120.782 120.782 120.712 0.070 18509 4358 1 9 . 1 1 69 69 ARG C C 69 173.381 173.381 175.314 -1.933 18509 4359 1 9 . 1 1 69 69 ARG CA C 69 50.543 50.543 54.505 -3.962 18509 4360 1 9 . 1 1 69 69 ARG H H 69 8.508 8.508 8.503 0.005 18509 4361 1 9 . 1 1 70 70 LYS N N 70 118.055 118.055 117.591 0.464 18509 4362 1 9 . 1 1 70 70 LYS C C 70 169.994 169.994 174.643 -4.649 18509 4363 1 9 . 1 1 70 70 LYS CA C 70 52.596 52.596 57.581 -4.986 18509 4364 1 9 . 1 1 70 70 LYS H H 70 8.745 8.745 8.003 0.742 18509 4365 1 9 . 1 1 71 71 HIS N N 71 111.871 111.871 118.475 -6.604 18509 4366 1 9 . 1 1 71 71 HIS C C 71 171.534 171.534 174.889 -3.355 18509 4367 1 9 . 1 1 71 71 HIS CA C 71 52.549 52.549 55.192 -2.643 18509 4368 1 9 . 1 1 71 71 HIS H H 71 7.152 7.152 8.352 -1.200 18509 4369 1 9 . 1 1 72 72 GLY N N 72 112.910 112.910 111.435 1.475 18509 4370 1 9 . 1 1 72 72 GLY C C 72 168.634 168.634 173.226 -4.592 18509 4371 1 9 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.703 -3.429 18509 4372 1 9 . 1 1 72 72 GLY H H 72 7.209 7.209 8.077 -0.868 18509 4373 1 9 . 1 1 73 73 GLY N N 73 105.207 105.207 109.711 -4.504 18509 4374 1 9 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.519 -3.298 18509 4375 1 9 . 1 1 73 73 GLY H H 73 8.789 8.789 8.686 0.103 18509 4376 1 9 . 1 1 74 74 PRO C C 74 175.753 175.753 177.292 -1.539 18509 4377 1 9 . 1 1 75 75 LYS N N 75 114.868 114.868 119.919 -5.051 18509 4378 1 9 . 1 1 75 75 LYS C C 75 173.640 173.640 175.490 -1.850 18509 4379 1 9 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.565 -5.462 18509 4380 1 9 . 1 1 75 75 LYS H H 75 8.651 8.651 8.101 0.550 18509 4381 1 9 . 1 1 76 76 ASP N N 76 120.414 120.414 118.487 1.927 18509 4382 1 9 . 1 1 76 76 ASP C C 76 172.557 172.557 174.558 -2.001 18509 4383 1 9 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.482 -3.173 18509 4384 1 9 . 1 1 76 76 ASP H H 76 7.461 7.461 8.017 -0.556 18509 4385 1 9 . 1 1 77 77 GLU N N 77 120.820 120.820 115.807 5.013 18509 4386 1 9 . 1 1 77 77 GLU C C 77 174.101 174.101 175.269 -1.168 18509 4387 1 9 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.950 -2.437 18509 4388 1 9 . 1 1 77 77 GLU H H 77 8.315 8.315 8.077 0.238 18509 4389 1 9 . 1 1 78 78 GLU N N 78 119.251 119.251 115.421 3.830 18509 4390 1 9 . 1 1 78 78 GLU C C 78 168.285 168.285 176.244 -7.959 18509 4391 1 9 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.302 -5.224 18509 4392 1 9 . 1 1 78 78 GLU H H 78 8.109 8.109 8.307 -0.198 18509 4393 1 9 . 1 1 79 79 ARG N N 79 118.991 118.991 116.398 2.593 18509 4394 1 9 . 1 1 79 79 ARG C C 79 172.123 172.123 175.712 -3.589 18509 4395 1 9 . 1 1 79 79 ARG CA C 79 51.074 51.074 58.106 -7.032 18509 4396 1 9 . 1 1 79 79 ARG H H 79 6.999 6.999 7.618 -0.619 18509 4397 1 9 . 1 1 80 80 HIS N N 80 118.000 118.000 111.025 6.975 18509 4398 1 9 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.005 -6.052 18509 4399 1 9 . 1 1 80 80 HIS H H 80 8.355 8.355 7.501 0.854 18509 4400 1 9 . 1 1 81 81 VAL C C 81 173.460 173.460 176.228 -2.768 18509 4401 1 9 . 1 1 82 82 GLY N N 82 97.322 97.322 107.244 -9.922 18509 4402 1 9 . 1 1 82 82 GLY C C 82 170.370 170.370 171.978 -1.608 18509 4403 1 9 . 1 1 82 82 GLY CA C 82 42.688 42.688 44.752 -2.064 18509 4404 1 9 . 1 1 82 82 GLY H H 82 8.487 8.487 7.383 1.104 18509 4405 1 9 . 1 1 83 83 ASP N N 83 120.890 120.890 122.823 -1.933 18509 4406 1 9 . 1 1 83 83 ASP C C 83 168.737 168.737 175.713 -6.976 18509 4407 1 9 . 1 1 83 83 ASP CA C 83 52.918 52.918 54.629 -1.711 18509 4408 1 9 . 1 1 83 83 ASP H H 83 7.127 7.127 8.239 -1.112 18509 4409 1 9 . 1 1 84 84 LEU N N 84 120.154 120.154 127.630 -7.476 18509 4410 1 9 . 1 1 84 84 LEU C C 84 173.212 173.212 175.258 -2.046 18509 4411 1 9 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.728 -4.295 18509 4412 1 9 . 1 1 84 84 LEU H H 84 7.128 7.128 7.806 -0.678 18509 4413 1 9 . 1 1 85 85 GLY N N 85 106.867 106.867 112.597 -5.730 18509 4414 1 9 . 1 1 85 85 GLY C C 85 167.654 167.654 171.786 -4.132 18509 4415 1 9 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.141 -1.130 18509 4416 1 9 . 1 1 85 85 GLY H H 85 8.260 8.260 7.050 1.210 18509 4417 1 9 . 1 1 86 86 ASN N N 86 117.454 117.454 120.159 -2.705 18509 4418 1 9 . 1 1 86 86 ASN C C 86 173.942 173.942 174.200 -0.258 18509 4419 1 9 . 1 1 86 86 ASN CA C 86 49.266 49.266 51.958 -2.692 18509 4420 1 9 . 1 1 86 86 ASN H H 86 8.041 8.041 8.483 -0.442 18509 4421 1 9 . 1 1 87 87 VAL N N 87 113.370 113.370 117.947 -4.577 18509 4422 1 9 . 1 1 87 87 VAL C C 87 171.526 171.526 174.232 -2.706 18509 4423 1 9 . 1 1 87 87 VAL CA C 87 55.708 55.708 59.869 -4.161 18509 4424 1 9 . 1 1 87 87 VAL H H 87 8.960 8.960 8.378 0.582 18509 4425 1 9 . 1 1 88 88 THR N N 88 117.939 117.939 113.145 4.794 18509 4426 1 9 . 1 1 88 88 THR C C 88 170.367 170.367 173.517 -3.150 18509 4427 1 9 . 1 1 88 88 THR CA C 88 58.694 58.694 60.723 -2.029 18509 4428 1 9 . 1 1 88 88 THR H H 88 8.681 8.681 8.440 0.241 18509 4429 1 9 . 1 1 89 89 ALA N N 89 128.674 128.674 127.906 0.768 18509 4430 1 9 . 1 1 89 89 ALA C C 89 174.480 174.480 175.805 -1.325 18509 4431 1 9 . 1 1 89 89 ALA CA C 89 46.369 46.369 51.360 -4.991 18509 4432 1 9 . 1 1 89 89 ALA H H 89 9.377 9.377 8.231 1.146 18509 4433 1 9 . 1 1 90 90 ASP N N 90 124.235 124.235 119.637 4.598 18509 4434 1 9 . 1 1 90 90 ASP C C 90 173.825 173.825 177.466 -3.641 18509 4435 1 9 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.920 -3.573 18509 4436 1 9 . 1 1 90 90 ASP H H 90 8.455 8.455 8.045 0.410 18509 4437 1 9 . 1 1 91 91 LYS N N 91 114.942 114.942 119.677 -4.735 18509 4438 1 9 . 1 1 91 91 LYS C C 91 174.101 174.101 176.389 -2.288 18509 4439 1 9 . 1 1 91 91 LYS CA C 91 55.279 55.279 59.404 -4.125 18509 4440 1 9 . 1 1 91 91 LYS H H 91 8.231 8.231 8.480 -0.249 18509 4441 1 9 . 1 1 92 92 ASP N N 92 119.251 119.251 113.959 5.292 18509 4442 1 9 . 1 1 92 92 ASP C C 92 173.020 173.020 176.358 -3.338 18509 4443 1 9 . 1 1 92 92 ASP CA C 92 51.127 51.127 52.905 -1.778 18509 4444 1 9 . 1 1 92 92 ASP H H 92 8.109 8.109 8.111 -0.002 18509 4445 1 9 . 1 1 93 93 GLY N N 93 110.868 110.868 108.735 2.133 18509 4446 1 9 . 1 1 93 93 GLY C C 93 169.706 169.706 173.035 -3.329 18509 4447 1 9 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.446 -1.683 18509 4448 1 9 . 1 1 93 93 GLY H H 93 8.405 8.405 7.801 0.604 18509 4449 1 9 . 1 1 94 94 VAL N N 94 118.755 118.755 113.211 5.544 18509 4450 1 9 . 1 1 94 94 VAL C C 94 173.510 173.510 174.867 -1.357 18509 4451 1 9 . 1 1 94 94 VAL CA C 94 58.185 58.185 59.541 -1.356 18509 4452 1 9 . 1 1 94 94 VAL H H 94 7.814 7.814 8.108 -0.294 18509 4453 1 9 . 1 1 95 95 ALA N N 95 131.313 131.313 128.555 2.758 18509 4454 1 9 . 1 1 95 95 ALA C C 95 171.635 171.635 175.896 -4.261 18509 4455 1 9 . 1 1 95 95 ALA CA C 95 46.914 46.914 51.117 -4.202 18509 4456 1 9 . 1 1 95 95 ALA H H 95 9.763 9.763 9.103 0.660 18509 4457 1 9 . 1 1 96 96 ASP N N 96 125.170 125.170 126.939 -1.769 18509 4458 1 9 . 1 1 96 96 ASP C C 96 172.336 172.336 175.404 -3.068 18509 4459 1 9 . 1 1 96 96 ASP H H 96 8.515 8.515 8.193 0.322 18509 4460 1 9 . 1 1 97 97 VAL N N 97 125.879 125.879 123.523 2.356 18509 4461 1 9 . 1 1 97 97 VAL C C 97 173.488 173.488 174.905 -1.417 18509 4462 1 9 . 1 1 97 97 VAL CA C 97 58.243 58.243 60.721 -2.478 18509 4463 1 9 . 1 1 97 97 VAL H H 97 8.703 8.703 7.816 0.887 18509 4464 1 9 . 1 1 98 98 SER N N 98 123.017 123.017 120.840 2.177 18509 4465 1 9 . 1 1 98 98 SER C C 98 169.715 169.715 174.210 -4.495 18509 4466 1 9 . 1 1 98 98 SER CA C 98 55.068 55.068 57.467 -2.399 18509 4467 1 9 . 1 1 98 98 SER H H 98 8.784 8.784 8.545 0.239 18509 4468 1 9 . 1 1 99 99 ILE N N 99 125.807 125.807 120.887 4.920 18509 4469 1 9 . 1 1 99 99 ILE C C 99 171.321 171.321 173.840 -2.519 18509 4470 1 9 . 1 1 99 99 ILE CA C 99 57.155 57.155 59.678 -2.523 18509 4471 1 9 . 1 1 99 99 ILE H H 99 9.411 9.411 8.904 0.507 18509 4472 1 9 . 1 1 100 100 GLU N N 100 124.068 124.068 122.542 1.526 18509 4473 1 9 . 1 1 100 100 GLU C C 100 172.098 172.098 174.748 -2.650 18509 4474 1 9 . 1 1 100 100 GLU CA C 100 52.290 52.290 55.232 -2.942 18509 4475 1 9 . 1 1 100 100 GLU H H 100 8.652 8.652 8.533 0.119 18509 4476 1 9 . 1 1 101 101 ASP N N 101 126.109 126.109 124.124 1.985 18509 4477 1 9 . 1 1 101 101 ASP C C 101 171.144 171.144 174.859 -3.715 18509 4478 1 9 . 1 1 101 101 ASP CA C 101 51.419 51.419 54.002 -2.583 18509 4479 1 9 . 1 1 101 101 ASP H H 101 9.317 9.317 8.465 0.852 18509 4480 1 9 . 1 1 102 102 SER N N 102 118.470 118.470 118.607 -0.137 18509 4481 1 9 . 1 1 102 102 SER C C 102 171.596 171.596 173.438 -1.842 18509 4482 1 9 . 1 1 102 102 SER CA C 102 55.245 55.245 58.651 -3.406 18509 4483 1 9 . 1 1 102 102 SER H H 102 8.933 8.933 8.671 0.262 18509 4484 1 9 . 1 1 103 103 VAL N N 103 123.179 123.179 123.452 -0.273 18509 4485 1 9 . 1 1 103 103 VAL CA C 103 61.450 61.450 61.582 -0.132 18509 4486 1 9 . 1 1 103 103 VAL H H 103 8.148 8.148 7.765 0.383 18509 4487 1 9 . 1 1 104 104 ILE C C 104 169.576 169.576 175.870 -6.294 18509 4488 1 9 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.237 -0.043 18509 4489 1 9 . 1 1 105 105 SER N N 105 107.618 107.618 117.200 -9.582 18509 4490 1 9 . 1 1 105 105 SER C C 105 170.046 170.046 174.265 -4.219 18509 4491 1 9 . 1 1 105 105 SER CA C 105 52.550 52.550 58.826 -6.276 18509 4492 1 9 . 1 1 105 105 SER H H 105 6.988 6.988 7.855 -0.867 18509 4493 1 9 . 1 1 106 106 LEU N N 106 120.137 120.137 130.481 -10.344 18509 4494 1 9 . 1 1 106 106 LEU H H 106 8.313 8.313 8.731 -0.418 18509 4495 1 9 . 1 1 107 107 SER C C 107 170.701 170.701 173.592 -2.891 18509 4496 1 9 . 1 1 107 107 SER CA C 107 54.540 54.540 56.883 -2.343 18509 4497 1 9 . 1 1 108 108 GLY N N 108 107.603 107.603 113.054 -5.451 18509 4498 1 9 . 1 1 108 108 GLY C C 108 173.128 173.128 173.689 -0.561 18509 4499 1 9 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.050 -2.763 18509 4500 1 9 . 1 1 108 108 GLY H H 108 8.717 8.717 7.576 1.141 18509 4501 1 9 . 1 1 109 109 ASP N N 109 120.664 120.664 120.637 0.027 18509 4502 1 9 . 1 1 109 109 ASP C C 109 171.904 171.904 177.060 -5.156 18509 4503 1 9 . 1 1 109 109 ASP H H 109 9.019 9.019 8.863 0.156 18509 4504 1 9 . 1 1 110 110 HIS N N 110 116.324 116.324 115.027 1.297 18509 4505 1 9 . 1 1 110 110 HIS H H 110 9.283 9.283 8.112 1.171 18509 4506 1 9 . 1 1 111 111 SER N N 111 110.225 110.225 113.852 -3.627 18509 4507 1 9 . 1 1 111 111 SER CA C 111 54.681 54.681 57.553 -2.872 18509 4508 1 9 . 1 1 111 111 SER H H 111 7.156 7.156 7.934 -0.778 18509 4509 1 9 . 1 1 112 112 ILE N N 112 117.053 117.053 120.074 -3.021 18509 4510 1 9 . 1 1 112 112 ILE C C 112 171.419 171.419 176.148 -4.729 18509 4511 1 9 . 1 1 112 112 ILE CA C 112 57.239 57.239 62.387 -5.148 18509 4512 1 9 . 1 1 112 112 ILE H H 112 7.837 7.837 8.093 -0.256 18509 4513 1 9 . 1 1 113 113 ILE N N 113 121.032 121.032 120.756 0.276 18509 4514 1 9 . 1 1 113 113 ILE C C 113 173.604 173.604 176.689 -3.085 18509 4515 1 9 . 1 1 113 113 ILE CA C 113 58.318 58.318 61.615 -3.297 18509 4516 1 9 . 1 1 113 113 ILE H H 113 7.592 7.592 7.719 -0.127 18509 4517 1 9 . 1 1 114 114 GLY N N 114 112.661 112.661 117.751 -5.090 18509 4518 1 9 . 1 1 114 114 GLY C C 114 169.739 169.739 173.890 -4.151 18509 4519 1 9 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.034 -3.124 18509 4520 1 9 . 1 1 114 114 GLY H H 114 9.575 9.575 8.872 0.703 18509 4521 1 9 . 1 1 115 115 ARG N N 115 118.398 118.398 120.939 -2.541 18509 4522 1 9 . 1 1 115 115 ARG C C 115 171.079 171.079 175.055 -3.976 18509 4523 1 9 . 1 1 115 115 ARG CA C 115 51.663 51.663 52.907 -1.244 18509 4524 1 9 . 1 1 115 115 ARG H H 115 7.464 7.464 7.386 0.078 18509 4525 1 9 . 1 1 116 116 THR N N 116 112.218 112.218 112.972 -0.754 18509 4526 1 9 . 1 1 116 116 THR C C 116 169.821 169.821 174.990 -5.169 18509 4527 1 9 . 1 1 116 116 THR CA C 116 59.633 59.633 60.005 -0.372 18509 4528 1 9 . 1 1 116 116 THR H H 116 6.677 6.677 8.202 -1.525 18509 4529 1 9 . 1 1 117 117 LEU N N 117 129.477 129.477 122.598 6.879 18509 4530 1 9 . 1 1 117 117 LEU C C 117 171.126 171.126 174.964 -3.838 18509 4531 1 9 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.200 -3.785 18509 4532 1 9 . 1 1 117 117 LEU H H 117 8.799 8.799 8.656 0.142 18509 4533 1 9 . 1 1 118 118 VAL N N 118 125.091 125.091 124.771 0.320 18509 4534 1 9 . 1 1 118 118 VAL C C 118 170.267 170.267 175.846 -5.579 18509 4535 1 9 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.836 -3.696 18509 4536 1 9 . 1 1 118 118 VAL H H 118 8.906 8.906 8.539 0.367 18509 4537 1 9 . 1 1 119 119 VAL N N 119 120.716 120.716 121.431 -0.715 18509 4538 1 9 . 1 1 119 119 VAL C C 119 171.175 171.175 173.524 -2.349 18509 4539 1 9 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.418 -4.147 18509 4540 1 9 . 1 1 119 119 VAL H H 119 7.982 7.982 8.480 -0.498 18509 4541 1 9 . 1 1 120 120 HIS N N 120 125.052 125.052 119.317 5.735 18509 4542 1 9 . 1 1 120 120 HIS C C 120 172.599 172.599 173.614 -1.015 18509 4543 1 9 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.300 -1.906 18509 4544 1 9 . 1 1 120 120 HIS H H 120 8.935 8.935 8.622 0.313 18509 4545 1 9 . 1 1 121 121 GLU N N 121 121.453 121.453 121.203 0.250 18509 4546 1 9 . 1 1 121 121 GLU C C 121 172.304 172.304 175.491 -3.187 18509 4547 1 9 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.036 0.054 18509 4548 1 9 . 1 1 121 121 GLU H H 121 9.178 9.178 7.961 1.217 18509 4549 1 9 . 1 1 122 122 LYS N N 122 115.248 115.248 120.591 -5.343 18509 4550 1 9 . 1 1 122 122 LYS C C 122 171.523 171.523 175.103 -3.580 18509 4551 1 9 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.312 -4.692 18509 4552 1 9 . 1 1 122 122 LYS H H 122 8.478 8.478 8.037 0.441 18509 4553 1 9 . 1 1 123 123 ALA N N 123 120.866 120.866 126.957 -6.091 18509 4554 1 9 . 1 1 123 123 ALA C C 123 173.219 173.219 177.194 -3.975 18509 4555 1 9 . 1 1 123 123 ALA CA C 123 48.850 48.850 53.291 -4.441 18509 4556 1 9 . 1 1 123 123 ALA H H 123 7.796 7.796 8.574 -0.778 18509 4557 1 9 . 1 1 124 124 ASP N N 124 121.799 121.799 125.355 -3.556 18509 4558 1 9 . 1 1 124 124 ASP C C 124 174.458 174.458 175.129 -0.671 18509 4559 1 9 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.091 -3.683 18509 4560 1 9 . 1 1 124 124 ASP H H 124 10.165 10.165 8.449 1.716 18509 4561 1 9 . 1 1 125 125 ASP N N 125 129.369 129.369 124.697 4.672 18509 4562 1 9 . 1 1 125 125 ASP C C 125 175.231 175.231 175.726 -0.495 18509 4563 1 9 . 1 1 125 125 ASP CA C 125 50.939 50.939 52.087 -1.148 18509 4564 1 9 . 1 1 125 125 ASP H H 125 10.055 10.055 7.857 2.198 18509 4565 1 9 . 1 1 126 126 LEU N N 126 117.190 117.190 125.669 -8.479 18509 4566 1 9 . 1 1 126 126 LEU C C 126 173.964 173.964 177.222 -3.258 18509 4567 1 9 . 1 1 126 126 LEU H H 126 10.483 10.483 8.188 2.295 18509 4568 1 9 . 1 1 127 127 GLY N N 127 103.809 103.809 106.897 -3.088 18509 4569 1 9 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.341 -3.463 18509 4570 1 9 . 1 1 127 127 GLY H H 127 8.637 8.637 9.056 -0.419 18509 4571 1 9 . 1 1 128 128 LYS N N 128 118.290 118.290 122.279 -3.989 18509 4572 1 9 . 1 1 128 128 LYS CA C 128 51.740 51.740 58.074 -6.334 18509 4573 1 9 . 1 1 128 128 LYS H H 128 7.158 7.158 8.633 -1.475 18509 4574 1 9 . 1 1 129 129 GLY N N 129 108.507 108.507 107.597 0.910 18509 4575 1 9 . 1 1 129 129 GLY C C 129 171.524 171.524 174.768 -3.244 18509 4576 1 9 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.879 -4.766 18509 4577 1 9 . 1 1 129 129 GLY H H 129 8.913 8.913 8.116 0.797 18509 4578 1 9 . 1 1 130 130 GLY N N 130 108.537 108.537 112.161 -3.624 18509 4579 1 9 . 1 1 130 130 GLY C C 130 169.994 169.994 173.173 -3.179 18509 4580 1 9 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.998 -2.579 18509 4581 1 9 . 1 1 130 130 GLY H H 130 8.723 8.723 8.417 0.306 18509 4582 1 9 . 1 1 131 131 ASN N N 131 111.951 111.951 119.824 -7.873 18509 4583 1 9 . 1 1 131 131 ASN C C 131 172.236 172.236 176.324 -4.088 18509 4584 1 9 . 1 1 131 131 ASN H H 131 7.152 7.152 8.041 -0.889 18509 4585 1 9 . 1 1 132 132 GLU N N 132 120.461 120.461 119.561 0.900 18509 4586 1 9 . 1 1 132 132 GLU C C 132 171.084 171.084 178.518 -7.434 18509 4587 1 9 . 1 1 132 132 GLU H H 132 8.935 8.935 8.942 -0.007 18509 4588 1 9 . 1 1 133 133 GLU N N 133 120.137 120.137 119.260 0.877 18509 4589 1 9 . 1 1 133 133 GLU C C 133 176.239 176.239 178.856 -2.617 18509 4590 1 9 . 1 1 133 133 GLU H H 133 8.775 8.775 8.660 0.115 18509 4591 1 9 . 1 1 134 134 SER N N 134 114.981 114.981 115.304 -0.323 18509 4592 1 9 . 1 1 134 134 SER CA C 134 59.046 59.046 62.019 -2.973 18509 4593 1 9 . 1 1 134 134 SER H H 134 8.117 8.117 8.215 -0.098 18509 4594 1 9 . 1 1 135 135 THR N N 135 102.263 102.263 116.192 -13.929 18509 4595 1 9 . 1 1 135 135 THR C C 135 172.804 172.804 175.866 -3.062 18509 4596 1 9 . 1 1 135 135 THR CA C 135 60.029 60.029 65.953 -5.924 18509 4597 1 9 . 1 1 135 135 THR H H 135 7.206 7.206 8.478 -1.272 18509 4598 1 9 . 1 1 136 136 LYS N N 136 122.108 122.108 117.766 4.342 18509 4599 1 9 . 1 1 136 136 LYS H H 136 7.884 7.884 7.507 0.377 18509 4600 1 9 . 1 1 137 137 THR N N 137 105.718 105.718 113.026 -7.308 18509 4601 1 9 . 1 1 137 137 THR H H 137 8.630 8.630 7.772 0.858 18509 4602 1 9 . 1 1 138 138 GLY N N 138 111.372 111.372 110.274 1.098 18509 4603 1 9 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.407 -2.924 18509 4604 1 9 . 1 1 138 138 GLY H H 138 7.426 7.426 7.556 -0.130 18509 4605 1 9 . 1 1 139 139 ASN N N 139 107.496 107.496 119.815 -12.319 18509 4606 1 9 . 1 1 139 139 ASN H H 139 7.545 7.545 8.076 -0.531 18509 4607 1 9 . 1 1 140 140 ALA N N 140 114.542 114.542 127.633 -13.091 18509 4608 1 9 . 1 1 140 140 ALA C C 140 173.571 173.571 175.786 -2.215 18509 4609 1 9 . 1 1 140 140 ALA H H 140 6.368 6.368 7.966 -1.598 18509 4610 1 9 . 1 1 141 141 GLY N N 141 105.287 105.287 106.552 -1.265 18509 4611 1 9 . 1 1 141 141 GLY C C 141 173.542 173.542 175.068 -1.526 18509 4612 1 9 . 1 1 141 141 GLY H H 141 8.271 8.271 8.769 -0.498 18509 4613 1 9 . 1 1 142 142 SER N N 142 118.771 118.771 119.418 -0.647 18509 4614 1 9 . 1 1 142 142 SER C C 142 170.188 170.188 175.569 -5.381 18509 4615 1 9 . 1 1 142 142 SER H H 142 9.196 9.196 8.120 1.076 18509 4616 1 9 . 1 1 143 143 ARG N N 143 120.189 120.189 118.925 1.264 18509 4617 1 9 . 1 1 143 143 ARG C C 143 171.596 171.596 177.763 -6.167 18509 4618 1 9 . 1 1 143 143 ARG H H 143 8.943 8.943 8.011 0.932 18509 4619 1 9 . 1 1 144 144 LEU N N 144 122.907 122.907 119.405 3.502 18509 4620 1 9 . 1 1 144 144 LEU C C 144 174.393 174.393 176.907 -2.514 18509 4621 1 9 . 1 1 144 144 LEU CA C 144 53.375 53.375 57.342 -3.967 18509 4622 1 9 . 1 1 144 144 LEU H H 144 8.395 8.395 7.836 0.559 18509 4623 1 9 . 1 1 145 145 ALA N N 145 114.159 114.159 116.593 -2.434 18509 4624 1 9 . 1 1 145 145 ALA C C 145 171.752 171.752 174.998 -3.246 18509 4625 1 9 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.357 -3.228 18509 4626 1 9 . 1 1 145 145 ALA H H 145 7.356 7.356 7.519 -0.163 18509 4627 1 9 . 1 1 146 146 CYS N N 146 110.738 110.738 119.816 -9.078 18509 4628 1 9 . 1 1 146 146 CYS C C 146 170.087 170.087 174.446 -4.359 18509 4629 1 9 . 1 1 146 146 CYS CA C 146 51.077 51.077 56.900 -5.823 18509 4630 1 9 . 1 1 146 146 CYS H H 146 9.008 9.008 8.205 0.803 18509 4631 1 9 . 1 1 147 147 GLY N N 147 106.461 106.461 107.523 -1.062 18509 4632 1 9 . 1 1 147 147 GLY C C 147 167.909 167.909 171.636 -3.727 18509 4633 1 9 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.069 -2.395 18509 4634 1 9 . 1 1 147 147 GLY H H 147 8.018 8.018 7.945 0.073 18509 4635 1 9 . 1 1 148 148 VAL N N 148 124.054 124.054 118.989 5.065 18509 4636 1 9 . 1 1 148 148 VAL C C 148 172.084 172.084 175.506 -3.422 18509 4637 1 9 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.100 -2.465 18509 4638 1 9 . 1 1 148 148 VAL H H 148 8.434 8.434 8.220 0.214 18509 4639 1 9 . 1 1 149 149 ILE N N 149 126.918 126.918 127.237 -0.319 18509 4640 1 9 . 1 1 149 149 ILE C C 149 171.804 171.804 174.646 -2.842 18509 4641 1 9 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.334 -0.150 18509 4642 1 9 . 1 1 149 149 ILE H H 149 8.613 8.613 8.836 -0.223 18509 4643 1 9 . 1 1 150 150 GLY N N 150 116.493 116.493 114.216 2.277 18509 4644 1 9 . 1 1 150 150 GLY C C 150 170.188 170.188 172.024 -1.836 18509 4645 1 9 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.693 -4.573 18509 4646 1 9 . 1 1 150 150 GLY H H 150 9.283 9.283 7.751 1.532 18509 4647 1 9 . 1 1 151 151 ILE N N 151 120.189 120.189 122.151 -1.962 18509 4648 1 9 . 1 1 151 151 ILE C C 151 172.231 172.231 174.443 -2.212 18509 4649 1 9 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.700 -1.329 18509 4650 1 9 . 1 1 151 151 ILE H H 151 8.943 8.943 8.477 0.466 18509 4651 1 9 . 1 1 152 152 ALA N N 152 129.719 129.719 131.988 -2.269 18509 4652 1 9 . 1 1 152 152 ALA CA C 152 46.772 46.772 50.525 -3.753 18509 4653 1 9 . 1 1 152 152 ALA H H 152 8.170 8.170 8.204 -0.034 18509 4654 1 10 . 1 1 2 2 THR C C 2 170.139 170.139 174.426 -4.287 18509 4655 1 10 . 1 1 3 3 LYS N N 3 123.998 123.998 121.280 2.718 18509 4656 1 10 . 1 1 3 3 LYS C C 3 171.607 171.607 174.663 -3.056 18509 4657 1 10 . 1 1 3 3 LYS CA C 3 51.178 51.178 55.054 -3.876 18509 4658 1 10 . 1 1 3 3 LYS H H 3 8.666 8.666 7.703 0.963 18509 4659 1 10 . 1 1 4 4 ALA N N 4 123.295 123.295 124.142 -0.847 18509 4660 1 10 . 1 1 4 4 ALA C C 4 172.145 172.145 174.862 -2.717 18509 4661 1 10 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.684 -3.180 18509 4662 1 10 . 1 1 4 4 ALA H H 4 9.116 9.116 8.399 0.717 18509 4663 1 10 . 1 1 5 5 VAL N N 5 121.466 121.466 119.134 2.332 18509 4664 1 10 . 1 1 5 5 VAL C C 5 167.836 167.836 173.674 -5.838 18509 4665 1 10 . 1 1 5 5 VAL CA C 5 56.875 56.875 60.881 -4.006 18509 4666 1 10 . 1 1 5 5 VAL H H 5 9.545 9.545 8.566 0.979 18509 4667 1 10 . 1 1 6 6 ALA N N 6 125.984 125.984 131.931 -5.947 18509 4668 1 10 . 1 1 6 6 ALA C C 6 171.607 171.607 175.192 -3.585 18509 4669 1 10 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.052 -2.581 18509 4670 1 10 . 1 1 6 6 ALA H H 6 9.177 9.177 8.410 0.767 18509 4671 1 10 . 1 1 7 7 VAL N N 7 123.600 123.600 124.316 -0.716 18509 4672 1 10 . 1 1 7 7 VAL C C 7 172.244 172.244 174.286 -2.042 18509 4673 1 10 . 1 1 7 7 VAL CA C 7 58.476 58.476 58.930 -0.454 18509 4674 1 10 . 1 1 7 7 VAL H H 7 9.116 9.116 8.217 0.899 18509 4675 1 10 . 1 1 8 8 LEU N N 8 126.455 126.455 129.237 -2.782 18509 4676 1 10 . 1 1 8 8 LEU C C 8 172.557 172.557 175.685 -3.128 18509 4677 1 10 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.706 -2.654 18509 4678 1 10 . 1 1 8 8 LEU H H 8 8.916 8.916 8.074 0.842 18509 4679 1 10 . 1 1 9 9 LYS N N 9 120.820 120.820 120.164 0.656 18509 4680 1 10 . 1 1 9 9 LYS C C 9 172.509 172.509 175.334 -2.825 18509 4681 1 10 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.489 -3.592 18509 4682 1 10 . 1 1 9 9 LYS H H 9 8.315 8.315 7.808 0.507 18509 4683 1 10 . 1 1 10 10 GLY N N 10 111.249 111.249 110.521 0.728 18509 4684 1 10 . 1 1 10 10 GLY C C 10 169.847 169.847 173.275 -3.428 18509 4685 1 10 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.387 -3.112 18509 4686 1 10 . 1 1 10 10 GLY H H 10 8.968 8.968 8.367 0.601 18509 4687 1 10 . 1 1 11 11 ASP N N 11 120.904 120.904 120.726 0.178 18509 4688 1 10 . 1 1 11 11 ASP C C 11 173.132 173.132 177.038 -3.906 18509 4689 1 10 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.323 -4.006 18509 4690 1 10 . 1 1 11 11 ASP H H 11 8.745 8.745 8.395 0.350 18509 4691 1 10 . 1 1 12 12 GLY N N 12 109.862 109.862 107.756 2.106 18509 4692 1 10 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.353 -2.153 18509 4693 1 10 . 1 1 12 12 GLY H H 12 7.985 7.985 8.221 -0.236 18509 4694 1 10 . 1 1 13 13 PRO C C 13 173.640 173.640 175.488 -1.848 18509 4695 1 10 . 1 1 14 14 VAL N N 14 120.414 120.414 118.741 1.673 18509 4696 1 10 . 1 1 14 14 VAL C C 14 172.804 172.804 174.270 -1.466 18509 4697 1 10 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.004 -0.120 18509 4698 1 10 . 1 1 14 14 VAL H H 14 7.476 7.476 8.058 -0.582 18509 4699 1 10 . 1 1 15 15 GLN N N 15 122.664 122.664 125.440 -2.776 18509 4700 1 10 . 1 1 15 15 GLN C C 15 171.168 171.168 174.541 -3.373 18509 4701 1 10 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.682 -4.003 18509 4702 1 10 . 1 1 15 15 GLN H H 15 7.938 7.938 8.474 -0.536 18509 4703 1 10 . 1 1 16 16 GLY N N 16 107.018 107.018 109.562 -2.544 18509 4704 1 10 . 1 1 16 16 GLY C C 16 167.726 167.726 171.713 -3.987 18509 4705 1 10 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.232 -1.607 18509 4706 1 10 . 1 1 16 16 GLY H H 16 8.288 8.288 8.339 -0.051 18509 4707 1 10 . 1 1 17 17 ILE N N 17 120.248 120.248 115.995 4.253 18509 4708 1 10 . 1 1 17 17 ILE C C 17 171.194 171.194 174.256 -3.062 18509 4709 1 10 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.257 -0.760 18509 4710 1 10 . 1 1 17 17 ILE H H 17 7.948 7.948 7.763 0.185 18509 4711 1 10 . 1 1 18 18 ILE N N 18 125.851 125.851 126.013 -0.162 18509 4712 1 10 . 1 1 18 18 ILE C C 18 168.889 168.889 175.046 -6.157 18509 4713 1 10 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.368 -5.937 18509 4714 1 10 . 1 1 18 18 ILE H H 18 8.725 8.725 7.985 0.740 18509 4715 1 10 . 1 1 19 19 ASN N N 19 123.256 123.256 123.911 -0.655 18509 4716 1 10 . 1 1 19 19 ASN C C 19 168.903 168.903 173.797 -4.894 18509 4717 1 10 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.744 -2.656 18509 4718 1 10 . 1 1 19 19 ASN H H 19 8.727 8.727 8.538 0.189 18509 4719 1 10 . 1 1 20 20 PHE N N 20 113.849 113.849 119.274 -5.425 18509 4720 1 10 . 1 1 20 20 PHE C C 20 173.219 173.219 174.637 -1.418 18509 4721 1 10 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.135 -5.077 18509 4722 1 10 . 1 1 20 20 PHE H H 20 8.399 8.399 8.782 -0.383 18509 4723 1 10 . 1 1 21 21 GLU N N 21 121.454 121.454 125.592 -4.138 18509 4724 1 10 . 1 1 21 21 GLU C C 21 170.280 170.280 174.833 -4.553 18509 4725 1 10 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.920 -1.876 18509 4726 1 10 . 1 1 21 21 GLU H H 21 9.526 9.526 8.367 1.159 18509 4727 1 10 . 1 1 22 22 GLN N N 22 130.340 130.340 126.559 3.781 18509 4728 1 10 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.087 -3.907 18509 4729 1 10 . 1 1 22 22 GLN H H 22 9.305 9.305 8.057 1.248 18509 4730 1 10 . 1 1 23 23 LYS N N 23 128.657 128.657 126.229 2.428 18509 4731 1 10 . 1 1 23 23 LYS CA C 23 57.241 57.241 55.416 1.825 18509 4732 1 10 . 1 1 23 23 LYS H H 23 9.088 9.088 8.607 0.481 18509 4733 1 10 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.694 -7.303 18509 4734 1 10 . 1 1 25 25 SER CA C 25 58.078 58.078 59.007 -0.929 18509 4735 1 10 . 1 1 27 27 GLY N N 27 108.125 108.125 111.423 -3.298 18509 4736 1 10 . 1 1 27 27 GLY CA C 27 42.925 42.925 43.657 -0.732 18509 4737 1 10 . 1 1 27 27 GLY H H 27 8.032 8.032 8.228 -0.196 18509 4738 1 10 . 1 1 28 28 PRO C C 28 173.128 173.128 176.172 -3.044 18509 4739 1 10 . 1 1 29 29 VAL N N 29 121.267 121.267 125.486 -4.219 18509 4740 1 10 . 1 1 29 29 VAL C C 29 172.198 172.198 175.809 -3.611 18509 4741 1 10 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.478 -3.758 18509 4742 1 10 . 1 1 29 29 VAL H H 29 9.089 9.089 8.345 0.744 18509 4743 1 10 . 1 1 30 30 LYS N N 30 127.589 127.589 129.325 -1.736 18509 4744 1 10 . 1 1 30 30 LYS C C 30 172.098 172.098 174.604 -2.506 18509 4745 1 10 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.177 -2.535 18509 4746 1 10 . 1 1 30 30 LYS H H 30 9.200 9.200 8.329 0.871 18509 4747 1 10 . 1 1 31 31 VAL N N 31 126.037 126.037 124.023 2.014 18509 4748 1 10 . 1 1 31 31 VAL C C 31 172.244 172.244 174.384 -2.140 18509 4749 1 10 . 1 1 31 31 VAL CA C 31 57.139 57.139 61.798 -4.660 18509 4750 1 10 . 1 1 31 31 VAL H H 31 9.282 9.282 8.482 0.800 18509 4751 1 10 . 1 1 32 32 TRP N N 32 125.414 125.414 129.267 -3.853 18509 4752 1 10 . 1 1 32 32 TRP C C 32 170.156 170.156 174.121 -3.965 18509 4753 1 10 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.320 -3.183 18509 4754 1 10 . 1 1 32 32 TRP H H 32 8.983 8.983 8.024 0.959 18509 4755 1 10 . 1 1 33 33 GLY N N 33 107.848 107.848 112.881 -5.033 18509 4756 1 10 . 1 1 33 33 GLY C C 33 168.400 168.400 171.403 -3.003 18509 4757 1 10 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.878 -3.311 18509 4758 1 10 . 1 1 33 33 GLY H H 33 8.360 8.360 7.977 0.383 18509 4759 1 10 . 1 1 34 34 SER N N 34 114.377 114.377 118.901 -4.524 18509 4760 1 10 . 1 1 34 34 SER C C 34 169.618 169.618 174.206 -4.588 18509 4761 1 10 . 1 1 34 34 SER CA C 34 53.875 53.875 56.196 -2.321 18509 4762 1 10 . 1 1 34 34 SER H H 34 7.838 7.838 7.730 0.108 18509 4763 1 10 . 1 1 35 35 ILE N N 35 123.149 123.149 120.423 2.726 18509 4764 1 10 . 1 1 35 35 ILE C C 35 169.713 169.713 174.680 -4.967 18509 4765 1 10 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.095 -2.326 18509 4766 1 10 . 1 1 35 35 ILE H H 35 8.496 8.496 8.115 0.381 18509 4767 1 10 . 1 1 36 36 LYS N N 36 123.803 123.803 123.791 0.012 18509 4768 1 10 . 1 1 36 36 LYS C C 36 172.260 172.260 176.057 -3.797 18509 4769 1 10 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.032 -2.882 18509 4770 1 10 . 1 1 36 36 LYS H H 36 9.091 9.091 8.707 0.384 18509 4771 1 10 . 1 1 37 37 GLY N N 37 105.495 105.495 109.342 -3.847 18509 4772 1 10 . 1 1 37 37 GLY C C 37 171.641 171.641 173.074 -1.433 18509 4773 1 10 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.992 -1.631 18509 4774 1 10 . 1 1 37 37 GLY H H 37 8.237 8.237 7.533 0.704 18509 4775 1 10 . 1 1 38 38 LEU N N 38 120.966 120.966 119.686 1.280 18509 4776 1 10 . 1 1 38 38 LEU C C 38 174.112 174.112 176.420 -2.308 18509 4777 1 10 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.793 -4.322 18509 4778 1 10 . 1 1 38 38 LEU H H 38 8.156 8.156 8.276 -0.120 18509 4779 1 10 . 1 1 39 39 THR N N 39 110.363 110.363 113.502 -3.139 18509 4780 1 10 . 1 1 39 39 THR C C 39 173.102 173.102 174.433 -1.331 18509 4781 1 10 . 1 1 39 39 THR CA C 39 58.194 58.194 62.504 -4.310 18509 4782 1 10 . 1 1 39 39 THR H H 39 8.660 8.660 7.986 0.674 18509 4783 1 10 . 1 1 40 40 GLU N N 40 125.818 125.818 124.568 1.250 18509 4784 1 10 . 1 1 40 40 GLU C C 40 173.134 173.134 175.175 -2.041 18509 4785 1 10 . 1 1 40 40 GLU CA C 40 54.356 54.356 57.365 -3.009 18509 4786 1 10 . 1 1 40 40 GLU H H 40 8.804 8.804 8.199 0.605 18509 4787 1 10 . 1 1 41 41 GLY N N 41 113.875 113.875 107.430 6.445 18509 4788 1 10 . 1 1 41 41 GLY C C 41 170.046 170.046 172.304 -2.258 18509 4789 1 10 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.480 -4.426 18509 4790 1 10 . 1 1 41 41 GLY H H 41 8.763 8.763 8.245 0.518 18509 4791 1 10 . 1 1 42 42 LEU N N 42 120.137 120.137 118.970 1.167 18509 4792 1 10 . 1 1 42 42 LEU C C 42 174.218 174.218 176.348 -2.130 18509 4793 1 10 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.687 -3.532 18509 4794 1 10 . 1 1 42 42 LEU H H 42 8.313 8.313 8.260 0.053 18509 4795 1 10 . 1 1 43 43 HIS N N 43 114.385 114.385 121.191 -6.806 18509 4796 1 10 . 1 1 43 43 HIS C C 43 171.504 171.504 175.065 -3.561 18509 4797 1 10 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.826 -4.841 18509 4798 1 10 . 1 1 43 43 HIS H H 43 8.712 8.712 8.240 0.472 18509 4799 1 10 . 1 1 44 44 GLY N N 44 108.872 108.872 114.339 -5.467 18509 4800 1 10 . 1 1 44 44 GLY C C 44 168.656 168.656 172.119 -3.463 18509 4801 1 10 . 1 1 44 44 GLY CA C 44 44.195 44.195 43.802 0.393 18509 4802 1 10 . 1 1 44 44 GLY H H 44 8.875 8.875 8.807 0.068 18509 4803 1 10 . 1 1 45 45 PHE N N 45 126.439 126.439 125.147 1.292 18509 4804 1 10 . 1 1 45 45 PHE CA C 45 53.098 53.098 55.729 -2.631 18509 4805 1 10 . 1 1 45 45 PHE H H 45 8.111 8.111 8.322 -0.211 18509 4806 1 10 . 1 1 46 46 HIS N N 46 115.353 115.353 125.947 -10.594 18509 4807 1 10 . 1 1 46 46 HIS C C 46 172.415 172.415 173.401 -0.986 18509 4808 1 10 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.821 -5.615 18509 4809 1 10 . 1 1 46 46 HIS H H 46 8.107 8.107 8.462 -0.355 18509 4810 1 10 . 1 1 47 47 VAL N N 47 120.548 120.548 124.453 -3.905 18509 4811 1 10 . 1 1 47 47 VAL C C 47 173.900 173.900 173.384 0.516 18509 4812 1 10 . 1 1 47 47 VAL CA C 47 58.792 58.792 62.536 -3.744 18509 4813 1 10 . 1 1 47 47 VAL H H 47 9.366 9.366 8.523 0.843 18509 4814 1 10 . 1 1 48 48 HIS N N 48 129.236 129.236 126.747 2.489 18509 4815 1 10 . 1 1 48 48 HIS C C 48 171.084 171.084 173.825 -2.741 18509 4816 1 10 . 1 1 48 48 HIS CA C 48 52.756 52.756 53.958 -1.202 18509 4817 1 10 . 1 1 48 48 HIS H H 48 10.210 10.210 9.909 0.301 18509 4818 1 10 . 1 1 49 49 GLU N N 49 118.119 118.119 119.470 -1.351 18509 4819 1 10 . 1 1 49 49 GLU C C 49 171.635 171.635 175.057 -3.422 18509 4820 1 10 . 1 1 49 49 GLU CA C 49 57.759 57.759 54.991 2.768 18509 4821 1 10 . 1 1 49 49 GLU H H 49 8.492 8.492 8.003 0.489 18509 4822 1 10 . 1 1 50 50 PHE N N 50 110.329 110.329 125.326 -14.997 18509 4823 1 10 . 1 1 50 50 PHE C C 50 175.252 175.252 174.993 0.259 18509 4824 1 10 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.810 -5.910 18509 4825 1 10 . 1 1 50 50 PHE H H 50 8.580 8.580 9.288 -0.708 18509 4826 1 10 . 1 1 51 51 GLY N N 51 119.251 119.251 107.568 11.683 18509 4827 1 10 . 1 1 51 51 GLY C C 51 168.248 168.248 174.302 -6.054 18509 4828 1 10 . 1 1 51 51 GLY H H 51 10.208 10.208 8.363 1.845 18509 4829 1 10 . 1 1 52 52 ASP N N 52 114.958 114.958 121.240 -6.282 18509 4830 1 10 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.469 -5.578 18509 4831 1 10 . 1 1 52 52 ASP H H 52 5.834 5.834 8.262 -2.428 18509 4832 1 10 . 1 1 53 53 ASN N N 53 128.224 128.224 116.443 11.781 18509 4833 1 10 . 1 1 53 53 ASN CA C 53 48.233 48.233 53.191 -4.958 18509 4834 1 10 . 1 1 53 53 ASN H H 53 9.360 9.360 7.944 1.416 18509 4835 1 10 . 1 1 54 54 THR C C 54 168.656 168.656 173.697 -5.041 18509 4836 1 10 . 1 1 55 55 ALA N N 55 126.661 126.661 120.358 6.303 18509 4837 1 10 . 1 1 55 55 ALA C C 55 174.185 174.185 175.751 -1.566 18509 4838 1 10 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.773 -5.618 18509 4839 1 10 . 1 1 55 55 ALA H H 55 8.390 8.390 7.951 0.439 18509 4840 1 10 . 1 1 56 56 GLY N N 56 107.903 107.903 105.686 2.217 18509 4841 1 10 . 1 1 56 56 GLY C C 56 171.578 171.578 172.528 -0.950 18509 4842 1 10 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.797 -3.217 18509 4843 1 10 . 1 1 56 56 GLY H H 56 7.282 7.282 7.599 -0.317 18509 4844 1 10 . 1 1 57 57 CYS N N 57 117.952 117.952 122.694 -4.742 18509 4845 1 10 . 1 1 57 57 CYS C C 57 175.209 175.209 175.094 0.115 18509 4846 1 10 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.623 -7.535 18509 4847 1 10 . 1 1 57 57 CYS H H 57 8.900 8.900 8.435 0.465 18509 4848 1 10 . 1 1 58 58 THR N N 58 119.852 119.852 120.441 -0.589 18509 4849 1 10 . 1 1 58 58 THR CA C 58 58.239 58.239 65.682 -7.443 18509 4850 1 10 . 1 1 58 58 THR H H 58 8.505 8.505 8.364 0.141 18509 4851 1 10 . 1 1 59 59 SER C C 59 170.763 170.763 175.965 -5.202 18509 4852 1 10 . 1 1 59 59 SER CA C 59 55.609 55.609 61.205 -5.596 18509 4853 1 10 . 1 1 60 60 ALA N N 60 119.753 119.753 122.907 -3.154 18509 4854 1 10 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.584 -2.643 18509 4855 1 10 . 1 1 60 60 ALA H H 60 6.898 6.898 7.911 -1.013 18509 4856 1 10 . 1 1 61 61 GLY N N 61 101.351 101.351 108.968 -7.617 18509 4857 1 10 . 1 1 61 61 GLY CA C 61 42.805 42.805 47.782 -4.977 18509 4858 1 10 . 1 1 61 61 GLY H H 61 7.730 7.730 7.772 -0.042 18509 4859 1 10 . 1 1 62 62 PRO C C 62 172.276 172.276 175.716 -3.440 18509 4860 1 10 . 1 1 63 63 HIS N N 63 115.023 115.023 120.715 -5.692 18509 4861 1 10 . 1 1 63 63 HIS CA C 63 52.119 52.119 54.775 -2.656 18509 4862 1 10 . 1 1 63 63 HIS H H 63 7.474 7.474 7.866 -0.392 18509 4863 1 10 . 1 1 64 64 PHE C C 64 171.731 171.731 174.265 -2.534 18509 4864 1 10 . 1 1 65 65 ASN N N 65 126.978 126.978 115.057 11.921 18509 4865 1 10 . 1 1 65 65 ASN CA C 65 47.753 47.753 50.688 -2.934 18509 4866 1 10 . 1 1 65 65 ASN H H 65 9.426 9.426 8.459 0.967 18509 4867 1 10 . 1 1 67 67 LEU N N 67 117.937 117.937 114.515 3.422 18509 4868 1 10 . 1 1 67 67 LEU C C 67 172.580 172.580 176.506 -3.926 18509 4869 1 10 . 1 1 67 67 LEU CA C 67 50.911 50.911 54.900 -3.989 18509 4870 1 10 . 1 1 67 67 LEU H H 67 7.720 7.720 8.285 -0.565 18509 4871 1 10 . 1 1 68 68 SER N N 68 110.842 110.842 114.088 -3.246 18509 4872 1 10 . 1 1 68 68 SER CA C 68 55.953 55.953 58.764 -2.811 18509 4873 1 10 . 1 1 68 68 SER H H 68 7.428 7.428 7.868 -0.440 18509 4874 1 10 . 1 1 69 69 ARG N N 69 120.782 120.782 122.990 -2.208 18509 4875 1 10 . 1 1 69 69 ARG C C 69 173.381 173.381 176.204 -2.823 18509 4876 1 10 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.875 -5.332 18509 4877 1 10 . 1 1 69 69 ARG H H 69 8.508 8.508 8.015 0.493 18509 4878 1 10 . 1 1 70 70 LYS N N 70 118.055 118.055 122.289 -4.234 18509 4879 1 10 . 1 1 70 70 LYS C C 70 169.994 169.994 175.867 -5.873 18509 4880 1 10 . 1 1 70 70 LYS CA C 70 52.596 52.596 57.196 -4.600 18509 4881 1 10 . 1 1 70 70 LYS H H 70 8.745 8.745 8.293 0.452 18509 4882 1 10 . 1 1 71 71 HIS N N 71 111.871 111.871 117.115 -5.244 18509 4883 1 10 . 1 1 71 71 HIS C C 71 171.534 171.534 174.966 -3.432 18509 4884 1 10 . 1 1 71 71 HIS CA C 71 52.549 52.549 56.671 -4.122 18509 4885 1 10 . 1 1 71 71 HIS H H 71 7.152 7.152 8.607 -1.455 18509 4886 1 10 . 1 1 72 72 GLY N N 72 112.910 112.910 108.660 4.250 18509 4887 1 10 . 1 1 72 72 GLY C C 72 168.634 168.634 172.689 -4.055 18509 4888 1 10 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.941 -3.667 18509 4889 1 10 . 1 1 72 72 GLY H H 72 7.209 7.209 8.339 -1.130 18509 4890 1 10 . 1 1 73 73 GLY N N 73 105.207 105.207 111.180 -5.973 18509 4891 1 10 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.354 -3.133 18509 4892 1 10 . 1 1 73 73 GLY H H 73 8.789 8.789 7.774 1.015 18509 4893 1 10 . 1 1 74 74 PRO C C 74 175.753 175.753 176.980 -1.227 18509 4894 1 10 . 1 1 75 75 LYS N N 75 114.868 114.868 112.323 2.545 18509 4895 1 10 . 1 1 75 75 LYS C C 75 173.640 173.640 175.592 -1.952 18509 4896 1 10 . 1 1 75 75 LYS CA C 75 51.103 51.103 54.226 -3.123 18509 4897 1 10 . 1 1 75 75 LYS H H 75 8.651 8.651 7.967 0.684 18509 4898 1 10 . 1 1 76 76 ASP N N 76 120.414 120.414 120.879 -0.465 18509 4899 1 10 . 1 1 76 76 ASP C C 76 172.557 172.557 175.367 -2.810 18509 4900 1 10 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.116 -2.807 18509 4901 1 10 . 1 1 76 76 ASP H H 76 7.461 7.461 7.351 0.110 18509 4902 1 10 . 1 1 77 77 GLU N N 77 120.820 120.820 115.634 5.186 18509 4903 1 10 . 1 1 77 77 GLU C C 77 174.101 174.101 175.384 -1.283 18509 4904 1 10 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.395 -1.882 18509 4905 1 10 . 1 1 77 77 GLU H H 77 8.315 8.315 8.482 -0.167 18509 4906 1 10 . 1 1 78 78 GLU N N 78 119.251 119.251 121.143 -1.892 18509 4907 1 10 . 1 1 78 78 GLU C C 78 168.285 168.285 177.940 -9.655 18509 4908 1 10 . 1 1 78 78 GLU CA C 78 52.078 52.078 56.864 -4.786 18509 4909 1 10 . 1 1 78 78 GLU H H 78 8.109 8.109 9.418 -1.309 18509 4910 1 10 . 1 1 79 79 ARG N N 79 118.991 118.991 117.203 1.788 18509 4911 1 10 . 1 1 79 79 ARG C C 79 172.123 172.123 174.946 -2.823 18509 4912 1 10 . 1 1 79 79 ARG CA C 79 51.074 51.074 55.764 -4.690 18509 4913 1 10 . 1 1 79 79 ARG H H 79 6.999 6.999 9.367 -2.368 18509 4914 1 10 . 1 1 80 80 HIS N N 80 118.000 118.000 110.480 7.520 18509 4915 1 10 . 1 1 80 80 HIS CA C 80 49.953 49.953 55.872 -5.919 18509 4916 1 10 . 1 1 80 80 HIS H H 80 8.355 8.355 7.757 0.598 18509 4917 1 10 . 1 1 81 81 VAL C C 81 173.460 173.460 174.617 -1.157 18509 4918 1 10 . 1 1 82 82 GLY N N 82 97.322 97.322 107.964 -10.642 18509 4919 1 10 . 1 1 82 82 GLY C C 82 170.370 170.370 173.426 -3.056 18509 4920 1 10 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.634 -2.946 18509 4921 1 10 . 1 1 82 82 GLY H H 82 8.487 8.487 7.582 0.905 18509 4922 1 10 . 1 1 83 83 ASP N N 83 120.890 120.890 121.822 -0.932 18509 4923 1 10 . 1 1 83 83 ASP C C 83 168.737 168.737 174.555 -5.818 18509 4924 1 10 . 1 1 83 83 ASP CA C 83 52.918 52.918 52.815 0.103 18509 4925 1 10 . 1 1 83 83 ASP H H 83 7.127 7.127 8.270 -1.143 18509 4926 1 10 . 1 1 84 84 LEU N N 84 120.154 120.154 122.903 -2.749 18509 4927 1 10 . 1 1 84 84 LEU C C 84 173.212 173.212 175.080 -1.868 18509 4928 1 10 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.602 -4.169 18509 4929 1 10 . 1 1 84 84 LEU H H 84 7.128 7.128 7.391 -0.263 18509 4930 1 10 . 1 1 85 85 GLY N N 85 106.867 106.867 111.533 -4.666 18509 4931 1 10 . 1 1 85 85 GLY C C 85 167.654 167.654 171.803 -4.149 18509 4932 1 10 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.857 -1.846 18509 4933 1 10 . 1 1 85 85 GLY H H 85 8.260 8.260 7.996 0.264 18509 4934 1 10 . 1 1 86 86 ASN N N 86 117.454 117.454 118.006 -0.552 18509 4935 1 10 . 1 1 86 86 ASN C C 86 173.942 173.942 174.108 -0.166 18509 4936 1 10 . 1 1 86 86 ASN CA C 86 49.266 49.266 51.596 -2.330 18509 4937 1 10 . 1 1 86 86 ASN H H 86 8.041 8.041 8.536 -0.495 18509 4938 1 10 . 1 1 87 87 VAL N N 87 113.370 113.370 121.155 -7.785 18509 4939 1 10 . 1 1 87 87 VAL C C 87 171.526 171.526 174.563 -3.037 18509 4940 1 10 . 1 1 87 87 VAL CA C 87 55.708 55.708 61.761 -6.053 18509 4941 1 10 . 1 1 87 87 VAL H H 87 8.960 8.960 8.375 0.585 18509 4942 1 10 . 1 1 88 88 THR N N 88 117.939 117.939 121.615 -3.676 18509 4943 1 10 . 1 1 88 88 THR C C 88 170.367 170.367 172.818 -2.451 18509 4944 1 10 . 1 1 88 88 THR CA C 88 58.694 58.694 61.976 -3.282 18509 4945 1 10 . 1 1 88 88 THR H H 88 8.681 8.681 8.370 0.311 18509 4946 1 10 . 1 1 89 89 ALA N N 89 128.674 128.674 129.410 -0.736 18509 4947 1 10 . 1 1 89 89 ALA C C 89 174.480 174.480 176.248 -1.768 18509 4948 1 10 . 1 1 89 89 ALA CA C 89 46.369 46.369 49.883 -3.514 18509 4949 1 10 . 1 1 89 89 ALA H H 89 9.377 9.377 8.066 1.311 18509 4950 1 10 . 1 1 90 90 ASP N N 90 124.235 124.235 122.437 1.798 18509 4951 1 10 . 1 1 90 90 ASP C C 90 173.825 173.825 178.122 -4.297 18509 4952 1 10 . 1 1 90 90 ASP CA C 90 49.347 49.347 53.803 -4.456 18509 4953 1 10 . 1 1 90 90 ASP H H 90 8.455 8.455 8.499 -0.044 18509 4954 1 10 . 1 1 91 91 LYS N N 91 114.942 114.942 123.267 -8.325 18509 4955 1 10 . 1 1 91 91 LYS C C 91 174.101 174.101 177.193 -3.092 18509 4956 1 10 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.838 -3.559 18509 4957 1 10 . 1 1 91 91 LYS H H 91 8.231 8.231 8.599 -0.368 18509 4958 1 10 . 1 1 92 92 ASP N N 92 119.251 119.251 117.582 1.669 18509 4959 1 10 . 1 1 92 92 ASP C C 92 173.020 173.020 176.095 -3.075 18509 4960 1 10 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.730 -2.603 18509 4961 1 10 . 1 1 92 92 ASP H H 92 8.109 8.109 7.746 0.363 18509 4962 1 10 . 1 1 93 93 GLY N N 93 110.868 110.868 108.899 1.969 18509 4963 1 10 . 1 1 93 93 GLY C C 93 169.706 169.706 172.698 -2.992 18509 4964 1 10 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.529 -1.766 18509 4965 1 10 . 1 1 93 93 GLY H H 93 8.405 8.405 8.477 -0.072 18509 4966 1 10 . 1 1 94 94 VAL N N 94 118.755 118.755 122.511 -3.756 18509 4967 1 10 . 1 1 94 94 VAL C C 94 173.510 173.510 174.097 -0.587 18509 4968 1 10 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.377 -3.192 18509 4969 1 10 . 1 1 94 94 VAL H H 94 7.814 7.814 7.646 0.168 18509 4970 1 10 . 1 1 95 95 ALA N N 95 131.313 131.313 130.325 0.988 18509 4971 1 10 . 1 1 95 95 ALA C C 95 171.635 171.635 175.383 -3.748 18509 4972 1 10 . 1 1 95 95 ALA CA C 95 46.914 46.914 49.679 -2.765 18509 4973 1 10 . 1 1 95 95 ALA H H 95 9.763 9.763 8.879 0.884 18509 4974 1 10 . 1 1 96 96 ASP N N 96 125.170 125.170 126.058 -0.888 18509 4975 1 10 . 1 1 96 96 ASP C C 96 172.336 172.336 175.914 -3.578 18509 4976 1 10 . 1 1 96 96 ASP H H 96 8.515 8.515 8.232 0.283 18509 4977 1 10 . 1 1 97 97 VAL N N 97 125.879 125.879 128.722 -2.843 18509 4978 1 10 . 1 1 97 97 VAL C C 97 173.488 173.488 174.585 -1.097 18509 4979 1 10 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.946 -3.703 18509 4980 1 10 . 1 1 97 97 VAL H H 97 8.703 8.703 8.697 0.006 18509 4981 1 10 . 1 1 98 98 SER N N 98 123.017 123.017 121.947 1.070 18509 4982 1 10 . 1 1 98 98 SER C C 98 169.715 169.715 173.351 -3.636 18509 4983 1 10 . 1 1 98 98 SER CA C 98 55.068 55.068 57.874 -2.807 18509 4984 1 10 . 1 1 98 98 SER H H 98 8.784 8.784 8.176 0.608 18509 4985 1 10 . 1 1 99 99 ILE N N 99 125.807 125.807 125.500 0.307 18509 4986 1 10 . 1 1 99 99 ILE C C 99 171.321 171.321 174.337 -3.016 18509 4987 1 10 . 1 1 99 99 ILE CA C 99 57.155 57.155 60.095 -2.940 18509 4988 1 10 . 1 1 99 99 ILE H H 99 9.411 9.411 8.053 1.359 18509 4989 1 10 . 1 1 100 100 GLU N N 100 124.068 124.068 129.385 -5.317 18509 4990 1 10 . 1 1 100 100 GLU C C 100 172.098 172.098 174.586 -2.488 18509 4991 1 10 . 1 1 100 100 GLU CA C 100 52.290 52.290 55.772 -3.482 18509 4992 1 10 . 1 1 100 100 GLU H H 100 8.652 8.652 8.575 0.077 18509 4993 1 10 . 1 1 101 101 ASP N N 101 126.109 126.109 120.227 5.882 18509 4994 1 10 . 1 1 101 101 ASP C C 101 171.144 171.144 174.824 -3.680 18509 4995 1 10 . 1 1 101 101 ASP CA C 101 51.419 51.419 52.779 -1.360 18509 4996 1 10 . 1 1 101 101 ASP H H 101 9.317 9.317 8.124 1.193 18509 4997 1 10 . 1 1 102 102 SER N N 102 118.470 118.470 114.832 3.638 18509 4998 1 10 . 1 1 102 102 SER C C 102 171.596 171.596 175.685 -4.089 18509 4999 1 10 . 1 1 102 102 SER CA C 102 55.245 55.245 58.821 -3.576 18509 5000 1 10 . 1 1 102 102 SER H H 102 8.933 8.933 8.511 0.422 18509 5001 1 10 . 1 1 103 103 VAL N N 103 123.179 123.179 117.031 6.148 18509 5002 1 10 . 1 1 103 103 VAL CA C 103 61.450 61.450 62.065 -0.615 18509 5003 1 10 . 1 1 103 103 VAL H H 103 8.148 8.148 7.999 0.149 18509 5004 1 10 . 1 1 104 104 ILE C C 104 169.576 169.576 175.159 -5.583 18509 5005 1 10 . 1 1 104 104 ILE CA C 104 60.194 60.194 59.461 0.733 18509 5006 1 10 . 1 1 105 105 SER N N 105 107.618 107.618 118.993 -11.375 18509 5007 1 10 . 1 1 105 105 SER C C 105 170.046 170.046 174.308 -4.262 18509 5008 1 10 . 1 1 105 105 SER CA C 105 52.550 52.550 58.533 -5.983 18509 5009 1 10 . 1 1 105 105 SER H H 105 6.988 6.988 8.227 -1.239 18509 5010 1 10 . 1 1 106 106 LEU N N 106 120.137 120.137 125.236 -5.099 18509 5011 1 10 . 1 1 106 106 LEU H H 106 8.313 8.313 8.103 0.210 18509 5012 1 10 . 1 1 107 107 SER C C 107 170.701 170.701 173.648 -2.947 18509 5013 1 10 . 1 1 107 107 SER CA C 107 54.540 54.540 58.062 -3.522 18509 5014 1 10 . 1 1 108 108 GLY N N 108 107.603 107.603 110.318 -2.715 18509 5015 1 10 . 1 1 108 108 GLY C C 108 173.128 173.128 173.516 -0.388 18509 5016 1 10 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.967 -3.680 18509 5017 1 10 . 1 1 108 108 GLY H H 108 8.717 8.717 7.456 1.261 18509 5018 1 10 . 1 1 109 109 ASP N N 109 120.664 120.664 120.940 -0.276 18509 5019 1 10 . 1 1 109 109 ASP C C 109 171.904 171.904 176.561 -4.657 18509 5020 1 10 . 1 1 109 109 ASP H H 109 9.019 9.019 8.888 0.131 18509 5021 1 10 . 1 1 110 110 HIS N N 110 116.324 116.324 115.315 1.009 18509 5022 1 10 . 1 1 110 110 HIS H H 110 9.283 9.283 8.101 1.182 18509 5023 1 10 . 1 1 111 111 SER N N 111 110.225 110.225 114.415 -4.190 18509 5024 1 10 . 1 1 111 111 SER CA C 111 54.681 54.681 59.587 -4.906 18509 5025 1 10 . 1 1 111 111 SER H H 111 7.156 7.156 7.451 -0.295 18509 5026 1 10 . 1 1 112 112 ILE N N 112 117.053 117.053 119.841 -2.788 18509 5027 1 10 . 1 1 112 112 ILE C C 112 171.419 171.419 175.065 -3.646 18509 5028 1 10 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.529 -4.290 18509 5029 1 10 . 1 1 112 112 ILE H H 112 7.837 7.837 8.123 -0.286 18509 5030 1 10 . 1 1 113 113 ILE N N 113 121.032 121.032 114.518 6.514 18509 5031 1 10 . 1 1 113 113 ILE C C 113 173.604 173.604 176.298 -2.694 18509 5032 1 10 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.197 -1.879 18509 5033 1 10 . 1 1 113 113 ILE H H 113 7.592 7.592 7.400 0.192 18509 5034 1 10 . 1 1 114 114 GLY N N 114 112.661 112.661 111.297 1.364 18509 5035 1 10 . 1 1 114 114 GLY C C 114 169.739 169.739 173.680 -3.941 18509 5036 1 10 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.460 -3.550 18509 5037 1 10 . 1 1 114 114 GLY H H 114 9.575 9.575 8.412 1.163 18509 5038 1 10 . 1 1 115 115 ARG N N 115 118.398 118.398 121.672 -3.274 18509 5039 1 10 . 1 1 115 115 ARG C C 115 171.079 171.079 174.929 -3.850 18509 5040 1 10 . 1 1 115 115 ARG CA C 115 51.663 51.663 53.562 -1.899 18509 5041 1 10 . 1 1 115 115 ARG H H 115 7.464 7.464 7.450 0.014 18509 5042 1 10 . 1 1 116 116 THR N N 116 112.218 112.218 116.379 -4.161 18509 5043 1 10 . 1 1 116 116 THR C C 116 169.821 169.821 174.310 -4.489 18509 5044 1 10 . 1 1 116 116 THR CA C 116 59.633 59.633 60.824 -1.191 18509 5045 1 10 . 1 1 116 116 THR H H 116 6.677 6.677 8.481 -1.804 18509 5046 1 10 . 1 1 117 117 LEU N N 117 129.477 129.477 130.719 -1.242 18509 5047 1 10 . 1 1 117 117 LEU C C 117 171.126 171.126 175.309 -4.183 18509 5048 1 10 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.894 -4.479 18509 5049 1 10 . 1 1 117 117 LEU H H 117 8.799 8.799 8.790 0.009 18509 5050 1 10 . 1 1 118 118 VAL N N 118 125.091 125.091 127.419 -2.328 18509 5051 1 10 . 1 1 118 118 VAL C C 118 170.267 170.267 174.723 -4.456 18509 5052 1 10 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.641 -3.502 18509 5053 1 10 . 1 1 118 118 VAL H H 118 8.906 8.906 7.850 1.056 18509 5054 1 10 . 1 1 119 119 VAL N N 119 120.716 120.716 126.879 -6.163 18509 5055 1 10 . 1 1 119 119 VAL C C 119 171.175 171.175 174.129 -2.954 18509 5056 1 10 . 1 1 119 119 VAL CA C 119 55.271 55.271 58.209 -2.938 18509 5057 1 10 . 1 1 119 119 VAL H H 119 7.982 7.982 7.943 0.039 18509 5058 1 10 . 1 1 120 120 HIS N N 120 125.052 125.052 121.239 3.813 18509 5059 1 10 . 1 1 120 120 HIS C C 120 172.599 172.599 173.883 -1.284 18509 5060 1 10 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.743 -1.349 18509 5061 1 10 . 1 1 120 120 HIS H H 120 8.935 8.935 8.477 0.458 18509 5062 1 10 . 1 1 121 121 GLU N N 121 121.453 121.453 121.472 -0.019 18509 5063 1 10 . 1 1 121 121 GLU C C 121 172.304 172.304 175.950 -3.646 18509 5064 1 10 . 1 1 121 121 GLU CA C 121 56.090 56.090 57.297 -1.206 18509 5065 1 10 . 1 1 121 121 GLU H H 121 9.178 9.178 8.026 1.152 18509 5066 1 10 . 1 1 122 122 LYS N N 122 115.248 115.248 122.385 -7.137 18509 5067 1 10 . 1 1 122 122 LYS C C 122 171.523 171.523 174.430 -2.907 18509 5068 1 10 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.278 -4.659 18509 5069 1 10 . 1 1 122 122 LYS H H 122 8.478 8.478 8.012 0.466 18509 5070 1 10 . 1 1 123 123 ALA N N 123 120.866 120.866 124.605 -3.739 18509 5071 1 10 . 1 1 123 123 ALA C C 123 173.219 173.219 177.094 -3.875 18509 5072 1 10 . 1 1 123 123 ALA CA C 123 48.850 48.850 50.865 -2.015 18509 5073 1 10 . 1 1 123 123 ALA H H 123 7.796 7.796 8.467 -0.671 18509 5074 1 10 . 1 1 124 124 ASP N N 124 121.799 121.799 126.684 -4.885 18509 5075 1 10 . 1 1 124 124 ASP C C 124 174.458 174.458 176.253 -1.795 18509 5076 1 10 . 1 1 124 124 ASP CA C 124 49.408 49.408 56.120 -6.712 18509 5077 1 10 . 1 1 124 124 ASP H H 124 10.165 10.165 8.697 1.468 18509 5078 1 10 . 1 1 125 125 ASP N N 125 129.369 129.369 116.452 12.917 18509 5079 1 10 . 1 1 125 125 ASP C C 125 175.231 175.231 176.157 -0.926 18509 5080 1 10 . 1 1 125 125 ASP CA C 125 50.939 50.939 54.582 -3.643 18509 5081 1 10 . 1 1 125 125 ASP H H 125 10.055 10.055 7.702 2.353 18509 5082 1 10 . 1 1 126 126 LEU N N 126 117.190 117.190 118.854 -1.664 18509 5083 1 10 . 1 1 126 126 LEU C C 126 173.964 173.964 177.192 -3.228 18509 5084 1 10 . 1 1 126 126 LEU H H 126 10.483 10.483 7.930 2.553 18509 5085 1 10 . 1 1 127 127 GLY N N 127 103.809 103.809 107.363 -3.554 18509 5086 1 10 . 1 1 127 127 GLY CA C 127 42.878 42.878 45.465 -2.587 18509 5087 1 10 . 1 1 127 127 GLY H H 127 8.637 8.637 8.466 0.171 18509 5088 1 10 . 1 1 128 128 LYS N N 128 118.290 118.290 121.510 -3.220 18509 5089 1 10 . 1 1 128 128 LYS CA C 128 51.740 51.740 55.095 -3.355 18509 5090 1 10 . 1 1 128 128 LYS H H 128 7.158 7.158 8.555 -1.397 18509 5091 1 10 . 1 1 129 129 GLY N N 129 108.507 108.507 107.016 1.491 18509 5092 1 10 . 1 1 129 129 GLY C C 129 171.524 171.524 174.425 -2.901 18509 5093 1 10 . 1 1 129 129 GLY CA C 129 42.113 42.113 45.136 -3.023 18509 5094 1 10 . 1 1 129 129 GLY H H 129 8.913 8.913 7.714 1.199 18509 5095 1 10 . 1 1 130 130 GLY N N 130 108.537 108.537 109.008 -0.471 18509 5096 1 10 . 1 1 130 130 GLY C C 130 169.994 169.994 173.310 -3.316 18509 5097 1 10 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.769 -2.349 18509 5098 1 10 . 1 1 130 130 GLY H H 130 8.723 8.723 7.708 1.015 18509 5099 1 10 . 1 1 131 131 ASN N N 131 111.951 111.951 119.675 -7.724 18509 5100 1 10 . 1 1 131 131 ASN C C 131 172.236 172.236 175.701 -3.465 18509 5101 1 10 . 1 1 131 131 ASN H H 131 7.152 7.152 8.182 -1.030 18509 5102 1 10 . 1 1 132 132 GLU N N 132 120.461 120.461 121.196 -0.735 18509 5103 1 10 . 1 1 132 132 GLU C C 132 171.084 171.084 178.095 -7.011 18509 5104 1 10 . 1 1 132 132 GLU H H 132 8.935 8.935 8.871 0.064 18509 5105 1 10 . 1 1 133 133 GLU N N 133 120.137 120.137 118.782 1.355 18509 5106 1 10 . 1 1 133 133 GLU C C 133 176.239 176.239 178.583 -2.344 18509 5107 1 10 . 1 1 133 133 GLU H H 133 8.775 8.775 8.530 0.245 18509 5108 1 10 . 1 1 134 134 SER N N 134 114.981 114.981 113.826 1.155 18509 5109 1 10 . 1 1 134 134 SER CA C 134 59.046 59.046 60.932 -1.887 18509 5110 1 10 . 1 1 134 134 SER H H 134 8.117 8.117 8.243 -0.126 18509 5111 1 10 . 1 1 135 135 THR N N 135 102.263 102.263 116.310 -14.047 18509 5112 1 10 . 1 1 135 135 THR C C 135 172.804 172.804 175.028 -2.224 18509 5113 1 10 . 1 1 135 135 THR CA C 135 60.029 60.029 65.791 -5.762 18509 5114 1 10 . 1 1 135 135 THR H H 135 7.206 7.206 8.202 -0.996 18509 5115 1 10 . 1 1 136 136 LYS N N 136 122.108 122.108 120.845 1.263 18509 5116 1 10 . 1 1 136 136 LYS H H 136 7.884 7.884 7.745 0.139 18509 5117 1 10 . 1 1 137 137 THR N N 137 105.718 105.718 111.386 -5.668 18509 5118 1 10 . 1 1 137 137 THR H H 137 8.630 8.630 7.562 1.068 18509 5119 1 10 . 1 1 138 138 GLY N N 138 111.372 111.372 110.302 1.070 18509 5120 1 10 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.238 -2.755 18509 5121 1 10 . 1 1 138 138 GLY H H 138 7.426 7.426 7.325 0.101 18509 5122 1 10 . 1 1 139 139 ASN N N 139 107.496 107.496 121.400 -13.904 18509 5123 1 10 . 1 1 139 139 ASN H H 139 7.545 7.545 8.155 -0.610 18509 5124 1 10 . 1 1 140 140 ALA N N 140 114.542 114.542 126.972 -12.430 18509 5125 1 10 . 1 1 140 140 ALA C C 140 173.571 173.571 176.610 -3.039 18509 5126 1 10 . 1 1 140 140 ALA H H 140 6.368 6.368 8.148 -1.780 18509 5127 1 10 . 1 1 141 141 GLY N N 141 105.287 105.287 109.424 -4.137 18509 5128 1 10 . 1 1 141 141 GLY C C 141 173.542 173.542 175.763 -2.221 18509 5129 1 10 . 1 1 141 141 GLY H H 141 8.271 8.271 8.725 -0.454 18509 5130 1 10 . 1 1 142 142 SER N N 142 118.771 118.771 120.432 -1.661 18509 5131 1 10 . 1 1 142 142 SER C C 142 170.188 170.188 174.883 -4.695 18509 5132 1 10 . 1 1 142 142 SER H H 142 9.196 9.196 8.326 0.870 18509 5133 1 10 . 1 1 143 143 ARG N N 143 120.189 120.189 113.463 6.726 18509 5134 1 10 . 1 1 143 143 ARG C C 143 171.596 171.596 176.331 -4.735 18509 5135 1 10 . 1 1 143 143 ARG H H 143 8.943 8.943 7.913 1.030 18509 5136 1 10 . 1 1 144 144 LEU N N 144 122.907 122.907 121.649 1.258 18509 5137 1 10 . 1 1 144 144 LEU C C 144 174.393 174.393 176.475 -2.082 18509 5138 1 10 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.273 -2.898 18509 5139 1 10 . 1 1 144 144 LEU H H 144 8.395 8.395 8.139 0.256 18509 5140 1 10 . 1 1 145 145 ALA N N 145 114.159 114.159 117.920 -3.761 18509 5141 1 10 . 1 1 145 145 ALA C C 145 171.752 171.752 174.697 -2.945 18509 5142 1 10 . 1 1 145 145 ALA CA C 145 48.129 48.129 52.084 -3.955 18509 5143 1 10 . 1 1 145 145 ALA H H 145 7.356 7.356 7.513 -0.157 18509 5144 1 10 . 1 1 146 146 CYS N N 146 110.738 110.738 120.496 -9.758 18509 5145 1 10 . 1 1 146 146 CYS C C 146 170.087 170.087 173.992 -3.905 18509 5146 1 10 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.996 -6.919 18509 5147 1 10 . 1 1 146 146 CYS H H 146 9.008 9.008 8.324 0.684 18509 5148 1 10 . 1 1 147 147 GLY N N 147 106.461 106.461 109.936 -3.475 18509 5149 1 10 . 1 1 147 147 GLY C C 147 167.909 167.909 171.852 -3.943 18509 5150 1 10 . 1 1 147 147 GLY CA C 147 42.674 42.674 44.902 -2.228 18509 5151 1 10 . 1 1 147 147 GLY H H 147 8.018 8.018 8.316 -0.298 18509 5152 1 10 . 1 1 148 148 VAL N N 148 124.054 124.054 125.359 -1.305 18509 5153 1 10 . 1 1 148 148 VAL C C 148 172.084 172.084 175.213 -3.129 18509 5154 1 10 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.254 -2.619 18509 5155 1 10 . 1 1 148 148 VAL H H 148 8.434 8.434 7.971 0.463 18509 5156 1 10 . 1 1 149 149 ILE N N 149 126.918 126.918 130.031 -3.113 18509 5157 1 10 . 1 1 149 149 ILE C C 149 171.804 171.804 174.296 -2.492 18509 5158 1 10 . 1 1 149 149 ILE CA C 149 59.184 59.184 60.971 -1.787 18509 5159 1 10 . 1 1 149 149 ILE H H 149 8.613 8.613 8.801 -0.188 18509 5160 1 10 . 1 1 150 150 GLY N N 150 116.493 116.493 115.186 1.307 18509 5161 1 10 . 1 1 150 150 GLY C C 150 170.188 170.188 172.355 -2.167 18509 5162 1 10 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.218 -4.098 18509 5163 1 10 . 1 1 150 150 GLY H H 150 9.283 9.283 8.215 1.068 18509 5164 1 10 . 1 1 151 151 ILE N N 151 120.189 120.189 121.576 -1.387 18509 5165 1 10 . 1 1 151 151 ILE C C 151 172.231 172.231 174.497 -2.266 18509 5166 1 10 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.104 -0.732 18509 5167 1 10 . 1 1 151 151 ILE H H 151 8.943 8.943 8.433 0.510 18509 5168 1 10 . 1 1 152 152 ALA N N 152 129.719 129.719 131.715 -1.996 18509 5169 1 10 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.307 -4.535 18509 5170 1 10 . 1 1 152 152 ALA H H 152 8.170 8.170 8.106 0.064 18509 5171 1 11 . 1 1 2 2 THR C C 2 170.139 170.139 174.037 -3.898 18509 5172 1 11 . 1 1 3 3 LYS N N 3 123.998 123.998 117.481 6.517 18509 5173 1 11 . 1 1 3 3 LYS C C 3 171.607 171.607 173.906 -2.299 18509 5174 1 11 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.387 -3.209 18509 5175 1 11 . 1 1 3 3 LYS H H 3 8.666 8.666 7.453 1.213 18509 5176 1 11 . 1 1 4 4 ALA N N 4 123.295 123.295 121.801 1.494 18509 5177 1 11 . 1 1 4 4 ALA C C 4 172.145 172.145 175.274 -3.129 18509 5178 1 11 . 1 1 4 4 ALA CA C 4 47.504 47.504 51.142 -3.638 18509 5179 1 11 . 1 1 4 4 ALA H H 4 9.116 9.116 8.285 0.831 18509 5180 1 11 . 1 1 5 5 VAL N N 5 121.466 121.466 120.280 1.186 18509 5181 1 11 . 1 1 5 5 VAL C C 5 167.836 167.836 173.928 -6.092 18509 5182 1 11 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.457 -4.582 18509 5183 1 11 . 1 1 5 5 VAL H H 5 9.545 9.545 9.018 0.527 18509 5184 1 11 . 1 1 6 6 ALA N N 6 125.984 125.984 130.507 -4.523 18509 5185 1 11 . 1 1 6 6 ALA C C 6 171.607 171.607 175.452 -3.845 18509 5186 1 11 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.321 -2.850 18509 5187 1 11 . 1 1 6 6 ALA H H 6 9.177 9.177 8.494 0.683 18509 5188 1 11 . 1 1 7 7 VAL N N 7 123.600 123.600 123.549 0.051 18509 5189 1 11 . 1 1 7 7 VAL C C 7 172.244 172.244 175.205 -2.961 18509 5190 1 11 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.326 -2.850 18509 5191 1 11 . 1 1 7 7 VAL H H 7 9.116 9.116 7.995 1.121 18509 5192 1 11 . 1 1 8 8 LEU N N 8 126.455 126.455 129.946 -3.491 18509 5193 1 11 . 1 1 8 8 LEU C C 8 172.557 172.557 175.853 -3.296 18509 5194 1 11 . 1 1 8 8 LEU CA C 8 51.052 51.052 54.326 -3.274 18509 5195 1 11 . 1 1 8 8 LEU H H 8 8.916 8.916 8.521 0.395 18509 5196 1 11 . 1 1 9 9 LYS N N 9 120.820 120.820 121.866 -1.046 18509 5197 1 11 . 1 1 9 9 LYS C C 9 172.509 172.509 175.200 -2.691 18509 5198 1 11 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.525 -3.628 18509 5199 1 11 . 1 1 9 9 LYS H H 9 8.315 8.315 8.539 -0.224 18509 5200 1 11 . 1 1 10 10 GLY N N 10 111.249 111.249 111.422 -0.173 18509 5201 1 11 . 1 1 10 10 GLY C C 10 169.847 169.847 173.195 -3.348 18509 5202 1 11 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.108 -2.833 18509 5203 1 11 . 1 1 10 10 GLY H H 10 8.968 8.968 7.882 1.086 18509 5204 1 11 . 1 1 11 11 ASP N N 11 120.904 120.904 120.364 0.540 18509 5205 1 11 . 1 1 11 11 ASP C C 11 173.132 173.132 177.033 -3.901 18509 5206 1 11 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.313 -3.996 18509 5207 1 11 . 1 1 11 11 ASP H H 11 8.745 8.745 8.104 0.640 18509 5208 1 11 . 1 1 12 12 GLY N N 12 109.862 109.862 107.927 1.935 18509 5209 1 11 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.335 -2.135 18509 5210 1 11 . 1 1 12 12 GLY H H 12 7.985 7.985 7.659 0.326 18509 5211 1 11 . 1 1 13 13 PRO C C 13 173.640 173.640 175.855 -2.215 18509 5212 1 11 . 1 1 14 14 VAL N N 14 120.414 120.414 118.878 1.536 18509 5213 1 11 . 1 1 14 14 VAL C C 14 172.804 172.804 174.900 -2.096 18509 5214 1 11 . 1 1 14 14 VAL CA C 14 59.884 59.884 59.259 0.625 18509 5215 1 11 . 1 1 14 14 VAL H H 14 7.476 7.476 7.988 -0.512 18509 5216 1 11 . 1 1 15 15 GLN N N 15 122.664 122.664 125.973 -3.309 18509 5217 1 11 . 1 1 15 15 GLN C C 15 171.168 171.168 175.531 -4.363 18509 5218 1 11 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.956 -4.277 18509 5219 1 11 . 1 1 15 15 GLN H H 15 7.938 7.938 8.742 -0.804 18509 5220 1 11 . 1 1 16 16 GLY N N 16 107.018 107.018 109.891 -2.873 18509 5221 1 11 . 1 1 16 16 GLY C C 16 167.726 167.726 171.652 -3.926 18509 5222 1 11 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.256 -1.631 18509 5223 1 11 . 1 1 16 16 GLY H H 16 8.288 8.288 8.178 0.110 18509 5224 1 11 . 1 1 17 17 ILE N N 17 120.248 120.248 115.891 4.357 18509 5225 1 11 . 1 1 17 17 ILE C C 17 171.194 171.194 174.084 -2.890 18509 5226 1 11 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.035 -0.538 18509 5227 1 11 . 1 1 17 17 ILE H H 17 7.948 7.948 7.697 0.251 18509 5228 1 11 . 1 1 18 18 ILE N N 18 125.851 125.851 123.459 2.392 18509 5229 1 11 . 1 1 18 18 ILE C C 18 168.889 168.889 175.056 -6.167 18509 5230 1 11 . 1 1 18 18 ILE CA C 18 53.431 53.431 58.555 -5.124 18509 5231 1 11 . 1 1 18 18 ILE H H 18 8.725 8.725 8.345 0.380 18509 5232 1 11 . 1 1 19 19 ASN N N 19 123.256 123.256 123.980 -0.724 18509 5233 1 11 . 1 1 19 19 ASN C C 19 168.903 168.903 173.466 -4.563 18509 5234 1 11 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.954 -2.866 18509 5235 1 11 . 1 1 19 19 ASN H H 19 8.727 8.727 8.459 0.268 18509 5236 1 11 . 1 1 20 20 PHE N N 20 113.849 113.849 119.957 -6.108 18509 5237 1 11 . 1 1 20 20 PHE C C 20 173.219 173.219 174.598 -1.379 18509 5238 1 11 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.348 -5.290 18509 5239 1 11 . 1 1 20 20 PHE H H 20 8.399 8.399 8.847 -0.448 18509 5240 1 11 . 1 1 21 21 GLU N N 21 121.454 121.454 123.434 -1.980 18509 5241 1 11 . 1 1 21 21 GLU C C 21 170.280 170.280 175.891 -5.611 18509 5242 1 11 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.156 -1.112 18509 5243 1 11 . 1 1 21 21 GLU H H 21 9.526 9.526 8.684 0.842 18509 5244 1 11 . 1 1 22 22 GLN N N 22 130.340 130.340 125.305 5.035 18509 5245 1 11 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.201 -4.021 18509 5246 1 11 . 1 1 22 22 GLN H H 22 9.305 9.305 8.845 0.460 18509 5247 1 11 . 1 1 23 23 LYS N N 23 128.657 128.657 127.815 0.842 18509 5248 1 11 . 1 1 23 23 LYS CA C 23 57.241 57.241 55.559 1.682 18509 5249 1 11 . 1 1 23 23 LYS H H 23 9.088 9.088 8.230 0.858 18509 5250 1 11 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.624 -7.232 18509 5251 1 11 . 1 1 25 25 SER CA C 25 58.078 58.078 58.943 -0.865 18509 5252 1 11 . 1 1 27 27 GLY N N 27 108.125 108.125 110.735 -2.610 18509 5253 1 11 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.706 -1.781 18509 5254 1 11 . 1 1 27 27 GLY H H 27 8.032 8.032 8.211 -0.179 18509 5255 1 11 . 1 1 28 28 PRO C C 28 173.128 173.128 176.285 -3.157 18509 5256 1 11 . 1 1 29 29 VAL N N 29 121.267 121.267 119.491 1.776 18509 5257 1 11 . 1 1 29 29 VAL C C 29 172.198 172.198 175.806 -3.608 18509 5258 1 11 . 1 1 29 29 VAL CA C 29 57.720 57.720 60.620 -2.900 18509 5259 1 11 . 1 1 29 29 VAL H H 29 9.089 9.089 8.157 0.932 18509 5260 1 11 . 1 1 30 30 LYS N N 30 127.589 127.589 126.704 0.885 18509 5261 1 11 . 1 1 30 30 LYS C C 30 172.098 172.098 175.124 -3.026 18509 5262 1 11 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.417 -2.775 18509 5263 1 11 . 1 1 30 30 LYS H H 30 9.200 9.200 8.655 0.545 18509 5264 1 11 . 1 1 31 31 VAL N N 31 126.037 126.037 124.036 2.001 18509 5265 1 11 . 1 1 31 31 VAL C C 31 172.244 172.244 174.274 -2.030 18509 5266 1 11 . 1 1 31 31 VAL CA C 31 57.139 57.139 60.695 -3.556 18509 5267 1 11 . 1 1 31 31 VAL H H 31 9.282 9.282 8.281 1.001 18509 5268 1 11 . 1 1 32 32 TRP N N 32 125.414 125.414 129.851 -4.437 18509 5269 1 11 . 1 1 32 32 TRP C C 32 170.156 170.156 174.161 -4.005 18509 5270 1 11 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.031 -2.893 18509 5271 1 11 . 1 1 32 32 TRP H H 32 8.983 8.983 8.186 0.797 18509 5272 1 11 . 1 1 33 33 GLY N N 33 107.848 107.848 112.808 -4.960 18509 5273 1 11 . 1 1 33 33 GLY C C 33 168.400 168.400 170.876 -2.476 18509 5274 1 11 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.688 -3.121 18509 5275 1 11 . 1 1 33 33 GLY H H 33 8.360 8.360 8.461 -0.101 18509 5276 1 11 . 1 1 34 34 SER N N 34 114.377 114.377 117.763 -3.386 18509 5277 1 11 . 1 1 34 34 SER C C 34 169.618 169.618 174.018 -4.400 18509 5278 1 11 . 1 1 34 34 SER CA C 34 53.875 53.875 54.676 -0.801 18509 5279 1 11 . 1 1 34 34 SER H H 34 7.838 7.838 7.633 0.205 18509 5280 1 11 . 1 1 35 35 ILE N N 35 123.149 123.149 121.933 1.216 18509 5281 1 11 . 1 1 35 35 ILE C C 35 169.713 169.713 173.987 -4.274 18509 5282 1 11 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.093 -2.324 18509 5283 1 11 . 1 1 35 35 ILE H H 35 8.496 8.496 8.458 0.038 18509 5284 1 11 . 1 1 36 36 LYS N N 36 123.803 123.803 127.542 -3.739 18509 5285 1 11 . 1 1 36 36 LYS C C 36 172.260 172.260 175.842 -3.582 18509 5286 1 11 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.871 -3.721 18509 5287 1 11 . 1 1 36 36 LYS H H 36 9.091 9.091 8.741 0.350 18509 5288 1 11 . 1 1 37 37 GLY N N 37 105.495 105.495 112.874 -7.379 18509 5289 1 11 . 1 1 37 37 GLY C C 37 171.641 171.641 173.249 -1.608 18509 5290 1 11 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.422 -1.061 18509 5291 1 11 . 1 1 37 37 GLY H H 37 8.237 8.237 7.994 0.243 18509 5292 1 11 . 1 1 38 38 LEU N N 38 120.966 120.966 120.039 0.927 18509 5293 1 11 . 1 1 38 38 LEU C C 38 174.112 174.112 177.615 -3.503 18509 5294 1 11 . 1 1 38 38 LEU CA C 38 50.471 50.471 55.509 -5.038 18509 5295 1 11 . 1 1 38 38 LEU H H 38 8.156 8.156 8.532 -0.376 18509 5296 1 11 . 1 1 39 39 THR N N 39 110.363 110.363 114.293 -3.930 18509 5297 1 11 . 1 1 39 39 THR C C 39 173.102 173.102 174.483 -1.381 18509 5298 1 11 . 1 1 39 39 THR CA C 39 58.194 58.194 63.622 -5.428 18509 5299 1 11 . 1 1 39 39 THR H H 39 8.660 8.660 8.270 0.390 18509 5300 1 11 . 1 1 40 40 GLU N N 40 125.818 125.818 129.061 -3.243 18509 5301 1 11 . 1 1 40 40 GLU C C 40 173.134 173.134 175.963 -2.829 18509 5302 1 11 . 1 1 40 40 GLU CA C 40 54.356 54.356 54.227 0.129 18509 5303 1 11 . 1 1 40 40 GLU H H 40 8.804 8.804 8.061 0.743 18509 5304 1 11 . 1 1 41 41 GLY N N 41 113.875 113.875 108.291 5.584 18509 5305 1 11 . 1 1 41 41 GLY C C 41 170.046 170.046 173.283 -3.237 18509 5306 1 11 . 1 1 41 41 GLY CA C 41 40.054 40.054 46.333 -6.279 18509 5307 1 11 . 1 1 41 41 GLY H H 41 8.763 8.763 8.155 0.608 18509 5308 1 11 . 1 1 42 42 LEU N N 42 120.137 120.137 111.998 8.139 18509 5309 1 11 . 1 1 42 42 LEU C C 42 174.218 174.218 174.718 -0.500 18509 5310 1 11 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.861 -2.707 18509 5311 1 11 . 1 1 42 42 LEU H H 42 8.313 8.313 8.034 0.279 18509 5312 1 11 . 1 1 43 43 HIS N N 43 114.385 114.385 117.958 -3.573 18509 5313 1 11 . 1 1 43 43 HIS C C 43 171.504 171.504 174.863 -3.359 18509 5314 1 11 . 1 1 43 43 HIS CA C 43 50.985 50.985 54.821 -3.836 18509 5315 1 11 . 1 1 43 43 HIS H H 43 8.712 8.712 7.793 0.919 18509 5316 1 11 . 1 1 44 44 GLY N N 44 108.872 108.872 111.282 -2.410 18509 5317 1 11 . 1 1 44 44 GLY C C 44 168.656 168.656 171.462 -2.806 18509 5318 1 11 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.710 -1.515 18509 5319 1 11 . 1 1 44 44 GLY H H 44 8.875 8.875 8.469 0.406 18509 5320 1 11 . 1 1 45 45 PHE N N 45 126.439 126.439 114.808 11.631 18509 5321 1 11 . 1 1 45 45 PHE CA C 45 53.098 53.098 55.964 -2.866 18509 5322 1 11 . 1 1 45 45 PHE H H 45 8.111 8.111 8.283 -0.172 18509 5323 1 11 . 1 1 46 46 HIS N N 46 115.353 115.353 118.080 -2.727 18509 5324 1 11 . 1 1 46 46 HIS C C 46 172.415 172.415 174.533 -2.118 18509 5325 1 11 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.434 -5.228 18509 5326 1 11 . 1 1 46 46 HIS H H 46 8.107 8.107 8.329 -0.222 18509 5327 1 11 . 1 1 47 47 VAL N N 47 120.548 120.548 119.050 1.498 18509 5328 1 11 . 1 1 47 47 VAL C C 47 173.900 173.900 174.338 -0.438 18509 5329 1 11 . 1 1 47 47 VAL CA C 47 58.792 58.792 62.317 -3.525 18509 5330 1 11 . 1 1 47 47 VAL H H 47 9.366 9.366 8.767 0.599 18509 5331 1 11 . 1 1 48 48 HIS N N 48 129.236 129.236 124.050 5.186 18509 5332 1 11 . 1 1 48 48 HIS C C 48 171.084 171.084 173.454 -2.370 18509 5333 1 11 . 1 1 48 48 HIS CA C 48 52.756 52.756 53.603 -0.847 18509 5334 1 11 . 1 1 48 48 HIS H H 48 10.210 10.210 8.303 1.907 18509 5335 1 11 . 1 1 49 49 GLU N N 49 118.119 118.119 125.704 -7.585 18509 5336 1 11 . 1 1 49 49 GLU C C 49 171.635 171.635 175.235 -3.600 18509 5337 1 11 . 1 1 49 49 GLU CA C 49 57.759 57.759 54.243 3.516 18509 5338 1 11 . 1 1 49 49 GLU H H 49 8.492 8.492 8.083 0.409 18509 5339 1 11 . 1 1 50 50 PHE N N 50 110.329 110.329 122.893 -12.564 18509 5340 1 11 . 1 1 50 50 PHE C C 50 175.252 175.252 175.546 -0.294 18509 5341 1 11 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.420 -5.521 18509 5342 1 11 . 1 1 50 50 PHE H H 50 8.580 8.580 8.478 0.102 18509 5343 1 11 . 1 1 51 51 GLY N N 51 119.251 119.251 114.076 5.175 18509 5344 1 11 . 1 1 51 51 GLY C C 51 168.248 168.248 173.490 -5.242 18509 5345 1 11 . 1 1 51 51 GLY H H 51 10.208 10.208 8.250 1.958 18509 5346 1 11 . 1 1 52 52 ASP N N 52 114.958 114.958 124.875 -9.917 18509 5347 1 11 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.583 -5.692 18509 5348 1 11 . 1 1 52 52 ASP H H 52 5.834 5.834 8.264 -2.430 18509 5349 1 11 . 1 1 53 53 ASN N N 53 128.224 128.224 119.018 9.206 18509 5350 1 11 . 1 1 53 53 ASN CA C 53 48.233 48.233 51.551 -3.318 18509 5351 1 11 . 1 1 53 53 ASN H H 53 9.360 9.360 8.002 1.358 18509 5352 1 11 . 1 1 54 54 THR C C 54 168.656 168.656 174.878 -6.222 18509 5353 1 11 . 1 1 55 55 ALA N N 55 126.661 126.661 118.290 8.371 18509 5354 1 11 . 1 1 55 55 ALA C C 55 174.185 174.185 175.978 -1.793 18509 5355 1 11 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.159 -5.004 18509 5356 1 11 . 1 1 55 55 ALA H H 55 8.390 8.390 7.815 0.575 18509 5357 1 11 . 1 1 56 56 GLY N N 56 107.903 107.903 107.755 0.148 18509 5358 1 11 . 1 1 56 56 GLY C C 56 171.578 171.578 173.255 -1.677 18509 5359 1 11 . 1 1 56 56 GLY CA C 56 42.580 42.580 44.622 -2.042 18509 5360 1 11 . 1 1 56 56 GLY H H 56 7.282 7.282 7.434 -0.152 18509 5361 1 11 . 1 1 57 57 CYS N N 57 117.952 117.952 124.216 -6.264 18509 5362 1 11 . 1 1 57 57 CYS C C 57 175.209 175.209 175.386 -0.177 18509 5363 1 11 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.362 -7.274 18509 5364 1 11 . 1 1 57 57 CYS H H 57 8.900 8.900 8.232 0.668 18509 5365 1 11 . 1 1 58 58 THR N N 58 119.852 119.852 117.602 2.250 18509 5366 1 11 . 1 1 58 58 THR CA C 58 58.239 58.239 64.392 -6.154 18509 5367 1 11 . 1 1 58 58 THR H H 58 8.505 8.505 7.803 0.702 18509 5368 1 11 . 1 1 59 59 SER C C 59 170.763 170.763 174.783 -4.020 18509 5369 1 11 . 1 1 59 59 SER CA C 59 55.609 55.609 60.946 -5.337 18509 5370 1 11 . 1 1 60 60 ALA N N 60 119.753 119.753 121.321 -1.568 18509 5371 1 11 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.648 -2.708 18509 5372 1 11 . 1 1 60 60 ALA H H 60 6.898 6.898 8.055 -1.157 18509 5373 1 11 . 1 1 61 61 GLY N N 61 101.351 101.351 108.317 -6.966 18509 5374 1 11 . 1 1 61 61 GLY CA C 61 42.805 42.805 46.672 -3.867 18509 5375 1 11 . 1 1 61 61 GLY H H 61 7.730 7.730 7.870 -0.140 18509 5376 1 11 . 1 1 62 62 PRO C C 62 172.276 172.276 175.876 -3.600 18509 5377 1 11 . 1 1 63 63 HIS N N 63 115.023 115.023 116.544 -1.521 18509 5378 1 11 . 1 1 63 63 HIS CA C 63 52.119 52.119 57.070 -4.951 18509 5379 1 11 . 1 1 63 63 HIS H H 63 7.474 7.474 8.157 -0.683 18509 5380 1 11 . 1 1 64 64 PHE C C 64 171.731 171.731 175.128 -3.397 18509 5381 1 11 . 1 1 65 65 ASN N N 65 126.978 126.978 121.100 5.878 18509 5382 1 11 . 1 1 65 65 ASN CA C 65 47.753 47.753 51.850 -4.097 18509 5383 1 11 . 1 1 65 65 ASN H H 65 9.426 9.426 8.868 0.558 18509 5384 1 11 . 1 1 67 67 LEU N N 67 117.937 117.937 118.697 -0.760 18509 5385 1 11 . 1 1 67 67 LEU C C 67 172.580 172.580 176.880 -4.300 18509 5386 1 11 . 1 1 67 67 LEU CA C 67 50.911 50.911 54.367 -3.456 18509 5387 1 11 . 1 1 67 67 LEU H H 67 7.720 7.720 7.942 -0.222 18509 5388 1 11 . 1 1 68 68 SER N N 68 110.842 110.842 114.837 -3.995 18509 5389 1 11 . 1 1 68 68 SER CA C 68 55.953 55.953 59.018 -3.065 18509 5390 1 11 . 1 1 68 68 SER H H 68 7.428 7.428 7.458 -0.030 18509 5391 1 11 . 1 1 69 69 ARG N N 69 120.782 120.782 119.858 0.924 18509 5392 1 11 . 1 1 69 69 ARG C C 69 173.381 173.381 176.012 -2.631 18509 5393 1 11 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.919 -5.376 18509 5394 1 11 . 1 1 69 69 ARG H H 69 8.508 8.508 8.161 0.347 18509 5395 1 11 . 1 1 70 70 LYS N N 70 118.055 118.055 117.687 0.368 18509 5396 1 11 . 1 1 70 70 LYS C C 70 169.994 169.994 175.475 -5.481 18509 5397 1 11 . 1 1 70 70 LYS CA C 70 52.596 52.596 58.561 -5.965 18509 5398 1 11 . 1 1 70 70 LYS H H 70 8.745 8.745 7.765 0.980 18509 5399 1 11 . 1 1 71 71 HIS N N 71 111.871 111.871 115.410 -3.539 18509 5400 1 11 . 1 1 71 71 HIS C C 71 171.534 171.534 175.804 -4.270 18509 5401 1 11 . 1 1 71 71 HIS CA C 71 52.549 52.549 58.014 -5.465 18509 5402 1 11 . 1 1 71 71 HIS H H 71 7.152 7.152 8.253 -1.101 18509 5403 1 11 . 1 1 72 72 GLY N N 72 112.910 112.910 106.559 6.351 18509 5404 1 11 . 1 1 72 72 GLY C C 72 168.634 168.634 173.652 -5.018 18509 5405 1 11 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.764 -3.490 18509 5406 1 11 . 1 1 72 72 GLY H H 72 7.209 7.209 8.172 -0.963 18509 5407 1 11 . 1 1 73 73 GLY N N 73 105.207 105.207 107.217 -2.010 18509 5408 1 11 . 1 1 73 73 GLY CA C 73 41.221 41.221 42.843 -1.622 18509 5409 1 11 . 1 1 73 73 GLY H H 73 8.789 8.789 7.982 0.807 18509 5410 1 11 . 1 1 74 74 PRO C C 74 175.753 175.753 176.933 -1.180 18509 5411 1 11 . 1 1 75 75 LYS N N 75 114.868 114.868 115.502 -0.634 18509 5412 1 11 . 1 1 75 75 LYS C C 75 173.640 173.640 175.525 -1.885 18509 5413 1 11 . 1 1 75 75 LYS CA C 75 51.103 51.103 55.844 -4.741 18509 5414 1 11 . 1 1 75 75 LYS H H 75 8.651 8.651 7.946 0.705 18509 5415 1 11 . 1 1 76 76 ASP N N 76 120.414 120.414 118.220 2.194 18509 5416 1 11 . 1 1 76 76 ASP C C 76 172.557 172.557 174.564 -2.007 18509 5417 1 11 . 1 1 76 76 ASP CA C 76 51.309 51.309 55.394 -4.085 18509 5418 1 11 . 1 1 76 76 ASP H H 76 7.461 7.461 7.760 -0.299 18509 5419 1 11 . 1 1 77 77 GLU N N 77 120.820 120.820 118.368 2.452 18509 5420 1 11 . 1 1 77 77 GLU C C 77 174.101 174.101 176.181 -2.080 18509 5421 1 11 . 1 1 77 77 GLU CA C 77 55.513 55.513 56.714 -1.201 18509 5422 1 11 . 1 1 77 77 GLU H H 77 8.315 8.315 8.369 -0.054 18509 5423 1 11 . 1 1 78 78 GLU N N 78 119.251 119.251 120.122 -0.871 18509 5424 1 11 . 1 1 78 78 GLU C C 78 168.285 168.285 175.297 -7.012 18509 5425 1 11 . 1 1 78 78 GLU CA C 78 52.078 52.078 56.325 -4.247 18509 5426 1 11 . 1 1 78 78 GLU H H 78 8.109 8.109 8.076 0.033 18509 5427 1 11 . 1 1 79 79 ARG N N 79 118.991 118.991 124.003 -5.012 18509 5428 1 11 . 1 1 79 79 ARG C C 79 172.123 172.123 175.183 -3.060 18509 5429 1 11 . 1 1 79 79 ARG CA C 79 51.074 51.074 55.240 -4.166 18509 5430 1 11 . 1 1 79 79 ARG H H 79 6.999 6.999 8.534 -1.535 18509 5431 1 11 . 1 1 80 80 HIS N N 80 118.000 118.000 119.590 -1.590 18509 5432 1 11 . 1 1 80 80 HIS CA C 80 49.953 49.953 57.794 -7.841 18509 5433 1 11 . 1 1 80 80 HIS H H 80 8.355 8.355 9.102 -0.747 18509 5434 1 11 . 1 1 81 81 VAL C C 81 173.460 173.460 177.132 -3.672 18509 5435 1 11 . 1 1 82 82 GLY N N 82 97.322 97.322 106.970 -9.648 18509 5436 1 11 . 1 1 82 82 GLY C C 82 170.370 170.370 173.777 -3.407 18509 5437 1 11 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.777 -3.089 18509 5438 1 11 . 1 1 82 82 GLY H H 82 8.487 8.487 7.614 0.873 18509 5439 1 11 . 1 1 83 83 ASP N N 83 120.890 120.890 125.342 -4.452 18509 5440 1 11 . 1 1 83 83 ASP C C 83 168.737 168.737 174.663 -5.926 18509 5441 1 11 . 1 1 83 83 ASP CA C 83 52.918 52.918 54.724 -1.806 18509 5442 1 11 . 1 1 83 83 ASP H H 83 7.127 7.127 8.000 -0.873 18509 5443 1 11 . 1 1 84 84 LEU N N 84 120.154 120.154 119.557 0.597 18509 5444 1 11 . 1 1 84 84 LEU C C 84 173.212 173.212 174.617 -1.405 18509 5445 1 11 . 1 1 84 84 LEU CA C 84 50.433 50.433 53.951 -3.518 18509 5446 1 11 . 1 1 84 84 LEU H H 84 7.128 7.128 7.569 -0.441 18509 5447 1 11 . 1 1 85 85 GLY N N 85 106.867 106.867 105.689 1.178 18509 5448 1 11 . 1 1 85 85 GLY C C 85 167.654 167.654 172.145 -4.491 18509 5449 1 11 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.058 -2.047 18509 5450 1 11 . 1 1 85 85 GLY H H 85 8.260 8.260 7.647 0.613 18509 5451 1 11 . 1 1 86 86 ASN N N 86 117.454 117.454 118.379 -0.925 18509 5452 1 11 . 1 1 86 86 ASN C C 86 173.942 173.942 175.080 -1.138 18509 5453 1 11 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.117 -2.851 18509 5454 1 11 . 1 1 86 86 ASN H H 86 8.041 8.041 8.413 -0.372 18509 5455 1 11 . 1 1 87 87 VAL N N 87 113.370 113.370 125.610 -12.240 18509 5456 1 11 . 1 1 87 87 VAL C C 87 171.526 171.526 175.071 -3.545 18509 5457 1 11 . 1 1 87 87 VAL CA C 87 55.708 55.708 61.744 -6.036 18509 5458 1 11 . 1 1 87 87 VAL H H 87 8.960 8.960 7.814 1.146 18509 5459 1 11 . 1 1 88 88 THR N N 88 117.939 117.939 122.495 -4.556 18509 5460 1 11 . 1 1 88 88 THR C C 88 170.367 170.367 172.667 -2.300 18509 5461 1 11 . 1 1 88 88 THR CA C 88 58.694 58.694 62.370 -3.675 18509 5462 1 11 . 1 1 88 88 THR H H 88 8.681 8.681 8.525 0.156 18509 5463 1 11 . 1 1 89 89 ALA N N 89 128.674 128.674 130.138 -1.464 18509 5464 1 11 . 1 1 89 89 ALA C C 89 174.480 174.480 175.671 -1.191 18509 5465 1 11 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.180 -3.811 18509 5466 1 11 . 1 1 89 89 ALA H H 89 9.377 9.377 7.952 1.425 18509 5467 1 11 . 1 1 90 90 ASP N N 90 124.235 124.235 123.439 0.796 18509 5468 1 11 . 1 1 90 90 ASP C C 90 173.825 173.825 177.086 -3.261 18509 5469 1 11 . 1 1 90 90 ASP CA C 90 49.347 49.347 54.422 -5.075 18509 5470 1 11 . 1 1 90 90 ASP H H 90 8.455 8.455 8.740 -0.285 18509 5471 1 11 . 1 1 91 91 LYS N N 91 114.942 114.942 119.984 -5.042 18509 5472 1 11 . 1 1 91 91 LYS C C 91 174.101 174.101 176.739 -2.638 18509 5473 1 11 . 1 1 91 91 LYS CA C 91 55.279 55.279 59.348 -4.069 18509 5474 1 11 . 1 1 91 91 LYS H H 91 8.231 8.231 8.504 -0.273 18509 5475 1 11 . 1 1 92 92 ASP N N 92 119.251 119.251 114.032 5.219 18509 5476 1 11 . 1 1 92 92 ASP C C 92 173.020 173.020 175.136 -2.116 18509 5477 1 11 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.689 -2.562 18509 5478 1 11 . 1 1 92 92 ASP H H 92 8.109 8.109 8.325 -0.216 18509 5479 1 11 . 1 1 93 93 GLY N N 93 110.868 110.868 107.265 3.603 18509 5480 1 11 . 1 1 93 93 GLY C C 93 169.706 169.706 173.241 -3.535 18509 5481 1 11 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.385 -1.622 18509 5482 1 11 . 1 1 93 93 GLY H H 93 8.405 8.405 8.308 0.097 18509 5483 1 11 . 1 1 94 94 VAL N N 94 118.755 118.755 121.687 -2.932 18509 5484 1 11 . 1 1 94 94 VAL C C 94 173.510 173.510 174.149 -0.639 18509 5485 1 11 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.703 -3.518 18509 5486 1 11 . 1 1 94 94 VAL H H 94 7.814 7.814 7.893 -0.079 18509 5487 1 11 . 1 1 95 95 ALA N N 95 131.313 131.313 130.431 0.882 18509 5488 1 11 . 1 1 95 95 ALA C C 95 171.635 171.635 175.571 -3.936 18509 5489 1 11 . 1 1 95 95 ALA CA C 95 46.914 46.914 49.984 -3.070 18509 5490 1 11 . 1 1 95 95 ALA H H 95 9.763 9.763 8.695 1.068 18509 5491 1 11 . 1 1 96 96 ASP N N 96 125.170 125.170 125.663 -0.493 18509 5492 1 11 . 1 1 96 96 ASP C C 96 172.336 172.336 175.744 -3.408 18509 5493 1 11 . 1 1 96 96 ASP H H 96 8.515 8.515 8.730 -0.215 18509 5494 1 11 . 1 1 97 97 VAL N N 97 125.879 125.879 129.222 -3.343 18509 5495 1 11 . 1 1 97 97 VAL C C 97 173.488 173.488 174.422 -0.934 18509 5496 1 11 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.572 -3.329 18509 5497 1 11 . 1 1 97 97 VAL H H 97 8.703 8.703 8.791 -0.088 18509 5498 1 11 . 1 1 98 98 SER N N 98 123.017 123.017 122.851 0.166 18509 5499 1 11 . 1 1 98 98 SER C C 98 169.715 169.715 173.518 -3.803 18509 5500 1 11 . 1 1 98 98 SER CA C 98 55.068 55.068 57.468 -2.400 18509 5501 1 11 . 1 1 98 98 SER H H 98 8.784 8.784 8.577 0.207 18509 5502 1 11 . 1 1 99 99 ILE N N 99 125.807 125.807 120.975 4.832 18509 5503 1 11 . 1 1 99 99 ILE C C 99 171.321 171.321 173.654 -2.333 18509 5504 1 11 . 1 1 99 99 ILE CA C 99 57.155 57.155 59.611 -2.455 18509 5505 1 11 . 1 1 99 99 ILE H H 99 9.411 9.411 7.774 1.637 18509 5506 1 11 . 1 1 100 100 GLU N N 100 124.068 124.068 120.719 3.349 18509 5507 1 11 . 1 1 100 100 GLU C C 100 172.098 172.098 174.319 -2.221 18509 5508 1 11 . 1 1 100 100 GLU CA C 100 52.290 52.290 56.041 -3.751 18509 5509 1 11 . 1 1 100 100 GLU H H 100 8.652 8.652 8.535 0.117 18509 5510 1 11 . 1 1 101 101 ASP N N 101 126.109 126.109 123.283 2.826 18509 5511 1 11 . 1 1 101 101 ASP C C 101 171.144 171.144 175.195 -4.051 18509 5512 1 11 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.300 -1.881 18509 5513 1 11 . 1 1 101 101 ASP H H 101 9.317 9.317 7.996 1.321 18509 5514 1 11 . 1 1 102 102 SER N N 102 118.470 118.470 117.350 1.120 18509 5515 1 11 . 1 1 102 102 SER C C 102 171.596 171.596 174.833 -3.237 18509 5516 1 11 . 1 1 102 102 SER CA C 102 55.245 55.245 59.704 -4.459 18509 5517 1 11 . 1 1 102 102 SER H H 102 8.933 8.933 8.641 0.292 18509 5518 1 11 . 1 1 103 103 VAL N N 103 123.179 123.179 121.686 1.493 18509 5519 1 11 . 1 1 103 103 VAL CA C 103 61.450 61.450 61.938 -0.487 18509 5520 1 11 . 1 1 103 103 VAL H H 103 8.148 8.148 8.108 0.040 18509 5521 1 11 . 1 1 104 104 ILE C C 104 169.576 169.576 176.223 -6.647 18509 5522 1 11 . 1 1 104 104 ILE CA C 104 60.194 60.194 62.875 -2.681 18509 5523 1 11 . 1 1 105 105 SER N N 105 107.618 107.618 116.136 -8.518 18509 5524 1 11 . 1 1 105 105 SER C C 105 170.046 170.046 173.698 -3.652 18509 5525 1 11 . 1 1 105 105 SER CA C 105 52.550 52.550 58.791 -6.241 18509 5526 1 11 . 1 1 105 105 SER H H 105 6.988 6.988 7.757 -0.769 18509 5527 1 11 . 1 1 106 106 LEU N N 106 120.137 120.137 120.017 0.120 18509 5528 1 11 . 1 1 106 106 LEU H H 106 8.313 8.313 8.194 0.119 18509 5529 1 11 . 1 1 107 107 SER C C 107 170.701 170.701 174.444 -3.743 18509 5530 1 11 . 1 1 107 107 SER CA C 107 54.540 54.540 58.755 -4.215 18509 5531 1 11 . 1 1 108 108 GLY N N 108 107.603 107.603 113.822 -6.219 18509 5532 1 11 . 1 1 108 108 GLY C C 108 173.128 173.128 174.193 -1.065 18509 5533 1 11 . 1 1 108 108 GLY CA C 108 41.287 41.287 45.205 -3.918 18509 5534 1 11 . 1 1 108 108 GLY H H 108 8.717 8.717 8.038 0.679 18509 5535 1 11 . 1 1 109 109 ASP N N 109 120.664 120.664 124.855 -4.191 18509 5536 1 11 . 1 1 109 109 ASP C C 109 171.904 171.904 176.446 -4.542 18509 5537 1 11 . 1 1 109 109 ASP H H 109 9.019 9.019 9.108 -0.089 18509 5538 1 11 . 1 1 110 110 HIS N N 110 116.324 116.324 117.194 -0.870 18509 5539 1 11 . 1 1 110 110 HIS H H 110 9.283 9.283 8.674 0.609 18509 5540 1 11 . 1 1 111 111 SER N N 111 110.225 110.225 115.515 -5.290 18509 5541 1 11 . 1 1 111 111 SER CA C 111 54.681 54.681 57.535 -2.854 18509 5542 1 11 . 1 1 111 111 SER H H 111 7.156 7.156 8.366 -1.210 18509 5543 1 11 . 1 1 112 112 ILE N N 112 117.053 117.053 125.026 -7.973 18509 5544 1 11 . 1 1 112 112 ILE C C 112 171.419 171.419 176.097 -4.678 18509 5545 1 11 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.962 -4.723 18509 5546 1 11 . 1 1 112 112 ILE H H 112 7.837 7.837 8.647 -0.810 18509 5547 1 11 . 1 1 113 113 ILE N N 113 121.032 121.032 117.038 3.994 18509 5548 1 11 . 1 1 113 113 ILE C C 113 173.604 173.604 177.218 -3.614 18509 5549 1 11 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.575 -2.257 18509 5550 1 11 . 1 1 113 113 ILE H H 113 7.592 7.592 7.566 0.026 18509 5551 1 11 . 1 1 114 114 GLY N N 114 112.661 112.661 112.985 -0.324 18509 5552 1 11 . 1 1 114 114 GLY C C 114 169.739 169.739 174.235 -4.496 18509 5553 1 11 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.692 -3.782 18509 5554 1 11 . 1 1 114 114 GLY H H 114 9.575 9.575 8.423 1.152 18509 5555 1 11 . 1 1 115 115 ARG N N 115 118.398 118.398 122.085 -3.687 18509 5556 1 11 . 1 1 115 115 ARG C C 115 171.079 171.079 175.053 -3.974 18509 5557 1 11 . 1 1 115 115 ARG CA C 115 51.663 51.663 53.906 -2.243 18509 5558 1 11 . 1 1 115 115 ARG H H 115 7.464 7.464 7.666 -0.202 18509 5559 1 11 . 1 1 116 116 THR N N 116 112.218 112.218 121.056 -8.838 18509 5560 1 11 . 1 1 116 116 THR C C 116 169.821 169.821 174.676 -4.855 18509 5561 1 11 . 1 1 116 116 THR CA C 116 59.633 59.633 61.940 -2.307 18509 5562 1 11 . 1 1 116 116 THR H H 116 6.677 6.677 8.571 -1.894 18509 5563 1 11 . 1 1 117 117 LEU N N 117 129.477 129.477 125.771 3.706 18509 5564 1 11 . 1 1 117 117 LEU C C 117 171.126 171.126 175.081 -3.955 18509 5565 1 11 . 1 1 117 117 LEU CA C 117 50.415 50.415 53.869 -3.454 18509 5566 1 11 . 1 1 117 117 LEU H H 117 8.799 8.799 9.042 -0.243 18509 5567 1 11 . 1 1 118 118 VAL N N 118 125.091 125.091 123.151 1.940 18509 5568 1 11 . 1 1 118 118 VAL C C 118 170.267 170.267 174.759 -4.492 18509 5569 1 11 . 1 1 118 118 VAL CA C 118 58.139 58.139 59.929 -1.790 18509 5570 1 11 . 1 1 118 118 VAL H H 118 8.906 8.906 8.346 0.560 18509 5571 1 11 . 1 1 119 119 VAL N N 119 120.716 120.716 122.896 -2.180 18509 5572 1 11 . 1 1 119 119 VAL C C 119 171.175 171.175 173.731 -2.556 18509 5573 1 11 . 1 1 119 119 VAL CA C 119 55.271 55.271 60.401 -5.130 18509 5574 1 11 . 1 1 119 119 VAL H H 119 7.982 7.982 7.742 0.240 18509 5575 1 11 . 1 1 120 120 HIS N N 120 125.052 125.052 123.560 1.492 18509 5576 1 11 . 1 1 120 120 HIS C C 120 172.599 172.599 174.258 -1.659 18509 5577 1 11 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.642 -2.248 18509 5578 1 11 . 1 1 120 120 HIS H H 120 8.935 8.935 8.693 0.242 18509 5579 1 11 . 1 1 121 121 GLU N N 121 121.453 121.453 124.894 -3.441 18509 5580 1 11 . 1 1 121 121 GLU C C 121 172.304 172.304 175.464 -3.160 18509 5581 1 11 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.852 -0.762 18509 5582 1 11 . 1 1 121 121 GLU H H 121 9.178 9.178 8.521 0.657 18509 5583 1 11 . 1 1 122 122 LYS N N 122 115.248 115.248 122.000 -6.752 18509 5584 1 11 . 1 1 122 122 LYS C C 122 171.523 171.523 174.287 -2.764 18509 5585 1 11 . 1 1 122 122 LYS CA C 122 50.619 50.619 54.920 -4.301 18509 5586 1 11 . 1 1 122 122 LYS H H 122 8.478 8.478 8.032 0.446 18509 5587 1 11 . 1 1 123 123 ALA N N 123 120.866 120.866 127.177 -6.311 18509 5588 1 11 . 1 1 123 123 ALA C C 123 173.219 173.219 176.613 -3.394 18509 5589 1 11 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.705 -3.855 18509 5590 1 11 . 1 1 123 123 ALA H H 123 7.796 7.796 8.662 -0.866 18509 5591 1 11 . 1 1 124 124 ASP N N 124 121.799 121.799 125.558 -3.759 18509 5592 1 11 . 1 1 124 124 ASP C C 124 174.458 174.458 175.597 -1.139 18509 5593 1 11 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.897 -4.489 18509 5594 1 11 . 1 1 124 124 ASP H H 124 10.165 10.165 8.164 2.001 18509 5595 1 11 . 1 1 125 125 ASP N N 125 129.369 129.369 126.391 2.978 18509 5596 1 11 . 1 1 125 125 ASP C C 125 175.231 175.231 177.506 -2.275 18509 5597 1 11 . 1 1 125 125 ASP CA C 125 50.939 50.939 52.907 -1.968 18509 5598 1 11 . 1 1 125 125 ASP H H 125 10.055 10.055 7.876 2.179 18509 5599 1 11 . 1 1 126 126 LEU N N 126 117.190 117.190 122.303 -5.113 18509 5600 1 11 . 1 1 126 126 LEU C C 126 173.964 173.964 177.967 -4.003 18509 5601 1 11 . 1 1 126 126 LEU H H 126 10.483 10.483 8.575 1.908 18509 5602 1 11 . 1 1 127 127 GLY N N 127 103.809 103.809 106.448 -2.639 18509 5603 1 11 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.601 -3.723 18509 5604 1 11 . 1 1 127 127 GLY H H 127 8.637 8.637 8.644 -0.007 18509 5605 1 11 . 1 1 128 128 LYS N N 128 118.290 118.290 120.234 -1.944 18509 5606 1 11 . 1 1 128 128 LYS CA C 128 51.740 51.740 55.183 -3.443 18509 5607 1 11 . 1 1 128 128 LYS H H 128 7.158 7.158 7.847 -0.689 18509 5608 1 11 . 1 1 129 129 GLY N N 129 108.507 108.507 108.636 -0.129 18509 5609 1 11 . 1 1 129 129 GLY C C 129 171.524 171.524 174.982 -3.458 18509 5610 1 11 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.926 -4.814 18509 5611 1 11 . 1 1 129 129 GLY H H 129 8.913 8.913 8.698 0.215 18509 5612 1 11 . 1 1 130 130 GLY N N 130 108.537 108.537 107.885 0.652 18509 5613 1 11 . 1 1 130 130 GLY C C 130 169.994 169.994 173.006 -3.012 18509 5614 1 11 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.799 -2.380 18509 5615 1 11 . 1 1 130 130 GLY H H 130 8.723 8.723 8.214 0.509 18509 5616 1 11 . 1 1 131 131 ASN N N 131 111.951 111.951 116.982 -5.031 18509 5617 1 11 . 1 1 131 131 ASN C C 131 172.236 172.236 174.230 -1.994 18509 5618 1 11 . 1 1 131 131 ASN H H 131 7.152 7.152 7.852 -0.700 18509 5619 1 11 . 1 1 132 132 GLU N N 132 120.461 120.461 120.135 0.326 18509 5620 1 11 . 1 1 132 132 GLU C C 132 171.084 171.084 177.161 -6.077 18509 5621 1 11 . 1 1 132 132 GLU H H 132 8.935 8.935 8.894 0.041 18509 5622 1 11 . 1 1 133 133 GLU N N 133 120.137 120.137 118.063 2.074 18509 5623 1 11 . 1 1 133 133 GLU C C 133 176.239 176.239 178.511 -2.272 18509 5624 1 11 . 1 1 133 133 GLU H H 133 8.775 8.775 8.564 0.211 18509 5625 1 11 . 1 1 134 134 SER N N 134 114.981 114.981 115.561 -0.580 18509 5626 1 11 . 1 1 134 134 SER CA C 134 59.046 59.046 61.878 -2.832 18509 5627 1 11 . 1 1 134 134 SER H H 134 8.117 8.117 8.434 -0.317 18509 5628 1 11 . 1 1 135 135 THR N N 135 102.263 102.263 116.427 -14.164 18509 5629 1 11 . 1 1 135 135 THR C C 135 172.804 172.804 176.486 -3.682 18509 5630 1 11 . 1 1 135 135 THR CA C 135 60.029 60.029 65.508 -5.479 18509 5631 1 11 . 1 1 135 135 THR H H 135 7.206 7.206 8.240 -1.034 18509 5632 1 11 . 1 1 136 136 LYS N N 136 122.108 122.108 119.571 2.537 18509 5633 1 11 . 1 1 136 136 LYS H H 136 7.884 7.884 7.696 0.188 18509 5634 1 11 . 1 1 137 137 THR N N 137 105.718 105.718 112.678 -6.960 18509 5635 1 11 . 1 1 137 137 THR H H 137 8.630 8.630 7.784 0.846 18509 5636 1 11 . 1 1 138 138 GLY N N 138 111.372 111.372 109.743 1.629 18509 5637 1 11 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.919 -3.436 18509 5638 1 11 . 1 1 138 138 GLY H H 138 7.426 7.426 7.991 -0.565 18509 5639 1 11 . 1 1 139 139 ASN N N 139 107.496 107.496 121.142 -13.646 18509 5640 1 11 . 1 1 139 139 ASN H H 139 7.545 7.545 7.722 -0.177 18509 5641 1 11 . 1 1 140 140 ALA N N 140 114.542 114.542 128.296 -13.754 18509 5642 1 11 . 1 1 140 140 ALA C C 140 173.571 173.571 177.612 -4.041 18509 5643 1 11 . 1 1 140 140 ALA H H 140 6.368 6.368 8.576 -2.208 18509 5644 1 11 . 1 1 141 141 GLY N N 141 105.287 105.287 106.948 -1.661 18509 5645 1 11 . 1 1 141 141 GLY C C 141 173.542 173.542 175.669 -2.127 18509 5646 1 11 . 1 1 141 141 GLY H H 141 8.271 8.271 8.718 -0.447 18509 5647 1 11 . 1 1 142 142 SER N N 142 118.771 118.771 120.768 -1.997 18509 5648 1 11 . 1 1 142 142 SER C C 142 170.188 170.188 175.342 -5.154 18509 5649 1 11 . 1 1 142 142 SER H H 142 9.196 9.196 8.823 0.373 18509 5650 1 11 . 1 1 143 143 ARG N N 143 120.189 120.189 117.499 2.690 18509 5651 1 11 . 1 1 143 143 ARG C C 143 171.596 171.596 176.975 -5.379 18509 5652 1 11 . 1 1 143 143 ARG H H 143 8.943 8.943 8.086 0.857 18509 5653 1 11 . 1 1 144 144 LEU N N 144 122.907 122.907 120.948 1.959 18509 5654 1 11 . 1 1 144 144 LEU C C 144 174.393 174.393 175.726 -1.333 18509 5655 1 11 . 1 1 144 144 LEU CA C 144 53.375 53.375 57.242 -3.867 18509 5656 1 11 . 1 1 144 144 LEU H H 144 8.395 8.395 7.890 0.505 18509 5657 1 11 . 1 1 145 145 ALA N N 145 114.159 114.159 115.586 -1.427 18509 5658 1 11 . 1 1 145 145 ALA C C 145 171.752 171.752 174.818 -3.066 18509 5659 1 11 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.756 -3.627 18509 5660 1 11 . 1 1 145 145 ALA H H 145 7.356 7.356 7.468 -0.112 18509 5661 1 11 . 1 1 146 146 CYS N N 146 110.738 110.738 120.292 -9.554 18509 5662 1 11 . 1 1 146 146 CYS C C 146 170.087 170.087 173.925 -3.838 18509 5663 1 11 . 1 1 146 146 CYS CA C 146 51.077 51.077 56.831 -5.754 18509 5664 1 11 . 1 1 146 146 CYS H H 146 9.008 9.008 7.976 1.032 18509 5665 1 11 . 1 1 147 147 GLY N N 147 106.461 106.461 108.284 -1.823 18509 5666 1 11 . 1 1 147 147 GLY C C 147 167.909 167.909 172.253 -4.344 18509 5667 1 11 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.324 -2.650 18509 5668 1 11 . 1 1 147 147 GLY H H 147 8.018 8.018 8.218 -0.200 18509 5669 1 11 . 1 1 148 148 VAL N N 148 124.054 124.054 126.226 -2.172 18509 5670 1 11 . 1 1 148 148 VAL C C 148 172.084 172.084 175.481 -3.397 18509 5671 1 11 . 1 1 148 148 VAL CA C 148 59.635 59.635 63.743 -4.108 18509 5672 1 11 . 1 1 148 148 VAL H H 148 8.434 8.434 8.326 0.108 18509 5673 1 11 . 1 1 149 149 ILE N N 149 126.918 126.918 129.082 -2.164 18509 5674 1 11 . 1 1 149 149 ILE C C 149 171.804 171.804 173.783 -1.979 18509 5675 1 11 . 1 1 149 149 ILE CA C 149 59.184 59.184 58.275 0.909 18509 5676 1 11 . 1 1 149 149 ILE H H 149 8.613 8.613 8.710 -0.097 18509 5677 1 11 . 1 1 150 150 GLY N N 150 116.493 116.493 114.137 2.356 18509 5678 1 11 . 1 1 150 150 GLY C C 150 170.188 170.188 172.358 -2.170 18509 5679 1 11 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.225 -4.105 18509 5680 1 11 . 1 1 150 150 GLY H H 150 9.283 9.283 8.067 1.216 18509 5681 1 11 . 1 1 151 151 ILE N N 151 120.189 120.189 118.482 1.707 18509 5682 1 11 . 1 1 151 151 ILE C C 151 172.231 172.231 174.617 -2.386 18509 5683 1 11 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.734 -1.362 18509 5684 1 11 . 1 1 151 151 ILE H H 151 8.943 8.943 8.469 0.474 18509 5685 1 11 . 1 1 152 152 ALA N N 152 129.719 129.719 130.894 -1.175 18509 5686 1 11 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.213 -4.441 18509 5687 1 11 . 1 1 152 152 ALA H H 152 8.170 8.170 8.175 -0.005 18509 5688 1 12 . 1 1 2 2 THR C C 2 170.139 170.139 174.217 -4.078 18509 5689 1 12 . 1 1 3 3 LYS N N 3 123.998 123.998 115.779 8.219 18509 5690 1 12 . 1 1 3 3 LYS C C 3 171.607 171.607 174.220 -2.613 18509 5691 1 12 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.325 -3.147 18509 5692 1 12 . 1 1 3 3 LYS H H 3 8.666 8.666 7.440 1.226 18509 5693 1 12 . 1 1 4 4 ALA N N 4 123.295 123.295 121.360 1.935 18509 5694 1 12 . 1 1 4 4 ALA C C 4 172.145 172.145 175.029 -2.884 18509 5695 1 12 . 1 1 4 4 ALA CA C 4 47.504 47.504 51.345 -3.841 18509 5696 1 12 . 1 1 4 4 ALA H H 4 9.116 9.116 8.641 0.475 18509 5697 1 12 . 1 1 5 5 VAL N N 5 121.466 121.466 120.076 1.390 18509 5698 1 12 . 1 1 5 5 VAL C C 5 167.836 167.836 174.326 -6.490 18509 5699 1 12 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.517 -4.642 18509 5700 1 12 . 1 1 5 5 VAL H H 5 9.545 9.545 8.788 0.757 18509 5701 1 12 . 1 1 6 6 ALA N N 6 125.984 125.984 131.059 -5.075 18509 5702 1 12 . 1 1 6 6 ALA C C 6 171.607 171.607 176.047 -4.440 18509 5703 1 12 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.037 -2.566 18509 5704 1 12 . 1 1 6 6 ALA H H 6 9.177 9.177 8.156 1.020 18509 5705 1 12 . 1 1 7 7 VAL N N 7 123.600 123.600 119.955 3.645 18509 5706 1 12 . 1 1 7 7 VAL C C 7 172.244 172.244 174.832 -2.588 18509 5707 1 12 . 1 1 7 7 VAL CA C 7 58.476 58.476 59.738 -1.262 18509 5708 1 12 . 1 1 7 7 VAL H H 7 9.116 9.116 7.919 1.197 18509 5709 1 12 . 1 1 8 8 LEU N N 8 126.455 126.455 128.548 -2.093 18509 5710 1 12 . 1 1 8 8 LEU C C 8 172.557 172.557 175.615 -3.058 18509 5711 1 12 . 1 1 8 8 LEU CA C 8 51.052 51.052 54.295 -3.243 18509 5712 1 12 . 1 1 8 8 LEU H H 8 8.916 8.916 8.523 0.393 18509 5713 1 12 . 1 1 9 9 LYS N N 9 120.820 120.820 120.848 -0.028 18509 5714 1 12 . 1 1 9 9 LYS C C 9 172.509 172.509 174.710 -2.201 18509 5715 1 12 . 1 1 9 9 LYS CA C 9 51.897 51.897 56.445 -4.548 18509 5716 1 12 . 1 1 9 9 LYS H H 9 8.315 8.315 7.980 0.335 18509 5717 1 12 . 1 1 10 10 GLY N N 10 111.249 111.249 112.019 -0.770 18509 5718 1 12 . 1 1 10 10 GLY C C 10 169.847 169.847 173.211 -3.364 18509 5719 1 12 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.007 -2.732 18509 5720 1 12 . 1 1 10 10 GLY H H 10 8.968 8.968 7.902 1.066 18509 5721 1 12 . 1 1 11 11 ASP N N 11 120.904 120.904 120.495 0.409 18509 5722 1 12 . 1 1 11 11 ASP C C 11 173.132 173.132 176.961 -3.829 18509 5723 1 12 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.971 -4.654 18509 5724 1 12 . 1 1 11 11 ASP H H 11 8.745 8.745 8.681 0.064 18509 5725 1 12 . 1 1 12 12 GLY N N 12 109.862 109.862 106.952 2.910 18509 5726 1 12 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.060 -1.860 18509 5727 1 12 . 1 1 12 12 GLY H H 12 7.985 7.985 8.058 -0.073 18509 5728 1 12 . 1 1 13 13 PRO C C 13 173.640 173.640 175.444 -1.804 18509 5729 1 12 . 1 1 14 14 VAL N N 14 120.414 120.414 124.908 -4.494 18509 5730 1 12 . 1 1 14 14 VAL C C 14 172.804 172.804 174.506 -1.702 18509 5731 1 12 . 1 1 14 14 VAL CA C 14 59.884 59.884 61.383 -1.499 18509 5732 1 12 . 1 1 14 14 VAL H H 14 7.476 7.476 8.262 -0.786 18509 5733 1 12 . 1 1 15 15 GLN N N 15 122.664 122.664 126.985 -4.321 18509 5734 1 12 . 1 1 15 15 GLN C C 15 171.168 171.168 174.270 -3.102 18509 5735 1 12 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.434 -3.755 18509 5736 1 12 . 1 1 15 15 GLN H H 15 7.938 7.938 8.884 -0.946 18509 5737 1 12 . 1 1 16 16 GLY N N 16 107.018 107.018 111.978 -4.960 18509 5738 1 12 . 1 1 16 16 GLY C C 16 167.726 167.726 171.933 -4.207 18509 5739 1 12 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.482 -1.857 18509 5740 1 12 . 1 1 16 16 GLY H H 16 8.288 8.288 8.273 0.015 18509 5741 1 12 . 1 1 17 17 ILE N N 17 120.248 120.248 114.452 5.796 18509 5742 1 12 . 1 1 17 17 ILE C C 17 171.194 171.194 173.458 -2.264 18509 5743 1 12 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.146 -0.649 18509 5744 1 12 . 1 1 17 17 ILE H H 17 7.948 7.948 8.499 -0.551 18509 5745 1 12 . 1 1 18 18 ILE N N 18 125.851 125.851 122.612 3.239 18509 5746 1 12 . 1 1 18 18 ILE C C 18 168.889 168.889 173.333 -4.444 18509 5747 1 12 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.132 -5.701 18509 5748 1 12 . 1 1 18 18 ILE H H 18 8.725 8.725 8.052 0.673 18509 5749 1 12 . 1 1 19 19 ASN N N 19 123.256 123.256 125.462 -2.206 18509 5750 1 12 . 1 1 19 19 ASN C C 19 168.903 168.903 173.436 -4.533 18509 5751 1 12 . 1 1 19 19 ASN CA C 19 49.088 49.088 50.851 -1.763 18509 5752 1 12 . 1 1 19 19 ASN H H 19 8.727 8.727 7.835 0.892 18509 5753 1 12 . 1 1 20 20 PHE N N 20 113.849 113.849 119.745 -5.896 18509 5754 1 12 . 1 1 20 20 PHE C C 20 173.219 173.219 174.482 -1.263 18509 5755 1 12 . 1 1 20 20 PHE CA C 20 52.058 52.058 56.751 -4.693 18509 5756 1 12 . 1 1 20 20 PHE H H 20 8.399 8.399 8.305 0.094 18509 5757 1 12 . 1 1 21 21 GLU N N 21 121.454 121.454 124.679 -3.225 18509 5758 1 12 . 1 1 21 21 GLU C C 21 170.280 170.280 175.503 -5.223 18509 5759 1 12 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.191 -1.147 18509 5760 1 12 . 1 1 21 21 GLU H H 21 9.526 9.526 8.587 0.939 18509 5761 1 12 . 1 1 22 22 GLN N N 22 130.340 130.340 122.686 7.654 18509 5762 1 12 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.696 -3.516 18509 5763 1 12 . 1 1 22 22 GLN H H 22 9.305 9.305 8.578 0.727 18509 5764 1 12 . 1 1 23 23 LYS N N 23 128.657 128.657 121.164 7.493 18509 5765 1 12 . 1 1 23 23 LYS CA C 23 57.241 57.241 54.606 2.635 18509 5766 1 12 . 1 1 23 23 LYS H H 23 9.088 9.088 8.211 0.877 18509 5767 1 12 . 1 1 24 24 GLU CA C 24 51.392 51.392 59.179 -7.787 18509 5768 1 12 . 1 1 25 25 SER CA C 25 58.078 58.078 59.750 -1.672 18509 5769 1 12 . 1 1 27 27 GLY N N 27 108.125 108.125 106.188 1.937 18509 5770 1 12 . 1 1 27 27 GLY CA C 27 42.925 42.925 45.132 -2.207 18509 5771 1 12 . 1 1 27 27 GLY H H 27 8.032 8.032 7.978 0.054 18509 5772 1 12 . 1 1 28 28 PRO C C 28 173.128 173.128 176.312 -3.184 18509 5773 1 12 . 1 1 29 29 VAL N N 29 121.267 121.267 125.868 -4.601 18509 5774 1 12 . 1 1 29 29 VAL C C 29 172.198 172.198 175.876 -3.678 18509 5775 1 12 . 1 1 29 29 VAL CA C 29 57.720 57.720 62.456 -4.736 18509 5776 1 12 . 1 1 29 29 VAL H H 29 9.089 9.089 8.955 0.134 18509 5777 1 12 . 1 1 30 30 LYS N N 30 127.589 127.589 128.300 -0.711 18509 5778 1 12 . 1 1 30 30 LYS C C 30 172.098 172.098 175.054 -2.956 18509 5779 1 12 . 1 1 30 30 LYS CA C 30 52.642 52.642 53.991 -1.349 18509 5780 1 12 . 1 1 30 30 LYS H H 30 9.200 9.200 8.025 1.175 18509 5781 1 12 . 1 1 31 31 VAL N N 31 126.037 126.037 116.451 9.586 18509 5782 1 12 . 1 1 31 31 VAL C C 31 172.244 172.244 173.863 -1.619 18509 5783 1 12 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.504 -2.365 18509 5784 1 12 . 1 1 31 31 VAL H H 31 9.282 9.282 7.133 2.149 18509 5785 1 12 . 1 1 32 32 TRP N N 32 125.414 125.414 122.297 3.117 18509 5786 1 12 . 1 1 32 32 TRP C C 32 170.156 170.156 175.950 -5.794 18509 5787 1 12 . 1 1 32 32 TRP CA C 32 53.137 53.137 55.863 -2.726 18509 5788 1 12 . 1 1 32 32 TRP H H 32 8.983 8.983 8.407 0.576 18509 5789 1 12 . 1 1 33 33 GLY N N 33 107.848 107.848 107.707 0.141 18509 5790 1 12 . 1 1 33 33 GLY C C 33 168.400 168.400 172.309 -3.909 18509 5791 1 12 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.527 -3.960 18509 5792 1 12 . 1 1 33 33 GLY H H 33 8.360 8.360 8.280 0.080 18509 5793 1 12 . 1 1 34 34 SER N N 34 114.377 114.377 118.292 -3.915 18509 5794 1 12 . 1 1 34 34 SER C C 34 169.618 169.618 172.935 -3.317 18509 5795 1 12 . 1 1 34 34 SER CA C 34 53.875 53.875 57.017 -3.142 18509 5796 1 12 . 1 1 34 34 SER H H 34 7.838 7.838 8.248 -0.410 18509 5797 1 12 . 1 1 35 35 ILE N N 35 123.149 123.149 121.558 1.591 18509 5798 1 12 . 1 1 35 35 ILE C C 35 169.713 169.713 173.672 -3.959 18509 5799 1 12 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.419 -2.650 18509 5800 1 12 . 1 1 35 35 ILE H H 35 8.496 8.496 8.285 0.211 18509 5801 1 12 . 1 1 36 36 LYS N N 36 123.803 123.803 124.213 -0.410 18509 5802 1 12 . 1 1 36 36 LYS C C 36 172.260 172.260 175.742 -3.482 18509 5803 1 12 . 1 1 36 36 LYS CA C 36 51.150 51.150 53.536 -2.386 18509 5804 1 12 . 1 1 36 36 LYS H H 36 9.091 9.091 8.120 0.971 18509 5805 1 12 . 1 1 37 37 GLY N N 37 105.495 105.495 108.773 -3.278 18509 5806 1 12 . 1 1 37 37 GLY C C 37 171.641 171.641 172.922 -1.281 18509 5807 1 12 . 1 1 37 37 GLY CA C 37 42.361 42.361 45.102 -2.741 18509 5808 1 12 . 1 1 37 37 GLY H H 37 8.237 8.237 8.393 -0.156 18509 5809 1 12 . 1 1 38 38 LEU N N 38 120.966 120.966 120.759 0.207 18509 5810 1 12 . 1 1 38 38 LEU C C 38 174.112 174.112 176.815 -2.703 18509 5811 1 12 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.824 -4.353 18509 5812 1 12 . 1 1 38 38 LEU H H 38 8.156 8.156 8.451 -0.295 18509 5813 1 12 . 1 1 39 39 THR N N 39 110.363 110.363 113.735 -3.372 18509 5814 1 12 . 1 1 39 39 THR C C 39 173.102 173.102 174.019 -0.917 18509 5815 1 12 . 1 1 39 39 THR CA C 39 58.194 58.194 62.898 -4.704 18509 5816 1 12 . 1 1 39 39 THR H H 39 8.660 8.660 8.241 0.419 18509 5817 1 12 . 1 1 40 40 GLU N N 40 125.818 125.818 125.262 0.556 18509 5818 1 12 . 1 1 40 40 GLU C C 40 173.134 173.134 173.933 -0.799 18509 5819 1 12 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.172 -1.816 18509 5820 1 12 . 1 1 40 40 GLU H H 40 8.804 8.804 8.214 0.590 18509 5821 1 12 . 1 1 41 41 GLY N N 41 113.875 113.875 109.120 4.755 18509 5822 1 12 . 1 1 41 41 GLY C C 41 170.046 170.046 172.328 -2.282 18509 5823 1 12 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.721 -5.667 18509 5824 1 12 . 1 1 41 41 GLY H H 41 8.763 8.763 8.505 0.258 18509 5825 1 12 . 1 1 42 42 LEU N N 42 120.137 120.137 124.111 -3.974 18509 5826 1 12 . 1 1 42 42 LEU C C 42 174.218 174.218 174.720 -0.502 18509 5827 1 12 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.470 -3.315 18509 5828 1 12 . 1 1 42 42 LEU H H 42 8.313 8.313 8.550 -0.237 18509 5829 1 12 . 1 1 43 43 HIS N N 43 114.385 114.385 117.997 -3.612 18509 5830 1 12 . 1 1 43 43 HIS C C 43 171.504 171.504 174.264 -2.760 18509 5831 1 12 . 1 1 43 43 HIS CA C 43 50.985 50.985 56.034 -5.049 18509 5832 1 12 . 1 1 43 43 HIS H H 43 8.712 8.712 7.739 0.973 18509 5833 1 12 . 1 1 44 44 GLY N N 44 108.872 108.872 112.888 -4.016 18509 5834 1 12 . 1 1 44 44 GLY C C 44 168.656 168.656 173.290 -4.634 18509 5835 1 12 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.839 -1.644 18509 5836 1 12 . 1 1 44 44 GLY H H 44 8.875 8.875 8.386 0.489 18509 5837 1 12 . 1 1 45 45 PHE N N 45 126.439 126.439 119.639 6.800 18509 5838 1 12 . 1 1 45 45 PHE CA C 45 53.098 53.098 59.012 -5.914 18509 5839 1 12 . 1 1 45 45 PHE H H 45 8.111 8.111 7.735 0.376 18509 5840 1 12 . 1 1 46 46 HIS N N 46 115.353 115.353 116.011 -0.658 18509 5841 1 12 . 1 1 46 46 HIS C C 46 172.415 172.415 173.812 -1.397 18509 5842 1 12 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.748 -5.543 18509 5843 1 12 . 1 1 46 46 HIS H H 46 8.107 8.107 8.179 -0.072 18509 5844 1 12 . 1 1 47 47 VAL N N 47 120.548 120.548 118.535 2.013 18509 5845 1 12 . 1 1 47 47 VAL C C 47 173.900 173.900 174.452 -0.552 18509 5846 1 12 . 1 1 47 47 VAL CA C 47 58.792 58.792 60.692 -1.900 18509 5847 1 12 . 1 1 47 47 VAL H H 47 9.366 9.366 8.287 1.079 18509 5848 1 12 . 1 1 48 48 HIS N N 48 129.236 129.236 113.335 15.901 18509 5849 1 12 . 1 1 48 48 HIS C C 48 171.084 171.084 173.776 -2.692 18509 5850 1 12 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.246 -1.490 18509 5851 1 12 . 1 1 48 48 HIS H H 48 10.210 10.210 8.447 1.763 18509 5852 1 12 . 1 1 49 49 GLU N N 49 118.119 118.119 124.120 -6.001 18509 5853 1 12 . 1 1 49 49 GLU C C 49 171.635 171.635 174.831 -3.196 18509 5854 1 12 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.913 1.846 18509 5855 1 12 . 1 1 49 49 GLU H H 49 8.492 8.492 8.951 -0.459 18509 5856 1 12 . 1 1 50 50 PHE N N 50 110.329 110.329 123.963 -13.634 18509 5857 1 12 . 1 1 50 50 PHE C C 50 175.252 175.252 174.879 0.373 18509 5858 1 12 . 1 1 50 50 PHE CA C 50 52.900 52.900 57.477 -4.577 18509 5859 1 12 . 1 1 50 50 PHE H H 50 8.580 8.580 7.869 0.711 18509 5860 1 12 . 1 1 51 51 GLY N N 51 119.251 119.251 109.035 10.216 18509 5861 1 12 . 1 1 51 51 GLY C C 51 168.248 168.248 173.213 -4.965 18509 5862 1 12 . 1 1 51 51 GLY H H 51 10.208 10.208 7.662 2.546 18509 5863 1 12 . 1 1 52 52 ASP N N 52 114.958 114.958 122.652 -7.694 18509 5864 1 12 . 1 1 52 52 ASP CA C 52 48.891 48.891 52.475 -3.584 18509 5865 1 12 . 1 1 52 52 ASP H H 52 5.834 5.834 7.981 -2.147 18509 5866 1 12 . 1 1 53 53 ASN N N 53 128.224 128.224 118.134 10.090 18509 5867 1 12 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.922 -4.689 18509 5868 1 12 . 1 1 53 53 ASN H H 53 9.360 9.360 8.570 0.790 18509 5869 1 12 . 1 1 54 54 THR C C 54 168.656 168.656 174.722 -6.066 18509 5870 1 12 . 1 1 55 55 ALA N N 55 126.661 126.661 120.108 6.553 18509 5871 1 12 . 1 1 55 55 ALA C C 55 174.185 174.185 176.994 -2.809 18509 5872 1 12 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.245 -5.090 18509 5873 1 12 . 1 1 55 55 ALA H H 55 8.390 8.390 7.667 0.723 18509 5874 1 12 . 1 1 56 56 GLY N N 56 107.903 107.903 107.169 0.734 18509 5875 1 12 . 1 1 56 56 GLY C C 56 171.578 171.578 173.069 -1.491 18509 5876 1 12 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.746 -3.166 18509 5877 1 12 . 1 1 56 56 GLY H H 56 7.282 7.282 7.770 -0.488 18509 5878 1 12 . 1 1 57 57 CYS N N 57 117.952 117.952 124.916 -6.964 18509 5879 1 12 . 1 1 57 57 CYS C C 57 175.209 175.209 176.067 -0.858 18509 5880 1 12 . 1 1 57 57 CYS CA C 57 49.088 49.088 57.517 -8.429 18509 5881 1 12 . 1 1 57 57 CYS H H 57 8.900 8.900 8.584 0.316 18509 5882 1 12 . 1 1 58 58 THR N N 58 119.852 119.852 118.367 1.485 18509 5883 1 12 . 1 1 58 58 THR CA C 58 58.239 58.239 65.634 -7.395 18509 5884 1 12 . 1 1 58 58 THR H H 58 8.505 8.505 8.446 0.059 18509 5885 1 12 . 1 1 59 59 SER C C 59 170.763 170.763 175.536 -4.773 18509 5886 1 12 . 1 1 59 59 SER CA C 59 55.609 55.609 60.581 -4.972 18509 5887 1 12 . 1 1 60 60 ALA N N 60 119.753 119.753 121.991 -2.238 18509 5888 1 12 . 1 1 60 60 ALA CA C 60 49.940 49.940 51.837 -1.897 18509 5889 1 12 . 1 1 60 60 ALA H H 60 6.898 6.898 8.704 -1.806 18509 5890 1 12 . 1 1 61 61 GLY N N 61 101.351 101.351 108.165 -6.814 18509 5891 1 12 . 1 1 61 61 GLY CA C 61 42.805 42.805 45.628 -2.823 18509 5892 1 12 . 1 1 61 61 GLY H H 61 7.730 7.730 7.777 -0.047 18509 5893 1 12 . 1 1 62 62 PRO C C 62 172.276 172.276 175.523 -3.247 18509 5894 1 12 . 1 1 63 63 HIS N N 63 115.023 115.023 122.764 -7.741 18509 5895 1 12 . 1 1 63 63 HIS CA C 63 52.119 52.119 57.003 -4.884 18509 5896 1 12 . 1 1 63 63 HIS H H 63 7.474 7.474 8.511 -1.037 18509 5897 1 12 . 1 1 64 64 PHE C C 64 171.731 171.731 172.972 -1.241 18509 5898 1 12 . 1 1 65 65 ASN N N 65 126.978 126.978 125.493 1.485 18509 5899 1 12 . 1 1 65 65 ASN CA C 65 47.753 47.753 49.778 -2.025 18509 5900 1 12 . 1 1 65 65 ASN H H 65 9.426 9.426 8.118 1.308 18509 5901 1 12 . 1 1 67 67 LEU N N 67 117.937 117.937 117.963 -0.026 18509 5902 1 12 . 1 1 67 67 LEU C C 67 172.580 172.580 177.369 -4.789 18509 5903 1 12 . 1 1 67 67 LEU CA C 67 50.911 50.911 57.570 -6.659 18509 5904 1 12 . 1 1 67 67 LEU H H 67 7.720 7.720 7.716 0.004 18509 5905 1 12 . 1 1 68 68 SER N N 68 110.842 110.842 111.963 -1.121 18509 5906 1 12 . 1 1 68 68 SER CA C 68 55.953 55.953 59.432 -3.479 18509 5907 1 12 . 1 1 68 68 SER H H 68 7.428 7.428 7.697 -0.269 18509 5908 1 12 . 1 1 69 69 ARG N N 69 120.782 120.782 120.920 -0.138 18509 5909 1 12 . 1 1 69 69 ARG C C 69 173.381 173.381 176.128 -2.747 18509 5910 1 12 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.142 -4.599 18509 5911 1 12 . 1 1 69 69 ARG H H 69 8.508 8.508 8.117 0.391 18509 5912 1 12 . 1 1 70 70 LYS N N 70 118.055 118.055 117.045 1.010 18509 5913 1 12 . 1 1 70 70 LYS C C 70 169.994 169.994 177.009 -7.015 18509 5914 1 12 . 1 1 70 70 LYS CA C 70 52.596 52.596 60.025 -7.429 18509 5915 1 12 . 1 1 70 70 LYS H H 70 8.745 8.745 8.329 0.416 18509 5916 1 12 . 1 1 71 71 HIS N N 71 111.871 111.871 117.325 -5.454 18509 5917 1 12 . 1 1 71 71 HIS C C 71 171.534 171.534 175.667 -4.133 18509 5918 1 12 . 1 1 71 71 HIS CA C 71 52.549 52.549 58.870 -6.321 18509 5919 1 12 . 1 1 71 71 HIS H H 71 7.152 7.152 8.323 -1.171 18509 5920 1 12 . 1 1 72 72 GLY N N 72 112.910 112.910 102.331 10.579 18509 5921 1 12 . 1 1 72 72 GLY C C 72 168.634 168.634 172.283 -3.649 18509 5922 1 12 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.958 -3.684 18509 5923 1 12 . 1 1 72 72 GLY H H 72 7.209 7.209 7.801 -0.592 18509 5924 1 12 . 1 1 73 73 GLY N N 73 105.207 105.207 105.964 -0.757 18509 5925 1 12 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.222 -3.001 18509 5926 1 12 . 1 1 73 73 GLY H H 73 8.789 8.789 8.412 0.377 18509 5927 1 12 . 1 1 74 74 PRO C C 74 175.753 175.753 177.061 -1.308 18509 5928 1 12 . 1 1 75 75 LYS N N 75 114.868 114.868 113.639 1.229 18509 5929 1 12 . 1 1 75 75 LYS C C 75 173.640 173.640 175.286 -1.646 18509 5930 1 12 . 1 1 75 75 LYS CA C 75 51.103 51.103 54.387 -3.284 18509 5931 1 12 . 1 1 75 75 LYS H H 75 8.651 8.651 7.807 0.844 18509 5932 1 12 . 1 1 76 76 ASP N N 76 120.414 120.414 120.683 -0.269 18509 5933 1 12 . 1 1 76 76 ASP C C 76 172.557 172.557 175.502 -2.945 18509 5934 1 12 . 1 1 76 76 ASP CA C 76 51.309 51.309 55.482 -4.173 18509 5935 1 12 . 1 1 76 76 ASP H H 76 7.461 7.461 7.684 -0.223 18509 5936 1 12 . 1 1 77 77 GLU N N 77 120.820 120.820 123.910 -3.090 18509 5937 1 12 . 1 1 77 77 GLU C C 77 174.101 174.101 175.331 -1.230 18509 5938 1 12 . 1 1 77 77 GLU CA C 77 55.513 55.513 56.724 -1.211 18509 5939 1 12 . 1 1 77 77 GLU H H 77 8.315 8.315 7.903 0.412 18509 5940 1 12 . 1 1 78 78 GLU N N 78 119.251 119.251 119.049 0.202 18509 5941 1 12 . 1 1 78 78 GLU C C 78 168.285 168.285 175.289 -7.004 18509 5942 1 12 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.108 -5.030 18509 5943 1 12 . 1 1 78 78 GLU H H 78 8.109 8.109 8.191 -0.082 18509 5944 1 12 . 1 1 79 79 ARG N N 79 118.991 118.991 121.189 -2.198 18509 5945 1 12 . 1 1 79 79 ARG C C 79 172.123 172.123 174.397 -2.274 18509 5946 1 12 . 1 1 79 79 ARG CA C 79 51.074 51.074 57.387 -6.313 18509 5947 1 12 . 1 1 79 79 ARG H H 79 6.999 6.999 8.591 -1.592 18509 5948 1 12 . 1 1 80 80 HIS N N 80 118.000 118.000 115.069 2.931 18509 5949 1 12 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.414 -6.462 18509 5950 1 12 . 1 1 80 80 HIS H H 80 8.355 8.355 8.383 -0.028 18509 5951 1 12 . 1 1 81 81 VAL C C 81 173.460 173.460 175.786 -2.326 18509 5952 1 12 . 1 1 82 82 GLY N N 82 97.322 97.322 116.166 -18.844 18509 5953 1 12 . 1 1 82 82 GLY C C 82 170.370 170.370 172.811 -2.441 18509 5954 1 12 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.795 -3.107 18509 5955 1 12 . 1 1 82 82 GLY H H 82 8.487 8.487 8.376 0.111 18509 5956 1 12 . 1 1 83 83 ASP N N 83 120.890 120.890 121.567 -0.677 18509 5957 1 12 . 1 1 83 83 ASP C C 83 168.737 168.737 173.988 -5.251 18509 5958 1 12 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.759 -0.841 18509 5959 1 12 . 1 1 83 83 ASP H H 83 7.127 7.127 7.988 -0.861 18509 5960 1 12 . 1 1 84 84 LEU N N 84 120.154 120.154 122.543 -2.389 18509 5961 1 12 . 1 1 84 84 LEU C C 84 173.212 173.212 176.335 -3.123 18509 5962 1 12 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.633 -4.200 18509 5963 1 12 . 1 1 84 84 LEU H H 84 7.128 7.128 8.496 -1.368 18509 5964 1 12 . 1 1 85 85 GLY N N 85 106.867 106.867 110.865 -3.998 18509 5965 1 12 . 1 1 85 85 GLY C C 85 167.654 167.654 172.261 -4.607 18509 5966 1 12 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.638 -2.627 18509 5967 1 12 . 1 1 85 85 GLY H H 85 8.260 8.260 8.701 -0.441 18509 5968 1 12 . 1 1 86 86 ASN N N 86 117.454 117.454 118.441 -0.987 18509 5969 1 12 . 1 1 86 86 ASN C C 86 173.942 173.942 173.269 0.673 18509 5970 1 12 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.543 -3.277 18509 5971 1 12 . 1 1 86 86 ASN H H 86 8.041 8.041 8.499 -0.458 18509 5972 1 12 . 1 1 87 87 VAL N N 87 113.370 113.370 119.213 -5.843 18509 5973 1 12 . 1 1 87 87 VAL C C 87 171.526 171.526 173.821 -2.295 18509 5974 1 12 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.495 -4.787 18509 5975 1 12 . 1 1 87 87 VAL H H 87 8.960 8.960 8.047 0.913 18509 5976 1 12 . 1 1 88 88 THR N N 88 117.939 117.939 121.237 -3.298 18509 5977 1 12 . 1 1 88 88 THR C C 88 170.367 170.367 172.834 -2.467 18509 5978 1 12 . 1 1 88 88 THR CA C 88 58.694 58.694 62.225 -3.531 18509 5979 1 12 . 1 1 88 88 THR H H 88 8.681 8.681 8.423 0.258 18509 5980 1 12 . 1 1 89 89 ALA N N 89 128.674 128.674 127.646 1.028 18509 5981 1 12 . 1 1 89 89 ALA C C 89 174.480 174.480 175.250 -0.770 18509 5982 1 12 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.341 -3.972 18509 5983 1 12 . 1 1 89 89 ALA H H 89 9.377 9.377 8.021 1.356 18509 5984 1 12 . 1 1 90 90 ASP N N 90 124.235 124.235 118.519 5.716 18509 5985 1 12 . 1 1 90 90 ASP C C 90 173.825 173.825 176.056 -2.231 18509 5986 1 12 . 1 1 90 90 ASP CA C 90 49.347 49.347 55.128 -5.781 18509 5987 1 12 . 1 1 90 90 ASP H H 90 8.455 8.455 8.536 -0.081 18509 5988 1 12 . 1 1 91 91 LYS N N 91 114.942 114.942 120.943 -6.001 18509 5989 1 12 . 1 1 91 91 LYS C C 91 174.101 174.101 176.005 -1.904 18509 5990 1 12 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.802 -3.523 18509 5991 1 12 . 1 1 91 91 LYS H H 91 8.231 8.231 8.217 0.014 18509 5992 1 12 . 1 1 92 92 ASP N N 92 119.251 119.251 114.333 4.918 18509 5993 1 12 . 1 1 92 92 ASP C C 92 173.020 173.020 175.178 -2.158 18509 5994 1 12 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.627 -2.500 18509 5995 1 12 . 1 1 92 92 ASP H H 92 8.109 8.109 8.015 0.094 18509 5996 1 12 . 1 1 93 93 GLY N N 93 110.868 110.868 109.983 0.885 18509 5997 1 12 . 1 1 93 93 GLY C C 93 169.706 169.706 172.625 -2.919 18509 5998 1 12 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.696 -1.933 18509 5999 1 12 . 1 1 93 93 GLY H H 93 8.405 8.405 8.043 0.362 18509 6000 1 12 . 1 1 94 94 VAL N N 94 118.755 118.755 120.127 -1.372 18509 6001 1 12 . 1 1 94 94 VAL C C 94 173.510 173.510 174.249 -0.739 18509 6002 1 12 . 1 1 94 94 VAL CA C 94 58.185 58.185 60.335 -2.150 18509 6003 1 12 . 1 1 94 94 VAL H H 94 7.814 7.814 7.689 0.125 18509 6004 1 12 . 1 1 95 95 ALA N N 95 131.313 131.313 129.796 1.517 18509 6005 1 12 . 1 1 95 95 ALA C C 95 171.635 171.635 175.629 -3.994 18509 6006 1 12 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.525 -3.611 18509 6007 1 12 . 1 1 95 95 ALA H H 95 9.763 9.763 7.736 2.027 18509 6008 1 12 . 1 1 96 96 ASP N N 96 125.170 125.170 125.170 0.000 18509 6009 1 12 . 1 1 96 96 ASP C C 96 172.336 172.336 176.096 -3.760 18509 6010 1 12 . 1 1 96 96 ASP H H 96 8.515 8.515 8.552 -0.037 18509 6011 1 12 . 1 1 97 97 VAL N N 97 125.879 125.879 122.279 3.600 18509 6012 1 12 . 1 1 97 97 VAL C C 97 173.488 173.488 174.314 -0.826 18509 6013 1 12 . 1 1 97 97 VAL CA C 97 58.243 58.243 60.688 -2.445 18509 6014 1 12 . 1 1 97 97 VAL H H 97 8.703 8.703 8.941 -0.238 18509 6015 1 12 . 1 1 98 98 SER N N 98 123.017 123.017 120.964 2.053 18509 6016 1 12 . 1 1 98 98 SER C C 98 169.715 169.715 173.936 -4.221 18509 6017 1 12 . 1 1 98 98 SER CA C 98 55.068 55.068 56.807 -1.739 18509 6018 1 12 . 1 1 98 98 SER H H 98 8.784 8.784 8.410 0.374 18509 6019 1 12 . 1 1 99 99 ILE N N 99 125.807 125.807 123.741 2.066 18509 6020 1 12 . 1 1 99 99 ILE C C 99 171.321 171.321 173.714 -2.393 18509 6021 1 12 . 1 1 99 99 ILE CA C 99 57.155 57.155 58.920 -1.765 18509 6022 1 12 . 1 1 99 99 ILE H H 99 9.411 9.411 7.807 1.604 18509 6023 1 12 . 1 1 100 100 GLU N N 100 124.068 124.068 118.723 5.345 18509 6024 1 12 . 1 1 100 100 GLU C C 100 172.098 172.098 174.492 -2.394 18509 6025 1 12 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.727 -2.437 18509 6026 1 12 . 1 1 100 100 GLU H H 100 8.652 8.652 8.300 0.352 18509 6027 1 12 . 1 1 101 101 ASP N N 101 126.109 126.109 123.349 2.760 18509 6028 1 12 . 1 1 101 101 ASP C C 101 171.144 171.144 174.674 -3.530 18509 6029 1 12 . 1 1 101 101 ASP CA C 101 51.419 51.419 52.061 -0.642 18509 6030 1 12 . 1 1 101 101 ASP H H 101 9.317 9.317 8.227 1.090 18509 6031 1 12 . 1 1 102 102 SER N N 102 118.470 118.470 116.736 1.734 18509 6032 1 12 . 1 1 102 102 SER C C 102 171.596 171.596 176.619 -5.023 18509 6033 1 12 . 1 1 102 102 SER CA C 102 55.245 55.245 58.873 -3.628 18509 6034 1 12 . 1 1 102 102 SER H H 102 8.933 8.933 8.627 0.306 18509 6035 1 12 . 1 1 103 103 VAL N N 103 123.179 123.179 122.597 0.582 18509 6036 1 12 . 1 1 103 103 VAL CA C 103 61.450 61.450 65.335 -3.885 18509 6037 1 12 . 1 1 103 103 VAL H H 103 8.148 8.148 8.754 -0.606 18509 6038 1 12 . 1 1 104 104 ILE C C 104 169.576 169.576 176.085 -6.509 18509 6039 1 12 . 1 1 104 104 ILE CA C 104 60.194 60.194 61.924 -1.730 18509 6040 1 12 . 1 1 105 105 SER N N 105 107.618 107.618 117.268 -9.650 18509 6041 1 12 . 1 1 105 105 SER C C 105 170.046 170.046 174.467 -4.421 18509 6042 1 12 . 1 1 105 105 SER CA C 105 52.550 52.550 56.539 -3.990 18509 6043 1 12 . 1 1 105 105 SER H H 105 6.988 6.988 7.729 -0.741 18509 6044 1 12 . 1 1 106 106 LEU N N 106 120.137 120.137 122.256 -2.119 18509 6045 1 12 . 1 1 106 106 LEU H H 106 8.313 8.313 7.546 0.767 18509 6046 1 12 . 1 1 107 107 SER C C 107 170.701 170.701 173.830 -3.129 18509 6047 1 12 . 1 1 107 107 SER CA C 107 54.540 54.540 58.079 -3.539 18509 6048 1 12 . 1 1 108 108 GLY N N 108 107.603 107.603 114.693 -7.090 18509 6049 1 12 . 1 1 108 108 GLY C C 108 173.128 173.128 172.965 0.163 18509 6050 1 12 . 1 1 108 108 GLY CA C 108 41.287 41.287 45.376 -4.089 18509 6051 1 12 . 1 1 108 108 GLY H H 108 8.717 8.717 7.974 0.743 18509 6052 1 12 . 1 1 109 109 ASP N N 109 120.664 120.664 123.125 -2.461 18509 6053 1 12 . 1 1 109 109 ASP C C 109 171.904 171.904 177.065 -5.161 18509 6054 1 12 . 1 1 109 109 ASP H H 109 9.019 9.019 8.314 0.705 18509 6055 1 12 . 1 1 110 110 HIS N N 110 116.324 116.324 116.347 -0.023 18509 6056 1 12 . 1 1 110 110 HIS H H 110 9.283 9.283 8.593 0.690 18509 6057 1 12 . 1 1 111 111 SER N N 111 110.225 110.225 111.893 -1.668 18509 6058 1 12 . 1 1 111 111 SER CA C 111 54.681 54.681 56.775 -2.094 18509 6059 1 12 . 1 1 111 111 SER H H 111 7.156 7.156 7.530 -0.374 18509 6060 1 12 . 1 1 112 112 ILE N N 112 117.053 117.053 117.203 -0.150 18509 6061 1 12 . 1 1 112 112 ILE C C 112 171.419 171.419 175.330 -3.911 18509 6062 1 12 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.464 -4.225 18509 6063 1 12 . 1 1 112 112 ILE H H 112 7.837 7.837 8.426 -0.589 18509 6064 1 12 . 1 1 113 113 ILE N N 113 121.032 121.032 116.029 5.003 18509 6065 1 12 . 1 1 113 113 ILE C C 113 173.604 173.604 176.598 -2.994 18509 6066 1 12 . 1 1 113 113 ILE CA C 113 58.318 58.318 59.875 -1.557 18509 6067 1 12 . 1 1 113 113 ILE H H 113 7.592 7.592 7.884 -0.292 18509 6068 1 12 . 1 1 114 114 GLY N N 114 112.661 112.661 113.105 -0.444 18509 6069 1 12 . 1 1 114 114 GLY C C 114 169.739 169.739 174.560 -4.821 18509 6070 1 12 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.327 -3.417 18509 6071 1 12 . 1 1 114 114 GLY H H 114 9.575 9.575 8.735 0.840 18509 6072 1 12 . 1 1 115 115 ARG N N 115 118.398 118.398 121.722 -3.324 18509 6073 1 12 . 1 1 115 115 ARG C C 115 171.079 171.079 175.314 -4.235 18509 6074 1 12 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.035 -2.372 18509 6075 1 12 . 1 1 115 115 ARG H H 115 7.464 7.464 7.445 0.019 18509 6076 1 12 . 1 1 116 116 THR N N 116 112.218 112.218 113.676 -1.458 18509 6077 1 12 . 1 1 116 116 THR C C 116 169.821 169.821 174.389 -4.568 18509 6078 1 12 . 1 1 116 116 THR CA C 116 59.633 59.633 60.869 -1.236 18509 6079 1 12 . 1 1 116 116 THR H H 116 6.677 6.677 8.531 -1.854 18509 6080 1 12 . 1 1 117 117 LEU N N 117 129.477 129.477 129.310 0.167 18509 6081 1 12 . 1 1 117 117 LEU C C 117 171.126 171.126 175.408 -4.282 18509 6082 1 12 . 1 1 117 117 LEU CA C 117 50.415 50.415 53.983 -3.568 18509 6083 1 12 . 1 1 117 117 LEU H H 117 8.799 8.799 8.907 -0.108 18509 6084 1 12 . 1 1 118 118 VAL N N 118 125.091 125.091 127.056 -1.965 18509 6085 1 12 . 1 1 118 118 VAL C C 118 170.267 170.267 174.983 -4.716 18509 6086 1 12 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.175 -3.036 18509 6087 1 12 . 1 1 118 118 VAL H H 118 8.906 8.906 8.792 0.114 18509 6088 1 12 . 1 1 119 119 VAL N N 119 120.716 120.716 127.500 -6.784 18509 6089 1 12 . 1 1 119 119 VAL C C 119 171.175 171.175 173.579 -2.404 18509 6090 1 12 . 1 1 119 119 VAL CA C 119 55.271 55.271 61.022 -5.751 18509 6091 1 12 . 1 1 119 119 VAL H H 119 7.982 7.982 8.092 -0.110 18509 6092 1 12 . 1 1 120 120 HIS N N 120 125.052 125.052 127.056 -2.004 18509 6093 1 12 . 1 1 120 120 HIS C C 120 172.599 172.599 173.761 -1.162 18509 6094 1 12 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.212 -0.818 18509 6095 1 12 . 1 1 120 120 HIS H H 120 8.935 8.935 8.433 0.502 18509 6096 1 12 . 1 1 121 121 GLU N N 121 121.453 121.453 122.743 -1.290 18509 6097 1 12 . 1 1 121 121 GLU C C 121 172.304 172.304 176.080 -3.776 18509 6098 1 12 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.741 -0.651 18509 6099 1 12 . 1 1 121 121 GLU H H 121 9.178 9.178 7.774 1.404 18509 6100 1 12 . 1 1 122 122 LYS N N 122 115.248 115.248 121.462 -6.214 18509 6101 1 12 . 1 1 122 122 LYS C C 122 171.523 171.523 174.041 -2.518 18509 6102 1 12 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.062 -4.443 18509 6103 1 12 . 1 1 122 122 LYS H H 122 8.478 8.478 8.018 0.460 18509 6104 1 12 . 1 1 123 123 ALA N N 123 120.866 120.866 122.699 -1.833 18509 6105 1 12 . 1 1 123 123 ALA C C 123 173.219 173.219 175.675 -2.456 18509 6106 1 12 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.834 -3.985 18509 6107 1 12 . 1 1 123 123 ALA H H 123 7.796 7.796 8.404 -0.608 18509 6108 1 12 . 1 1 124 124 ASP N N 124 121.799 121.799 123.134 -1.335 18509 6109 1 12 . 1 1 124 124 ASP C C 124 174.458 174.458 173.942 0.516 18509 6110 1 12 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.185 -3.777 18509 6111 1 12 . 1 1 124 124 ASP H H 124 10.165 10.165 8.284 1.881 18509 6112 1 12 . 1 1 125 125 ASP N N 125 129.369 129.369 126.541 2.828 18509 6113 1 12 . 1 1 125 125 ASP C C 125 175.231 175.231 175.607 -0.376 18509 6114 1 12 . 1 1 125 125 ASP CA C 125 50.939 50.939 53.146 -2.207 18509 6115 1 12 . 1 1 125 125 ASP H H 125 10.055 10.055 8.202 1.853 18509 6116 1 12 . 1 1 126 126 LEU N N 126 117.190 117.190 123.928 -6.738 18509 6117 1 12 . 1 1 126 126 LEU C C 126 173.964 173.964 178.846 -4.882 18509 6118 1 12 . 1 1 126 126 LEU H H 126 10.483 10.483 8.649 1.834 18509 6119 1 12 . 1 1 127 127 GLY N N 127 103.809 103.809 105.112 -1.303 18509 6120 1 12 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.686 -3.808 18509 6121 1 12 . 1 1 127 127 GLY H H 127 8.637 8.637 8.420 0.217 18509 6122 1 12 . 1 1 128 128 LYS N N 128 118.290 118.290 121.192 -2.902 18509 6123 1 12 . 1 1 128 128 LYS CA C 128 51.740 51.740 57.347 -5.607 18509 6124 1 12 . 1 1 128 128 LYS H H 128 7.158 7.158 7.868 -0.710 18509 6125 1 12 . 1 1 129 129 GLY N N 129 108.507 108.507 106.952 1.555 18509 6126 1 12 . 1 1 129 129 GLY C C 129 171.524 171.524 174.786 -3.262 18509 6127 1 12 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.545 -4.432 18509 6128 1 12 . 1 1 129 129 GLY H H 129 8.913 8.913 7.455 1.458 18509 6129 1 12 . 1 1 130 130 GLY N N 130 108.537 108.537 111.222 -2.685 18509 6130 1 12 . 1 1 130 130 GLY C C 130 169.994 169.994 173.056 -3.062 18509 6131 1 12 . 1 1 130 130 GLY CA C 130 42.419 42.419 45.282 -2.863 18509 6132 1 12 . 1 1 130 130 GLY H H 130 8.723 8.723 8.308 0.415 18509 6133 1 12 . 1 1 131 131 ASN N N 131 111.951 111.951 119.281 -7.330 18509 6134 1 12 . 1 1 131 131 ASN C C 131 172.236 172.236 175.225 -2.989 18509 6135 1 12 . 1 1 131 131 ASN H H 131 7.152 7.152 8.052 -0.900 18509 6136 1 12 . 1 1 132 132 GLU N N 132 120.461 120.461 118.594 1.867 18509 6137 1 12 . 1 1 132 132 GLU C C 132 171.084 171.084 177.481 -6.397 18509 6138 1 12 . 1 1 132 132 GLU H H 132 8.935 8.935 8.730 0.205 18509 6139 1 12 . 1 1 133 133 GLU N N 133 120.137 120.137 118.290 1.847 18509 6140 1 12 . 1 1 133 133 GLU C C 133 176.239 176.239 178.303 -2.064 18509 6141 1 12 . 1 1 133 133 GLU H H 133 8.775 8.775 8.467 0.308 18509 6142 1 12 . 1 1 134 134 SER N N 134 114.981 114.981 116.478 -1.497 18509 6143 1 12 . 1 1 134 134 SER CA C 134 59.046 59.046 61.756 -2.710 18509 6144 1 12 . 1 1 134 134 SER H H 134 8.117 8.117 8.263 -0.146 18509 6145 1 12 . 1 1 135 135 THR N N 135 102.263 102.263 115.781 -13.518 18509 6146 1 12 . 1 1 135 135 THR C C 135 172.804 172.804 175.036 -2.232 18509 6147 1 12 . 1 1 135 135 THR CA C 135 60.029 60.029 64.174 -4.145 18509 6148 1 12 . 1 1 135 135 THR H H 135 7.206 7.206 7.831 -0.625 18509 6149 1 12 . 1 1 136 136 LYS N N 136 122.108 122.108 119.277 2.831 18509 6150 1 12 . 1 1 136 136 LYS H H 136 7.884 7.884 7.564 0.320 18509 6151 1 12 . 1 1 137 137 THR N N 137 105.718 105.718 114.006 -8.288 18509 6152 1 12 . 1 1 137 137 THR H H 137 8.630 8.630 7.992 0.638 18509 6153 1 12 . 1 1 138 138 GLY N N 138 111.372 111.372 108.640 2.732 18509 6154 1 12 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.197 -2.714 18509 6155 1 12 . 1 1 138 138 GLY H H 138 7.426 7.426 7.855 -0.429 18509 6156 1 12 . 1 1 139 139 ASN N N 139 107.496 107.496 118.921 -11.425 18509 6157 1 12 . 1 1 139 139 ASN H H 139 7.545 7.545 7.662 -0.117 18509 6158 1 12 . 1 1 140 140 ALA N N 140 114.542 114.542 126.724 -12.182 18509 6159 1 12 . 1 1 140 140 ALA C C 140 173.571 173.571 176.082 -2.511 18509 6160 1 12 . 1 1 140 140 ALA H H 140 6.368 6.368 8.121 -1.753 18509 6161 1 12 . 1 1 141 141 GLY N N 141 105.287 105.287 106.868 -1.581 18509 6162 1 12 . 1 1 141 141 GLY C C 141 173.542 173.542 175.360 -1.818 18509 6163 1 12 . 1 1 141 141 GLY H H 141 8.271 8.271 8.437 -0.166 18509 6164 1 12 . 1 1 142 142 SER N N 142 118.771 118.771 120.571 -1.800 18509 6165 1 12 . 1 1 142 142 SER C C 142 170.188 170.188 175.870 -5.682 18509 6166 1 12 . 1 1 142 142 SER H H 142 9.196 9.196 8.129 1.067 18509 6167 1 12 . 1 1 143 143 ARG N N 143 120.189 120.189 117.349 2.840 18509 6168 1 12 . 1 1 143 143 ARG C C 143 171.596 171.596 178.203 -6.607 18509 6169 1 12 . 1 1 143 143 ARG H H 143 8.943 8.943 8.377 0.566 18509 6170 1 12 . 1 1 144 144 LEU N N 144 122.907 122.907 121.516 1.391 18509 6171 1 12 . 1 1 144 144 LEU C C 144 174.393 174.393 175.964 -1.571 18509 6172 1 12 . 1 1 144 144 LEU CA C 144 53.375 53.375 57.060 -3.685 18509 6173 1 12 . 1 1 144 144 LEU H H 144 8.395 8.395 8.093 0.302 18509 6174 1 12 . 1 1 145 145 ALA N N 145 114.159 114.159 118.244 -4.085 18509 6175 1 12 . 1 1 145 145 ALA C C 145 171.752 171.752 175.197 -3.445 18509 6176 1 12 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.459 -3.330 18509 6177 1 12 . 1 1 145 145 ALA H H 145 7.356 7.356 7.447 -0.091 18509 6178 1 12 . 1 1 146 146 CYS N N 146 110.738 110.738 120.131 -9.393 18509 6179 1 12 . 1 1 146 146 CYS C C 146 170.087 170.087 174.070 -3.983 18509 6180 1 12 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.589 -6.512 18509 6181 1 12 . 1 1 146 146 CYS H H 146 9.008 9.008 8.322 0.686 18509 6182 1 12 . 1 1 147 147 GLY N N 147 106.461 106.461 110.043 -3.582 18509 6183 1 12 . 1 1 147 147 GLY C C 147 167.909 167.909 172.427 -4.518 18509 6184 1 12 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.193 -2.519 18509 6185 1 12 . 1 1 147 147 GLY H H 147 8.018 8.018 8.231 -0.213 18509 6186 1 12 . 1 1 148 148 VAL N N 148 124.054 124.054 121.544 2.510 18509 6187 1 12 . 1 1 148 148 VAL C C 148 172.084 172.084 175.226 -3.142 18509 6188 1 12 . 1 1 148 148 VAL CA C 148 59.635 59.635 61.860 -2.225 18509 6189 1 12 . 1 1 148 148 VAL H H 148 8.434 8.434 8.674 -0.240 18509 6190 1 12 . 1 1 149 149 ILE N N 149 126.918 126.918 127.381 -0.463 18509 6191 1 12 . 1 1 149 149 ILE C C 149 171.804 171.804 174.473 -2.669 18509 6192 1 12 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.137 0.047 18509 6193 1 12 . 1 1 149 149 ILE H H 149 8.613 8.613 8.850 -0.237 18509 6194 1 12 . 1 1 150 150 GLY N N 150 116.493 116.493 113.528 2.965 18509 6195 1 12 . 1 1 150 150 GLY C C 150 170.188 170.188 172.377 -2.189 18509 6196 1 12 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.488 -4.368 18509 6197 1 12 . 1 1 150 150 GLY H H 150 9.283 9.283 8.179 1.104 18509 6198 1 12 . 1 1 151 151 ILE N N 151 120.189 120.189 118.937 1.252 18509 6199 1 12 . 1 1 151 151 ILE C C 151 172.231 172.231 174.844 -2.613 18509 6200 1 12 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.728 -1.356 18509 6201 1 12 . 1 1 151 151 ILE H H 151 8.943 8.943 8.530 0.413 18509 6202 1 12 . 1 1 152 152 ALA N N 152 129.719 129.719 130.990 -1.271 18509 6203 1 12 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.128 -4.356 18509 6204 1 12 . 1 1 152 152 ALA H H 152 8.170 8.170 8.208 -0.038 18509 6205 1 13 . 1 1 2 2 THR C C 2 170.139 170.139 173.741 -3.602 18509 6206 1 13 . 1 1 3 3 LYS N N 3 123.998 123.998 119.439 4.559 18509 6207 1 13 . 1 1 3 3 LYS C C 3 171.607 171.607 174.037 -2.430 18509 6208 1 13 . 1 1 3 3 LYS CA C 3 51.178 51.178 55.080 -3.902 18509 6209 1 13 . 1 1 3 3 LYS H H 3 8.666 8.666 7.866 0.800 18509 6210 1 13 . 1 1 4 4 ALA N N 4 123.295 123.295 122.441 0.854 18509 6211 1 13 . 1 1 4 4 ALA C C 4 172.145 172.145 175.394 -3.249 18509 6212 1 13 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.550 -3.046 18509 6213 1 13 . 1 1 4 4 ALA H H 4 9.116 9.116 8.392 0.724 18509 6214 1 13 . 1 1 5 5 VAL N N 5 121.466 121.466 115.292 6.174 18509 6215 1 13 . 1 1 5 5 VAL C C 5 167.836 167.836 173.869 -6.033 18509 6216 1 13 . 1 1 5 5 VAL CA C 5 56.875 56.875 60.691 -3.816 18509 6217 1 13 . 1 1 5 5 VAL H H 5 9.545 9.545 8.134 1.411 18509 6218 1 13 . 1 1 6 6 ALA N N 6 125.984 125.984 128.775 -2.791 18509 6219 1 13 . 1 1 6 6 ALA C C 6 171.607 171.607 176.114 -4.507 18509 6220 1 13 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.761 -3.290 18509 6221 1 13 . 1 1 6 6 ALA H H 6 9.177 9.177 8.336 0.841 18509 6222 1 13 . 1 1 7 7 VAL N N 7 123.600 123.600 121.156 2.444 18509 6223 1 13 . 1 1 7 7 VAL C C 7 172.244 172.244 174.756 -2.512 18509 6224 1 13 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.351 -2.875 18509 6225 1 13 . 1 1 7 7 VAL H H 7 9.116 9.116 8.356 0.760 18509 6226 1 13 . 1 1 8 8 LEU N N 8 126.455 126.455 127.335 -0.880 18509 6227 1 13 . 1 1 8 8 LEU C C 8 172.557 172.557 176.382 -3.825 18509 6228 1 13 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.579 -2.527 18509 6229 1 13 . 1 1 8 8 LEU H H 8 8.916 8.916 8.533 0.383 18509 6230 1 13 . 1 1 9 9 LYS N N 9 120.820 120.820 121.413 -0.593 18509 6231 1 13 . 1 1 9 9 LYS C C 9 172.509 172.509 175.428 -2.919 18509 6232 1 13 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.545 -3.648 18509 6233 1 13 . 1 1 9 9 LYS H H 9 8.315 8.315 8.346 -0.031 18509 6234 1 13 . 1 1 10 10 GLY N N 10 111.249 111.249 112.083 -0.834 18509 6235 1 13 . 1 1 10 10 GLY C C 10 169.847 169.847 172.696 -2.849 18509 6236 1 13 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.087 -2.812 18509 6237 1 13 . 1 1 10 10 GLY H H 10 8.968 8.968 8.280 0.688 18509 6238 1 13 . 1 1 11 11 ASP N N 11 120.904 120.904 121.675 -0.771 18509 6239 1 13 . 1 1 11 11 ASP C C 11 173.132 173.132 176.464 -3.332 18509 6240 1 13 . 1 1 11 11 ASP CA C 11 51.317 51.317 54.258 -2.942 18509 6241 1 13 . 1 1 11 11 ASP H H 11 8.745 8.745 8.104 0.641 18509 6242 1 13 . 1 1 12 12 GLY N N 12 109.862 109.862 112.100 -2.238 18509 6243 1 13 . 1 1 12 12 GLY CA C 12 41.200 41.200 44.011 -2.811 18509 6244 1 13 . 1 1 12 12 GLY H H 12 7.985 7.985 8.497 -0.512 18509 6245 1 13 . 1 1 13 13 PRO C C 13 173.640 173.640 175.954 -2.314 18509 6246 1 13 . 1 1 14 14 VAL N N 14 120.414 120.414 119.019 1.395 18509 6247 1 13 . 1 1 14 14 VAL C C 14 172.804 172.804 175.135 -2.331 18509 6248 1 13 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.066 -0.182 18509 6249 1 13 . 1 1 14 14 VAL H H 14 7.476 7.476 8.169 -0.693 18509 6250 1 13 . 1 1 15 15 GLN N N 15 122.664 122.664 125.985 -3.321 18509 6251 1 13 . 1 1 15 15 GLN C C 15 171.168 171.168 174.989 -3.821 18509 6252 1 13 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.871 -4.192 18509 6253 1 13 . 1 1 15 15 GLN H H 15 7.938 7.938 8.981 -1.043 18509 6254 1 13 . 1 1 16 16 GLY N N 16 107.018 107.018 109.813 -2.795 18509 6255 1 13 . 1 1 16 16 GLY C C 16 167.726 167.726 171.841 -4.115 18509 6256 1 13 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.248 -1.623 18509 6257 1 13 . 1 1 16 16 GLY H H 16 8.288 8.288 8.346 -0.058 18509 6258 1 13 . 1 1 17 17 ILE N N 17 120.248 120.248 115.734 4.514 18509 6259 1 13 . 1 1 17 17 ILE C C 17 171.194 171.194 173.414 -2.220 18509 6260 1 13 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.663 -1.166 18509 6261 1 13 . 1 1 17 17 ILE H H 17 7.948 7.948 7.856 0.092 18509 6262 1 13 . 1 1 18 18 ILE N N 18 125.851 125.851 123.404 2.447 18509 6263 1 13 . 1 1 18 18 ILE C C 18 168.889 168.889 174.066 -5.177 18509 6264 1 13 . 1 1 18 18 ILE CA C 18 53.431 53.431 58.522 -5.091 18509 6265 1 13 . 1 1 18 18 ILE H H 18 8.725 8.725 8.007 0.718 18509 6266 1 13 . 1 1 19 19 ASN N N 19 123.256 123.256 126.024 -2.768 18509 6267 1 13 . 1 1 19 19 ASN C C 19 168.903 168.903 173.873 -4.970 18509 6268 1 13 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.182 -2.094 18509 6269 1 13 . 1 1 19 19 ASN H H 19 8.727 8.727 8.008 0.719 18509 6270 1 13 . 1 1 20 20 PHE N N 20 113.849 113.849 117.826 -3.977 18509 6271 1 13 . 1 1 20 20 PHE C C 20 173.219 173.219 174.764 -1.545 18509 6272 1 13 . 1 1 20 20 PHE CA C 20 52.058 52.058 56.874 -4.816 18509 6273 1 13 . 1 1 20 20 PHE H H 20 8.399 8.399 8.070 0.329 18509 6274 1 13 . 1 1 21 21 GLU N N 21 121.454 121.454 123.035 -1.581 18509 6275 1 13 . 1 1 21 21 GLU C C 21 170.280 170.280 174.837 -4.557 18509 6276 1 13 . 1 1 21 21 GLU CA C 21 53.044 53.044 55.325 -2.281 18509 6277 1 13 . 1 1 21 21 GLU H H 21 9.526 9.526 8.472 1.054 18509 6278 1 13 . 1 1 22 22 GLN N N 22 130.340 130.340 123.536 6.804 18509 6279 1 13 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.321 -4.141 18509 6280 1 13 . 1 1 22 22 GLN H H 22 9.305 9.305 8.507 0.798 18509 6281 1 13 . 1 1 23 23 LYS N N 23 128.657 128.657 123.312 5.345 18509 6282 1 13 . 1 1 23 23 LYS CA C 23 57.241 57.241 57.530 -0.289 18509 6283 1 13 . 1 1 23 23 LYS H H 23 9.088 9.088 7.948 1.140 18509 6284 1 13 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.033 -6.641 18509 6285 1 13 . 1 1 25 25 SER CA C 25 58.078 58.078 59.320 -1.242 18509 6286 1 13 . 1 1 27 27 GLY N N 27 108.125 108.125 112.732 -4.607 18509 6287 1 13 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.813 -1.888 18509 6288 1 13 . 1 1 27 27 GLY H H 27 8.032 8.032 8.693 -0.661 18509 6289 1 13 . 1 1 28 28 PRO C C 28 173.128 173.128 175.875 -2.747 18509 6290 1 13 . 1 1 29 29 VAL N N 29 121.267 121.267 126.346 -5.079 18509 6291 1 13 . 1 1 29 29 VAL C C 29 172.198 172.198 175.519 -3.321 18509 6292 1 13 . 1 1 29 29 VAL CA C 29 57.720 57.720 62.003 -4.283 18509 6293 1 13 . 1 1 29 29 VAL H H 29 9.089 9.089 8.047 1.042 18509 6294 1 13 . 1 1 30 30 LYS N N 30 127.589 127.589 129.677 -2.088 18509 6295 1 13 . 1 1 30 30 LYS C C 30 172.098 172.098 174.726 -2.628 18509 6296 1 13 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.145 -2.503 18509 6297 1 13 . 1 1 30 30 LYS H H 30 9.200 9.200 8.593 0.607 18509 6298 1 13 . 1 1 31 31 VAL N N 31 126.037 126.037 115.325 10.712 18509 6299 1 13 . 1 1 31 31 VAL C C 31 172.244 172.244 173.170 -0.926 18509 6300 1 13 . 1 1 31 31 VAL CA C 31 57.139 57.139 58.830 -1.691 18509 6301 1 13 . 1 1 31 31 VAL H H 31 9.282 9.282 6.929 2.353 18509 6302 1 13 . 1 1 32 32 TRP N N 32 125.414 125.414 121.026 4.388 18509 6303 1 13 . 1 1 32 32 TRP C C 32 170.156 170.156 175.548 -5.392 18509 6304 1 13 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.297 -3.160 18509 6305 1 13 . 1 1 32 32 TRP H H 32 8.983 8.983 8.448 0.535 18509 6306 1 13 . 1 1 33 33 GLY N N 33 107.848 107.848 108.688 -0.840 18509 6307 1 13 . 1 1 33 33 GLY C C 33 168.400 168.400 172.296 -3.896 18509 6308 1 13 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.290 -3.723 18509 6309 1 13 . 1 1 33 33 GLY H H 33 8.360 8.360 8.474 -0.114 18509 6310 1 13 . 1 1 34 34 SER N N 34 114.377 114.377 117.504 -3.127 18509 6311 1 13 . 1 1 34 34 SER C C 34 169.618 169.618 173.259 -3.641 18509 6312 1 13 . 1 1 34 34 SER CA C 34 53.875 53.875 56.249 -2.374 18509 6313 1 13 . 1 1 34 34 SER H H 34 7.838 7.838 8.083 -0.245 18509 6314 1 13 . 1 1 35 35 ILE N N 35 123.149 123.149 122.247 0.902 18509 6315 1 13 . 1 1 35 35 ILE C C 35 169.713 169.713 174.887 -5.174 18509 6316 1 13 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.074 -2.305 18509 6317 1 13 . 1 1 35 35 ILE H H 35 8.496 8.496 8.078 0.418 18509 6318 1 13 . 1 1 36 36 LYS N N 36 123.803 123.803 126.332 -2.529 18509 6319 1 13 . 1 1 36 36 LYS C C 36 172.260 172.260 175.591 -3.331 18509 6320 1 13 . 1 1 36 36 LYS CA C 36 51.150 51.150 55.325 -4.175 18509 6321 1 13 . 1 1 36 36 LYS H H 36 9.091 9.091 8.978 0.113 18509 6322 1 13 . 1 1 37 37 GLY N N 37 105.495 105.495 111.384 -5.889 18509 6323 1 13 . 1 1 37 37 GLY C C 37 171.641 171.641 172.775 -1.134 18509 6324 1 13 . 1 1 37 37 GLY CA C 37 42.361 42.361 42.969 -0.608 18509 6325 1 13 . 1 1 37 37 GLY H H 37 8.237 8.237 8.784 -0.547 18509 6326 1 13 . 1 1 38 38 LEU N N 38 120.966 120.966 119.476 1.490 18509 6327 1 13 . 1 1 38 38 LEU C C 38 174.112 174.112 177.128 -3.016 18509 6328 1 13 . 1 1 38 38 LEU CA C 38 50.471 50.471 53.685 -3.214 18509 6329 1 13 . 1 1 38 38 LEU H H 38 8.156 8.156 8.487 -0.331 18509 6330 1 13 . 1 1 39 39 THR N N 39 110.363 110.363 118.258 -7.895 18509 6331 1 13 . 1 1 39 39 THR C C 39 173.102 173.102 174.331 -1.229 18509 6332 1 13 . 1 1 39 39 THR CA C 39 58.194 58.194 62.931 -4.737 18509 6333 1 13 . 1 1 39 39 THR H H 39 8.660 8.660 8.499 0.161 18509 6334 1 13 . 1 1 40 40 GLU N N 40 125.818 125.818 125.405 0.413 18509 6335 1 13 . 1 1 40 40 GLU C C 40 173.134 173.134 174.463 -1.329 18509 6336 1 13 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.822 -1.466 18509 6337 1 13 . 1 1 40 40 GLU H H 40 8.804 8.804 7.960 0.844 18509 6338 1 13 . 1 1 41 41 GLY N N 41 113.875 113.875 106.800 7.075 18509 6339 1 13 . 1 1 41 41 GLY C C 41 170.046 170.046 173.121 -3.075 18509 6340 1 13 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.253 -5.199 18509 6341 1 13 . 1 1 41 41 GLY H H 41 8.763 8.763 8.350 0.413 18509 6342 1 13 . 1 1 42 42 LEU N N 42 120.137 120.137 121.772 -1.635 18509 6343 1 13 . 1 1 42 42 LEU C C 42 174.218 174.218 175.922 -1.704 18509 6344 1 13 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.997 -2.842 18509 6345 1 13 . 1 1 42 42 LEU H H 42 8.313 8.313 8.475 -0.162 18509 6346 1 13 . 1 1 43 43 HIS N N 43 114.385 114.385 116.754 -2.369 18509 6347 1 13 . 1 1 43 43 HIS C C 43 171.504 171.504 173.932 -2.428 18509 6348 1 13 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.701 -4.716 18509 6349 1 13 . 1 1 43 43 HIS H H 43 8.712 8.712 8.141 0.571 18509 6350 1 13 . 1 1 44 44 GLY N N 44 108.872 108.872 110.264 -1.392 18509 6351 1 13 . 1 1 44 44 GLY C C 44 168.656 168.656 173.434 -4.778 18509 6352 1 13 . 1 1 44 44 GLY CA C 44 44.195 44.195 44.029 0.167 18509 6353 1 13 . 1 1 44 44 GLY H H 44 8.875 8.875 8.275 0.600 18509 6354 1 13 . 1 1 45 45 PHE N N 45 126.439 126.439 123.900 2.539 18509 6355 1 13 . 1 1 45 45 PHE CA C 45 53.098 53.098 54.966 -1.868 18509 6356 1 13 . 1 1 45 45 PHE H H 45 8.111 8.111 7.619 0.492 18509 6357 1 13 . 1 1 46 46 HIS N N 46 115.353 115.353 119.167 -3.814 18509 6358 1 13 . 1 1 46 46 HIS C C 46 172.415 172.415 173.855 -1.440 18509 6359 1 13 . 1 1 46 46 HIS CA C 46 49.206 49.206 53.814 -4.608 18509 6360 1 13 . 1 1 46 46 HIS H H 46 8.107 8.107 9.636 -1.529 18509 6361 1 13 . 1 1 47 47 VAL N N 47 120.548 120.548 121.117 -0.569 18509 6362 1 13 . 1 1 47 47 VAL C C 47 173.900 173.900 174.083 -0.183 18509 6363 1 13 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.926 -3.134 18509 6364 1 13 . 1 1 47 47 VAL H H 47 9.366 9.366 7.836 1.530 18509 6365 1 13 . 1 1 48 48 HIS N N 48 129.236 129.236 124.031 5.205 18509 6366 1 13 . 1 1 48 48 HIS C C 48 171.084 171.084 173.233 -2.149 18509 6367 1 13 . 1 1 48 48 HIS CA C 48 52.756 52.756 55.252 -2.496 18509 6368 1 13 . 1 1 48 48 HIS H H 48 10.210 10.210 8.763 1.447 18509 6369 1 13 . 1 1 49 49 GLU N N 49 118.119 118.119 124.340 -6.221 18509 6370 1 13 . 1 1 49 49 GLU C C 49 171.635 171.635 175.958 -4.323 18509 6371 1 13 . 1 1 49 49 GLU CA C 49 57.759 57.759 56.258 1.501 18509 6372 1 13 . 1 1 49 49 GLU H H 49 8.492 8.492 8.798 -0.306 18509 6373 1 13 . 1 1 50 50 PHE N N 50 110.329 110.329 118.366 -8.037 18509 6374 1 13 . 1 1 50 50 PHE C C 50 175.252 175.252 174.040 1.212 18509 6375 1 13 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.581 -5.681 18509 6376 1 13 . 1 1 50 50 PHE H H 50 8.580 8.580 9.233 -0.653 18509 6377 1 13 . 1 1 51 51 GLY N N 51 119.251 119.251 106.193 13.058 18509 6378 1 13 . 1 1 51 51 GLY C C 51 168.248 168.248 172.377 -4.129 18509 6379 1 13 . 1 1 51 51 GLY H H 51 10.208 10.208 7.697 2.511 18509 6380 1 13 . 1 1 52 52 ASP N N 52 114.958 114.958 118.024 -3.066 18509 6381 1 13 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.475 -5.584 18509 6382 1 13 . 1 1 52 52 ASP H H 52 5.834 5.834 8.381 -2.547 18509 6383 1 13 . 1 1 53 53 ASN N N 53 128.224 128.224 119.344 8.880 18509 6384 1 13 . 1 1 53 53 ASN CA C 53 48.233 48.233 51.725 -3.492 18509 6385 1 13 . 1 1 53 53 ASN H H 53 9.360 9.360 8.259 1.101 18509 6386 1 13 . 1 1 54 54 THR C C 54 168.656 168.656 174.325 -5.669 18509 6387 1 13 . 1 1 55 55 ALA N N 55 126.661 126.661 121.785 4.876 18509 6388 1 13 . 1 1 55 55 ALA C C 55 174.185 174.185 176.210 -2.025 18509 6389 1 13 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.807 -5.652 18509 6390 1 13 . 1 1 55 55 ALA H H 55 8.390 8.390 8.041 0.349 18509 6391 1 13 . 1 1 56 56 GLY N N 56 107.903 107.903 106.487 1.416 18509 6392 1 13 . 1 1 56 56 GLY C C 56 171.578 171.578 173.379 -1.801 18509 6393 1 13 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.365 -2.785 18509 6394 1 13 . 1 1 56 56 GLY H H 56 7.282 7.282 7.495 -0.213 18509 6395 1 13 . 1 1 57 57 CYS N N 57 117.952 117.952 124.657 -6.705 18509 6396 1 13 . 1 1 57 57 CYS C C 57 175.209 175.209 175.364 -0.155 18509 6397 1 13 . 1 1 57 57 CYS CA C 57 49.088 49.088 58.635 -9.546 18509 6398 1 13 . 1 1 57 57 CYS H H 57 8.900 8.900 8.694 0.206 18509 6399 1 13 . 1 1 58 58 THR N N 58 119.852 119.852 119.665 0.187 18509 6400 1 13 . 1 1 58 58 THR CA C 58 58.239 58.239 65.656 -7.417 18509 6401 1 13 . 1 1 58 58 THR H H 58 8.505 8.505 8.084 0.421 18509 6402 1 13 . 1 1 59 59 SER C C 59 170.763 170.763 175.553 -4.790 18509 6403 1 13 . 1 1 59 59 SER CA C 59 55.609 55.609 61.124 -5.515 18509 6404 1 13 . 1 1 60 60 ALA N N 60 119.753 119.753 121.044 -1.291 18509 6405 1 13 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.358 -2.417 18509 6406 1 13 . 1 1 60 60 ALA H H 60 6.898 6.898 8.201 -1.303 18509 6407 1 13 . 1 1 61 61 GLY N N 61 101.351 101.351 108.338 -6.987 18509 6408 1 13 . 1 1 61 61 GLY CA C 61 42.805 42.805 47.542 -4.737 18509 6409 1 13 . 1 1 61 61 GLY H H 61 7.730 7.730 7.556 0.174 18509 6410 1 13 . 1 1 62 62 PRO C C 62 172.276 172.276 175.394 -3.118 18509 6411 1 13 . 1 1 63 63 HIS N N 63 115.023 115.023 115.010 0.013 18509 6412 1 13 . 1 1 63 63 HIS CA C 63 52.119 52.119 56.287 -4.168 18509 6413 1 13 . 1 1 63 63 HIS H H 63 7.474 7.474 8.094 -0.620 18509 6414 1 13 . 1 1 64 64 PHE C C 64 171.731 171.731 173.336 -1.605 18509 6415 1 13 . 1 1 65 65 ASN N N 65 126.978 126.978 122.593 4.385 18509 6416 1 13 . 1 1 65 65 ASN CA C 65 47.753 47.753 49.951 -2.198 18509 6417 1 13 . 1 1 65 65 ASN H H 65 9.426 9.426 8.415 1.011 18509 6418 1 13 . 1 1 67 67 LEU N N 67 117.937 117.937 114.703 3.234 18509 6419 1 13 . 1 1 67 67 LEU C C 67 172.580 172.580 177.956 -5.376 18509 6420 1 13 . 1 1 67 67 LEU CA C 67 50.911 50.911 54.222 -3.311 18509 6421 1 13 . 1 1 67 67 LEU H H 67 7.720 7.720 7.422 0.298 18509 6422 1 13 . 1 1 68 68 SER N N 68 110.842 110.842 117.252 -6.410 18509 6423 1 13 . 1 1 68 68 SER CA C 68 55.953 55.953 59.465 -3.512 18509 6424 1 13 . 1 1 68 68 SER H H 68 7.428 7.428 8.117 -0.689 18509 6425 1 13 . 1 1 69 69 ARG N N 69 120.782 120.782 119.278 1.504 18509 6426 1 13 . 1 1 69 69 ARG C C 69 173.381 173.381 177.242 -3.861 18509 6427 1 13 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.175 -4.632 18509 6428 1 13 . 1 1 69 69 ARG H H 69 8.508 8.508 8.207 0.301 18509 6429 1 13 . 1 1 70 70 LYS N N 70 118.055 118.055 121.620 -3.565 18509 6430 1 13 . 1 1 70 70 LYS C C 70 169.994 169.994 176.478 -6.484 18509 6431 1 13 . 1 1 70 70 LYS CA C 70 52.596 52.596 58.899 -6.303 18509 6432 1 13 . 1 1 70 70 LYS H H 70 8.745 8.745 7.687 1.058 18509 6433 1 13 . 1 1 71 71 HIS N N 71 111.871 111.871 115.092 -3.221 18509 6434 1 13 . 1 1 71 71 HIS C C 71 171.534 171.534 173.709 -2.175 18509 6435 1 13 . 1 1 71 71 HIS CA C 71 52.549 52.549 54.969 -2.420 18509 6436 1 13 . 1 1 71 71 HIS H H 71 7.152 7.152 8.071 -0.919 18509 6437 1 13 . 1 1 72 72 GLY N N 72 112.910 112.910 108.622 4.288 18509 6438 1 13 . 1 1 72 72 GLY C C 72 168.634 168.634 173.626 -4.992 18509 6439 1 13 . 1 1 72 72 GLY CA C 72 41.274 41.274 46.150 -4.876 18509 6440 1 13 . 1 1 72 72 GLY H H 72 7.209 7.209 8.254 -1.045 18509 6441 1 13 . 1 1 73 73 GLY N N 73 105.207 105.207 110.747 -5.540 18509 6442 1 13 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.403 -2.182 18509 6443 1 13 . 1 1 73 73 GLY H H 73 8.789 8.789 7.959 0.830 18509 6444 1 13 . 1 1 74 74 PRO C C 74 175.753 175.753 177.233 -1.480 18509 6445 1 13 . 1 1 75 75 LYS N N 75 114.868 114.868 118.158 -3.290 18509 6446 1 13 . 1 1 75 75 LYS C C 75 173.640 173.640 174.895 -1.255 18509 6447 1 13 . 1 1 75 75 LYS CA C 75 51.103 51.103 57.173 -6.070 18509 6448 1 13 . 1 1 75 75 LYS H H 75 8.651 8.651 8.199 0.452 18509 6449 1 13 . 1 1 76 76 ASP N N 76 120.414 120.414 115.993 4.421 18509 6450 1 13 . 1 1 76 76 ASP C C 76 172.557 172.557 174.299 -1.742 18509 6451 1 13 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.011 -2.702 18509 6452 1 13 . 1 1 76 76 ASP H H 76 7.461 7.461 7.850 -0.389 18509 6453 1 13 . 1 1 77 77 GLU N N 77 120.820 120.820 122.074 -1.254 18509 6454 1 13 . 1 1 77 77 GLU C C 77 174.101 174.101 173.922 0.179 18509 6455 1 13 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.339 -1.826 18509 6456 1 13 . 1 1 77 77 GLU H H 77 8.315 8.315 8.582 -0.267 18509 6457 1 13 . 1 1 78 78 GLU N N 78 119.251 119.251 121.214 -1.963 18509 6458 1 13 . 1 1 78 78 GLU C C 78 168.285 168.285 174.260 -5.975 18509 6459 1 13 . 1 1 78 78 GLU CA C 78 52.078 52.078 56.352 -4.274 18509 6460 1 13 . 1 1 78 78 GLU H H 78 8.109 8.109 8.600 -0.491 18509 6461 1 13 . 1 1 79 79 ARG N N 79 118.991 118.991 118.225 0.766 18509 6462 1 13 . 1 1 79 79 ARG C C 79 172.123 172.123 175.047 -2.924 18509 6463 1 13 . 1 1 79 79 ARG CA C 79 51.074 51.074 54.828 -3.754 18509 6464 1 13 . 1 1 79 79 ARG H H 79 6.999 6.999 8.280 -1.281 18509 6465 1 13 . 1 1 80 80 HIS N N 80 118.000 118.000 116.494 1.506 18509 6466 1 13 . 1 1 80 80 HIS CA C 80 49.953 49.953 55.999 -6.046 18509 6467 1 13 . 1 1 80 80 HIS H H 80 8.355 8.355 8.974 -0.619 18509 6468 1 13 . 1 1 81 81 VAL C C 81 173.460 173.460 175.057 -1.597 18509 6469 1 13 . 1 1 82 82 GLY N N 82 97.322 97.322 112.708 -15.386 18509 6470 1 13 . 1 1 82 82 GLY C C 82 170.370 170.370 172.954 -2.584 18509 6471 1 13 . 1 1 82 82 GLY CA C 82 42.688 42.688 44.678 -1.990 18509 6472 1 13 . 1 1 82 82 GLY H H 82 8.487 8.487 8.569 -0.082 18509 6473 1 13 . 1 1 83 83 ASP N N 83 120.890 120.890 116.717 4.173 18509 6474 1 13 . 1 1 83 83 ASP C C 83 168.737 168.737 173.636 -4.899 18509 6475 1 13 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.435 -0.517 18509 6476 1 13 . 1 1 83 83 ASP H H 83 7.127 7.127 7.512 -0.385 18509 6477 1 13 . 1 1 84 84 LEU N N 84 120.154 120.154 118.810 1.344 18509 6478 1 13 . 1 1 84 84 LEU C C 84 173.212 173.212 176.048 -2.836 18509 6479 1 13 . 1 1 84 84 LEU CA C 84 50.433 50.433 52.338 -1.905 18509 6480 1 13 . 1 1 84 84 LEU H H 84 7.128 7.128 8.130 -1.002 18509 6481 1 13 . 1 1 85 85 GLY N N 85 106.867 106.867 107.207 -0.340 18509 6482 1 13 . 1 1 85 85 GLY C C 85 167.654 167.654 173.608 -5.954 18509 6483 1 13 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.712 -2.701 18509 6484 1 13 . 1 1 85 85 GLY H H 85 8.260 8.260 8.666 -0.406 18509 6485 1 13 . 1 1 86 86 ASN N N 86 117.454 117.454 119.465 -2.011 18509 6486 1 13 . 1 1 86 86 ASN C C 86 173.942 173.942 174.053 -0.111 18509 6487 1 13 . 1 1 86 86 ASN CA C 86 49.266 49.266 53.086 -3.820 18509 6488 1 13 . 1 1 86 86 ASN H H 86 8.041 8.041 8.492 -0.451 18509 6489 1 13 . 1 1 87 87 VAL N N 87 113.370 113.370 118.515 -5.145 18509 6490 1 13 . 1 1 87 87 VAL C C 87 171.526 171.526 173.999 -2.473 18509 6491 1 13 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.150 -4.442 18509 6492 1 13 . 1 1 87 87 VAL H H 87 8.960 8.960 8.073 0.887 18509 6493 1 13 . 1 1 88 88 THR N N 88 117.939 117.939 119.164 -1.225 18509 6494 1 13 . 1 1 88 88 THR C C 88 170.367 170.367 172.725 -2.358 18509 6495 1 13 . 1 1 88 88 THR CA C 88 58.694 58.694 60.121 -1.427 18509 6496 1 13 . 1 1 88 88 THR H H 88 8.681 8.681 8.248 0.433 18509 6497 1 13 . 1 1 89 89 ALA N N 89 128.674 128.674 127.886 0.788 18509 6498 1 13 . 1 1 89 89 ALA C C 89 174.480 174.480 175.028 -0.548 18509 6499 1 13 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.087 -3.718 18509 6500 1 13 . 1 1 89 89 ALA H H 89 9.377 9.377 8.266 1.111 18509 6501 1 13 . 1 1 90 90 ASP N N 90 124.235 124.235 121.437 2.798 18509 6502 1 13 . 1 1 90 90 ASP C C 90 173.825 173.825 176.865 -3.040 18509 6503 1 13 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.359 -3.012 18509 6504 1 13 . 1 1 90 90 ASP H H 90 8.455 8.455 8.078 0.377 18509 6505 1 13 . 1 1 91 91 LYS N N 91 114.942 114.942 118.397 -3.455 18509 6506 1 13 . 1 1 91 91 LYS C C 91 174.101 174.101 174.993 -0.892 18509 6507 1 13 . 1 1 91 91 LYS CA C 91 55.279 55.279 57.415 -2.136 18509 6508 1 13 . 1 1 91 91 LYS H H 91 8.231 8.231 8.511 -0.280 18509 6509 1 13 . 1 1 92 92 ASP N N 92 119.251 119.251 118.309 0.942 18509 6510 1 13 . 1 1 92 92 ASP C C 92 173.020 173.020 175.588 -2.568 18509 6511 1 13 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.120 -1.993 18509 6512 1 13 . 1 1 92 92 ASP H H 92 8.109 8.109 7.619 0.490 18509 6513 1 13 . 1 1 93 93 GLY N N 93 110.868 110.868 112.308 -1.440 18509 6514 1 13 . 1 1 93 93 GLY C C 93 169.706 169.706 173.409 -3.703 18509 6515 1 13 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.428 -1.665 18509 6516 1 13 . 1 1 93 93 GLY H H 93 8.405 8.405 8.734 -0.329 18509 6517 1 13 . 1 1 94 94 VAL N N 94 118.755 118.755 124.960 -6.205 18509 6518 1 13 . 1 1 94 94 VAL C C 94 173.510 173.510 174.209 -0.699 18509 6519 1 13 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.492 -3.307 18509 6520 1 13 . 1 1 94 94 VAL H H 94 7.814 7.814 7.531 0.283 18509 6521 1 13 . 1 1 95 95 ALA N N 95 131.313 131.313 129.775 1.538 18509 6522 1 13 . 1 1 95 95 ALA C C 95 171.635 171.635 175.833 -4.198 18509 6523 1 13 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.041 -3.127 18509 6524 1 13 . 1 1 95 95 ALA H H 95 9.763 9.763 9.026 0.737 18509 6525 1 13 . 1 1 96 96 ASP N N 96 125.170 125.170 123.054 2.116 18509 6526 1 13 . 1 1 96 96 ASP C C 96 172.336 172.336 175.847 -3.511 18509 6527 1 13 . 1 1 96 96 ASP H H 96 8.515 8.515 8.231 0.284 18509 6528 1 13 . 1 1 97 97 VAL N N 97 125.879 125.879 121.536 4.343 18509 6529 1 13 . 1 1 97 97 VAL C C 97 173.488 173.488 176.130 -2.642 18509 6530 1 13 . 1 1 97 97 VAL CA C 97 58.243 58.243 62.946 -4.703 18509 6531 1 13 . 1 1 97 97 VAL H H 97 8.703 8.703 8.300 0.403 18509 6532 1 13 . 1 1 98 98 SER N N 98 123.017 123.017 122.002 1.015 18509 6533 1 13 . 1 1 98 98 SER C C 98 169.715 169.715 173.935 -4.220 18509 6534 1 13 . 1 1 98 98 SER CA C 98 55.068 55.068 57.339 -2.271 18509 6535 1 13 . 1 1 98 98 SER H H 98 8.784 8.784 8.416 0.368 18509 6536 1 13 . 1 1 99 99 ILE N N 99 125.807 125.807 122.645 3.162 18509 6537 1 13 . 1 1 99 99 ILE C C 99 171.321 171.321 175.088 -3.767 18509 6538 1 13 . 1 1 99 99 ILE CA C 99 57.155 57.155 60.075 -2.920 18509 6539 1 13 . 1 1 99 99 ILE H H 99 9.411 9.411 8.623 0.788 18509 6540 1 13 . 1 1 100 100 GLU N N 100 124.068 124.068 119.808 4.260 18509 6541 1 13 . 1 1 100 100 GLU C C 100 172.098 172.098 174.779 -2.681 18509 6542 1 13 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.949 -2.659 18509 6543 1 13 . 1 1 100 100 GLU H H 100 8.652 8.652 7.869 0.783 18509 6544 1 13 . 1 1 101 101 ASP N N 101 126.109 126.109 120.682 5.427 18509 6545 1 13 . 1 1 101 101 ASP C C 101 171.144 171.144 175.672 -4.528 18509 6546 1 13 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.060 -1.641 18509 6547 1 13 . 1 1 101 101 ASP H H 101 9.317 9.317 8.376 0.941 18509 6548 1 13 . 1 1 102 102 SER N N 102 118.470 118.470 116.078 2.392 18509 6549 1 13 . 1 1 102 102 SER C C 102 171.596 171.596 173.849 -2.253 18509 6550 1 13 . 1 1 102 102 SER CA C 102 55.245 55.245 59.683 -4.438 18509 6551 1 13 . 1 1 102 102 SER H H 102 8.933 8.933 8.619 0.314 18509 6552 1 13 . 1 1 103 103 VAL N N 103 123.179 123.179 121.332 1.847 18509 6553 1 13 . 1 1 103 103 VAL CA C 103 61.450 61.450 62.300 -0.850 18509 6554 1 13 . 1 1 103 103 VAL H H 103 8.148 8.148 7.843 0.305 18509 6555 1 13 . 1 1 104 104 ILE C C 104 169.576 169.576 174.986 -5.410 18509 6556 1 13 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.144 0.050 18509 6557 1 13 . 1 1 105 105 SER N N 105 107.618 107.618 116.226 -8.608 18509 6558 1 13 . 1 1 105 105 SER C C 105 170.046 170.046 174.732 -4.686 18509 6559 1 13 . 1 1 105 105 SER CA C 105 52.550 52.550 56.821 -4.271 18509 6560 1 13 . 1 1 105 105 SER H H 105 6.988 6.988 7.703 -0.715 18509 6561 1 13 . 1 1 106 106 LEU N N 106 120.137 120.137 118.788 1.349 18509 6562 1 13 . 1 1 106 106 LEU H H 106 8.313 8.313 8.420 -0.107 18509 6563 1 13 . 1 1 107 107 SER C C 107 170.701 170.701 173.126 -2.425 18509 6564 1 13 . 1 1 107 107 SER CA C 107 54.540 54.540 57.667 -3.127 18509 6565 1 13 . 1 1 108 108 GLY N N 108 107.603 107.603 110.279 -2.676 18509 6566 1 13 . 1 1 108 108 GLY C C 108 173.128 173.128 173.174 -0.046 18509 6567 1 13 . 1 1 108 108 GLY CA C 108 41.287 41.287 43.453 -2.166 18509 6568 1 13 . 1 1 108 108 GLY H H 108 8.717 8.717 7.631 1.086 18509 6569 1 13 . 1 1 109 109 ASP N N 109 120.664 120.664 119.297 1.367 18509 6570 1 13 . 1 1 109 109 ASP C C 109 171.904 171.904 176.842 -4.938 18509 6571 1 13 . 1 1 109 109 ASP H H 109 9.019 9.019 9.024 -0.005 18509 6572 1 13 . 1 1 110 110 HIS N N 110 116.324 116.324 116.541 -0.217 18509 6573 1 13 . 1 1 110 110 HIS H H 110 9.283 9.283 9.214 0.069 18509 6574 1 13 . 1 1 111 111 SER N N 111 110.225 110.225 112.076 -1.851 18509 6575 1 13 . 1 1 111 111 SER CA C 111 54.681 54.681 56.989 -2.308 18509 6576 1 13 . 1 1 111 111 SER H H 111 7.156 7.156 7.952 -0.796 18509 6577 1 13 . 1 1 112 112 ILE N N 112 117.053 117.053 122.850 -5.797 18509 6578 1 13 . 1 1 112 112 ILE C C 112 171.419 171.419 176.100 -4.681 18509 6579 1 13 . 1 1 112 112 ILE CA C 112 57.239 57.239 62.512 -5.273 18509 6580 1 13 . 1 1 112 112 ILE H H 112 7.837 7.837 8.871 -1.034 18509 6581 1 13 . 1 1 113 113 ILE N N 113 121.032 121.032 119.190 1.842 18509 6582 1 13 . 1 1 113 113 ILE C C 113 173.604 173.604 177.165 -3.561 18509 6583 1 13 . 1 1 113 113 ILE CA C 113 58.318 58.318 62.425 -4.107 18509 6584 1 13 . 1 1 113 113 ILE H H 113 7.592 7.592 7.427 0.165 18509 6585 1 13 . 1 1 114 114 GLY N N 114 112.661 112.661 115.838 -3.177 18509 6586 1 13 . 1 1 114 114 GLY C C 114 169.739 169.739 173.538 -3.799 18509 6587 1 13 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.864 -2.954 18509 6588 1 13 . 1 1 114 114 GLY H H 114 9.575 9.575 8.870 0.705 18509 6589 1 13 . 1 1 115 115 ARG N N 115 118.398 118.398 120.156 -1.758 18509 6590 1 13 . 1 1 115 115 ARG C C 115 171.079 171.079 175.107 -4.028 18509 6591 1 13 . 1 1 115 115 ARG CA C 115 51.663 51.663 53.286 -1.623 18509 6592 1 13 . 1 1 115 115 ARG H H 115 7.464 7.464 7.416 0.048 18509 6593 1 13 . 1 1 116 116 THR N N 116 112.218 112.218 112.443 -0.225 18509 6594 1 13 . 1 1 116 116 THR C C 116 169.821 169.821 173.609 -3.788 18509 6595 1 13 . 1 1 116 116 THR CA C 116 59.633 59.633 60.698 -1.065 18509 6596 1 13 . 1 1 116 116 THR H H 116 6.677 6.677 8.112 -1.435 18509 6597 1 13 . 1 1 117 117 LEU N N 117 129.477 129.477 123.737 5.740 18509 6598 1 13 . 1 1 117 117 LEU C C 117 171.126 171.126 175.217 -4.091 18509 6599 1 13 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.871 -4.456 18509 6600 1 13 . 1 1 117 117 LEU H H 117 8.799 8.799 8.274 0.525 18509 6601 1 13 . 1 1 118 118 VAL N N 118 125.091 125.091 123.189 1.902 18509 6602 1 13 . 1 1 118 118 VAL C C 118 170.267 170.267 174.339 -4.072 18509 6603 1 13 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.444 -3.305 18509 6604 1 13 . 1 1 118 118 VAL H H 118 8.906 8.906 8.240 0.666 18509 6605 1 13 . 1 1 119 119 VAL N N 119 120.716 120.716 127.303 -6.587 18509 6606 1 13 . 1 1 119 119 VAL C C 119 171.175 171.175 172.968 -1.793 18509 6607 1 13 . 1 1 119 119 VAL CA C 119 55.271 55.271 60.400 -5.128 18509 6608 1 13 . 1 1 119 119 VAL H H 119 7.982 7.982 8.126 -0.144 18509 6609 1 13 . 1 1 120 120 HIS N N 120 125.052 125.052 124.785 0.267 18509 6610 1 13 . 1 1 120 120 HIS C C 120 172.599 172.599 173.417 -0.818 18509 6611 1 13 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.142 -0.748 18509 6612 1 13 . 1 1 120 120 HIS H H 120 8.935 8.935 7.489 1.446 18509 6613 1 13 . 1 1 121 121 GLU N N 121 121.453 121.453 123.410 -1.957 18509 6614 1 13 . 1 1 121 121 GLU C C 121 172.304 172.304 175.990 -3.686 18509 6615 1 13 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.998 -0.908 18509 6616 1 13 . 1 1 121 121 GLU H H 121 9.178 9.178 8.208 0.970 18509 6617 1 13 . 1 1 122 122 LYS N N 122 115.248 115.248 125.049 -9.801 18509 6618 1 13 . 1 1 122 122 LYS C C 122 171.523 171.523 174.662 -3.139 18509 6619 1 13 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.386 -4.767 18509 6620 1 13 . 1 1 122 122 LYS H H 122 8.478 8.478 8.274 0.204 18509 6621 1 13 . 1 1 123 123 ALA N N 123 120.866 120.866 124.484 -3.618 18509 6622 1 13 . 1 1 123 123 ALA C C 123 173.219 173.219 175.596 -2.377 18509 6623 1 13 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.041 -3.191 18509 6624 1 13 . 1 1 123 123 ALA H H 123 7.796 7.796 8.573 -0.777 18509 6625 1 13 . 1 1 124 124 ASP N N 124 121.799 121.799 122.193 -0.394 18509 6626 1 13 . 1 1 124 124 ASP C C 124 174.458 174.458 173.613 0.845 18509 6627 1 13 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.105 -3.697 18509 6628 1 13 . 1 1 124 124 ASP H H 124 10.165 10.165 8.148 2.017 18509 6629 1 13 . 1 1 125 125 ASP N N 125 129.369 129.369 123.000 6.369 18509 6630 1 13 . 1 1 125 125 ASP C C 125 175.231 175.231 175.023 0.208 18509 6631 1 13 . 1 1 125 125 ASP CA C 125 50.939 50.939 52.865 -1.926 18509 6632 1 13 . 1 1 125 125 ASP H H 125 10.055 10.055 8.219 1.836 18509 6633 1 13 . 1 1 126 126 LEU N N 126 117.190 117.190 123.109 -5.919 18509 6634 1 13 . 1 1 126 126 LEU C C 126 173.964 173.964 178.549 -4.585 18509 6635 1 13 . 1 1 126 126 LEU H H 126 10.483 10.483 8.698 1.785 18509 6636 1 13 . 1 1 127 127 GLY N N 127 103.809 103.809 107.260 -3.451 18509 6637 1 13 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.149 -3.271 18509 6638 1 13 . 1 1 127 127 GLY H H 127 8.637 8.637 8.886 -0.249 18509 6639 1 13 . 1 1 128 128 LYS N N 128 118.290 118.290 121.304 -3.014 18509 6640 1 13 . 1 1 128 128 LYS CA C 128 51.740 51.740 53.896 -2.156 18509 6641 1 13 . 1 1 128 128 LYS H H 128 7.158 7.158 8.821 -1.663 18509 6642 1 13 . 1 1 129 129 GLY N N 129 108.507 108.507 107.451 1.056 18509 6643 1 13 . 1 1 129 129 GLY C C 129 171.524 171.524 174.156 -2.632 18509 6644 1 13 . 1 1 129 129 GLY CA C 129 42.113 42.113 45.323 -3.210 18509 6645 1 13 . 1 1 129 129 GLY H H 129 8.913 8.913 7.749 1.164 18509 6646 1 13 . 1 1 130 130 GLY N N 130 108.537 108.537 107.827 0.710 18509 6647 1 13 . 1 1 130 130 GLY C C 130 169.994 169.994 173.496 -3.502 18509 6648 1 13 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.583 -2.164 18509 6649 1 13 . 1 1 130 130 GLY H H 130 8.723 8.723 7.398 1.325 18509 6650 1 13 . 1 1 131 131 ASN N N 131 111.951 111.951 119.318 -7.367 18509 6651 1 13 . 1 1 131 131 ASN C C 131 172.236 172.236 176.069 -3.833 18509 6652 1 13 . 1 1 131 131 ASN H H 131 7.152 7.152 8.757 -1.605 18509 6653 1 13 . 1 1 132 132 GLU N N 132 120.461 120.461 121.417 -0.956 18509 6654 1 13 . 1 1 132 132 GLU C C 132 171.084 171.084 178.479 -7.395 18509 6655 1 13 . 1 1 132 132 GLU H H 132 8.935 8.935 8.903 0.032 18509 6656 1 13 . 1 1 133 133 GLU N N 133 120.137 120.137 117.805 2.332 18509 6657 1 13 . 1 1 133 133 GLU C C 133 176.239 176.239 178.823 -2.584 18509 6658 1 13 . 1 1 133 133 GLU H H 133 8.775 8.775 8.761 0.014 18509 6659 1 13 . 1 1 134 134 SER N N 134 114.981 114.981 114.973 0.008 18509 6660 1 13 . 1 1 134 134 SER CA C 134 59.046 59.046 60.992 -1.946 18509 6661 1 13 . 1 1 134 134 SER H H 134 8.117 8.117 8.241 -0.124 18509 6662 1 13 . 1 1 135 135 THR N N 135 102.263 102.263 117.368 -15.105 18509 6663 1 13 . 1 1 135 135 THR C C 135 172.804 172.804 176.169 -3.365 18509 6664 1 13 . 1 1 135 135 THR CA C 135 60.029 60.029 65.517 -5.488 18509 6665 1 13 . 1 1 135 135 THR H H 135 7.206 7.206 8.710 -1.504 18509 6666 1 13 . 1 1 136 136 LYS N N 136 122.108 122.108 120.876 1.232 18509 6667 1 13 . 1 1 136 136 LYS H H 136 7.884 7.884 7.633 0.251 18509 6668 1 13 . 1 1 137 137 THR N N 137 105.718 105.718 113.975 -8.257 18509 6669 1 13 . 1 1 137 137 THR H H 137 8.630 8.630 8.054 0.576 18509 6670 1 13 . 1 1 138 138 GLY N N 138 111.372 111.372 110.295 1.077 18509 6671 1 13 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.470 -2.987 18509 6672 1 13 . 1 1 138 138 GLY H H 138 7.426 7.426 7.900 -0.474 18509 6673 1 13 . 1 1 139 139 ASN N N 139 107.496 107.496 118.333 -10.837 18509 6674 1 13 . 1 1 139 139 ASN H H 139 7.545 7.545 7.829 -0.284 18509 6675 1 13 . 1 1 140 140 ALA N N 140 114.542 114.542 125.007 -10.465 18509 6676 1 13 . 1 1 140 140 ALA C C 140 173.571 173.571 177.307 -3.736 18509 6677 1 13 . 1 1 140 140 ALA H H 140 6.368 6.368 8.023 -1.655 18509 6678 1 13 . 1 1 141 141 GLY N N 141 105.287 105.287 106.070 -0.783 18509 6679 1 13 . 1 1 141 141 GLY C C 141 173.542 173.542 175.578 -2.036 18509 6680 1 13 . 1 1 141 141 GLY H H 141 8.271 8.271 8.025 0.246 18509 6681 1 13 . 1 1 142 142 SER N N 142 118.771 118.771 116.679 2.092 18509 6682 1 13 . 1 1 142 142 SER C C 142 170.188 170.188 174.587 -4.399 18509 6683 1 13 . 1 1 142 142 SER H H 142 9.196 9.196 8.529 0.667 18509 6684 1 13 . 1 1 143 143 ARG N N 143 120.189 120.189 114.716 5.473 18509 6685 1 13 . 1 1 143 143 ARG C C 143 171.596 171.596 176.161 -4.565 18509 6686 1 13 . 1 1 143 143 ARG H H 143 8.943 8.943 8.380 0.563 18509 6687 1 13 . 1 1 144 144 LEU N N 144 122.907 122.907 118.093 4.814 18509 6688 1 13 . 1 1 144 144 LEU C C 144 174.393 174.393 176.834 -2.441 18509 6689 1 13 . 1 1 144 144 LEU CA C 144 53.375 53.375 57.078 -3.703 18509 6690 1 13 . 1 1 144 144 LEU H H 144 8.395 8.395 8.214 0.181 18509 6691 1 13 . 1 1 145 145 ALA N N 145 114.159 114.159 119.563 -5.404 18509 6692 1 13 . 1 1 145 145 ALA C C 145 171.752 171.752 175.910 -4.158 18509 6693 1 13 . 1 1 145 145 ALA CA C 145 48.129 48.129 50.716 -2.587 18509 6694 1 13 . 1 1 145 145 ALA H H 145 7.356 7.356 7.843 -0.487 18509 6695 1 13 . 1 1 146 146 CYS N N 146 110.738 110.738 117.801 -7.063 18509 6696 1 13 . 1 1 146 146 CYS C C 146 170.087 170.087 173.017 -2.930 18509 6697 1 13 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.935 -6.858 18509 6698 1 13 . 1 1 146 146 CYS H H 146 9.008 9.008 7.971 1.037 18509 6699 1 13 . 1 1 147 147 GLY N N 147 106.461 106.461 112.974 -6.513 18509 6700 1 13 . 1 1 147 147 GLY C C 147 167.909 167.909 172.497 -4.588 18509 6701 1 13 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.835 -3.161 18509 6702 1 13 . 1 1 147 147 GLY H H 147 8.018 8.018 8.544 -0.526 18509 6703 1 13 . 1 1 148 148 VAL N N 148 124.054 124.054 121.824 2.230 18509 6704 1 13 . 1 1 148 148 VAL C C 148 172.084 172.084 173.327 -1.243 18509 6705 1 13 . 1 1 148 148 VAL CA C 148 59.635 59.635 61.942 -2.307 18509 6706 1 13 . 1 1 148 148 VAL H H 148 8.434 8.434 8.015 0.419 18509 6707 1 13 . 1 1 149 149 ILE N N 149 126.918 126.918 127.586 -0.668 18509 6708 1 13 . 1 1 149 149 ILE C C 149 171.804 171.804 173.755 -1.951 18509 6709 1 13 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.367 -0.183 18509 6710 1 13 . 1 1 149 149 ILE H H 149 8.613 8.613 8.766 -0.153 18509 6711 1 13 . 1 1 150 150 GLY N N 150 116.493 116.493 112.802 3.691 18509 6712 1 13 . 1 1 150 150 GLY C C 150 170.188 170.188 172.742 -2.554 18509 6713 1 13 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.415 -4.295 18509 6714 1 13 . 1 1 150 150 GLY H H 150 9.283 9.283 7.955 1.328 18509 6715 1 13 . 1 1 151 151 ILE N N 151 120.189 120.189 121.667 -1.478 18509 6716 1 13 . 1 1 151 151 ILE C C 151 172.231 172.231 174.008 -1.777 18509 6717 1 13 . 1 1 151 151 ILE CA C 151 60.372 60.372 60.221 0.151 18509 6718 1 13 . 1 1 151 151 ILE H H 151 8.943 8.943 8.457 0.486 18509 6719 1 13 . 1 1 152 152 ALA N N 152 129.719 129.719 132.170 -2.451 18509 6720 1 13 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.484 -4.713 18509 6721 1 13 . 1 1 152 152 ALA H H 152 8.170 8.170 8.376 -0.206 18509 6722 1 14 . 1 1 2 2 THR C C 2 170.139 170.139 174.319 -4.180 18509 6723 1 14 . 1 1 3 3 LYS N N 3 123.998 123.998 120.813 3.185 18509 6724 1 14 . 1 1 3 3 LYS C C 3 171.607 171.607 173.925 -2.318 18509 6725 1 14 . 1 1 3 3 LYS CA C 3 51.178 51.178 55.528 -4.350 18509 6726 1 14 . 1 1 3 3 LYS H H 3 8.666 8.666 7.684 0.982 18509 6727 1 14 . 1 1 4 4 ALA N N 4 123.295 123.295 125.319 -2.024 18509 6728 1 14 . 1 1 4 4 ALA C C 4 172.145 172.145 175.153 -3.008 18509 6729 1 14 . 1 1 4 4 ALA CA C 4 47.504 47.504 51.044 -3.540 18509 6730 1 14 . 1 1 4 4 ALA H H 4 9.116 9.116 8.496 0.620 18509 6731 1 14 . 1 1 5 5 VAL N N 5 121.466 121.466 121.242 0.224 18509 6732 1 14 . 1 1 5 5 VAL C C 5 167.836 167.836 174.732 -6.896 18509 6733 1 14 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.059 -4.184 18509 6734 1 14 . 1 1 5 5 VAL H H 5 9.545 9.545 8.210 1.335 18509 6735 1 14 . 1 1 6 6 ALA N N 6 125.984 125.984 130.109 -4.125 18509 6736 1 14 . 1 1 6 6 ALA C C 6 171.607 171.607 175.860 -4.253 18509 6737 1 14 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.074 -2.603 18509 6738 1 14 . 1 1 6 6 ALA H H 6 9.177 9.177 8.276 0.901 18509 6739 1 14 . 1 1 7 7 VAL N N 7 123.600 123.600 121.949 1.651 18509 6740 1 14 . 1 1 7 7 VAL C C 7 172.244 172.244 174.671 -2.427 18509 6741 1 14 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.760 -3.284 18509 6742 1 14 . 1 1 7 7 VAL H H 7 9.116 9.116 7.840 1.276 18509 6743 1 14 . 1 1 8 8 LEU N N 8 126.455 126.455 128.093 -1.638 18509 6744 1 14 . 1 1 8 8 LEU C C 8 172.557 172.557 175.838 -3.281 18509 6745 1 14 . 1 1 8 8 LEU CA C 8 51.052 51.052 54.029 -2.977 18509 6746 1 14 . 1 1 8 8 LEU H H 8 8.916 8.916 8.823 0.093 18509 6747 1 14 . 1 1 9 9 LYS N N 9 120.820 120.820 121.395 -0.575 18509 6748 1 14 . 1 1 9 9 LYS C C 9 172.509 172.509 175.652 -3.143 18509 6749 1 14 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.517 -3.620 18509 6750 1 14 . 1 1 9 9 LYS H H 9 8.315 8.315 8.105 0.210 18509 6751 1 14 . 1 1 10 10 GLY N N 10 111.249 111.249 110.886 0.363 18509 6752 1 14 . 1 1 10 10 GLY C C 10 169.847 169.847 173.215 -3.368 18509 6753 1 14 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.216 -2.941 18509 6754 1 14 . 1 1 10 10 GLY H H 10 8.968 8.968 8.122 0.846 18509 6755 1 14 . 1 1 11 11 ASP N N 11 120.904 120.904 120.656 0.248 18509 6756 1 14 . 1 1 11 11 ASP C C 11 173.132 173.132 177.095 -3.963 18509 6757 1 14 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.296 -3.979 18509 6758 1 14 . 1 1 11 11 ASP H H 11 8.745 8.745 8.698 0.047 18509 6759 1 14 . 1 1 12 12 GLY N N 12 109.862 109.862 109.795 0.067 18509 6760 1 14 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.678 -2.478 18509 6761 1 14 . 1 1 12 12 GLY H H 12 7.985 7.985 8.523 -0.538 18509 6762 1 14 . 1 1 13 13 PRO C C 13 173.640 173.640 176.187 -2.547 18509 6763 1 14 . 1 1 14 14 VAL N N 14 120.414 120.414 118.790 1.624 18509 6764 1 14 . 1 1 14 14 VAL C C 14 172.804 172.804 174.917 -2.113 18509 6765 1 14 . 1 1 14 14 VAL CA C 14 59.884 59.884 58.984 0.900 18509 6766 1 14 . 1 1 14 14 VAL H H 14 7.476 7.476 8.043 -0.567 18509 6767 1 14 . 1 1 15 15 GLN N N 15 122.664 122.664 121.858 0.806 18509 6768 1 14 . 1 1 15 15 GLN C C 15 171.168 171.168 174.881 -3.713 18509 6769 1 14 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.856 -4.177 18509 6770 1 14 . 1 1 15 15 GLN H H 15 7.938 7.938 8.799 -0.861 18509 6771 1 14 . 1 1 16 16 GLY N N 16 107.018 107.018 109.628 -2.610 18509 6772 1 14 . 1 1 16 16 GLY C C 16 167.726 167.726 171.988 -4.262 18509 6773 1 14 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.460 -1.835 18509 6774 1 14 . 1 1 16 16 GLY H H 16 8.288 8.288 8.489 -0.201 18509 6775 1 14 . 1 1 17 17 ILE N N 17 120.248 120.248 117.793 2.455 18509 6776 1 14 . 1 1 17 17 ILE C C 17 171.194 171.194 174.276 -3.082 18509 6777 1 14 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.509 -1.012 18509 6778 1 14 . 1 1 17 17 ILE H H 17 7.948 7.948 7.868 0.080 18509 6779 1 14 . 1 1 18 18 ILE N N 18 125.851 125.851 121.069 4.782 18509 6780 1 14 . 1 1 18 18 ILE C C 18 168.889 168.889 174.736 -5.847 18509 6781 1 14 . 1 1 18 18 ILE CA C 18 53.431 53.431 58.587 -5.156 18509 6782 1 14 . 1 1 18 18 ILE H H 18 8.725 8.725 8.335 0.390 18509 6783 1 14 . 1 1 19 19 ASN N N 19 123.256 123.256 124.522 -1.266 18509 6784 1 14 . 1 1 19 19 ASN C C 19 168.903 168.903 173.640 -4.737 18509 6785 1 14 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.978 -2.890 18509 6786 1 14 . 1 1 19 19 ASN H H 19 8.727 8.727 8.452 0.275 18509 6787 1 14 . 1 1 20 20 PHE N N 20 113.849 113.849 120.492 -6.643 18509 6788 1 14 . 1 1 20 20 PHE C C 20 173.219 173.219 174.811 -1.592 18509 6789 1 14 . 1 1 20 20 PHE CA C 20 52.058 52.058 56.957 -4.899 18509 6790 1 14 . 1 1 20 20 PHE H H 20 8.399 8.399 8.741 -0.342 18509 6791 1 14 . 1 1 21 21 GLU N N 21 121.454 121.454 121.401 0.053 18509 6792 1 14 . 1 1 21 21 GLU C C 21 170.280 170.280 175.515 -5.235 18509 6793 1 14 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.743 -1.699 18509 6794 1 14 . 1 1 21 21 GLU H H 21 9.526 9.526 8.493 1.033 18509 6795 1 14 . 1 1 22 22 GLN N N 22 130.340 130.340 121.755 8.585 18509 6796 1 14 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.063 -2.883 18509 6797 1 14 . 1 1 22 22 GLN H H 22 9.305 9.305 8.851 0.454 18509 6798 1 14 . 1 1 23 23 LYS N N 23 128.657 128.657 124.596 4.061 18509 6799 1 14 . 1 1 23 23 LYS CA C 23 57.241 57.241 54.432 2.809 18509 6800 1 14 . 1 1 23 23 LYS H H 23 9.088 9.088 8.478 0.610 18509 6801 1 14 . 1 1 24 24 GLU CA C 24 51.392 51.392 59.220 -7.828 18509 6802 1 14 . 1 1 25 25 SER CA C 25 58.078 58.078 59.481 -1.403 18509 6803 1 14 . 1 1 27 27 GLY N N 27 108.125 108.125 110.509 -2.384 18509 6804 1 14 . 1 1 27 27 GLY CA C 27 42.925 42.925 43.852 -0.927 18509 6805 1 14 . 1 1 27 27 GLY H H 27 8.032 8.032 7.996 0.036 18509 6806 1 14 . 1 1 28 28 PRO C C 28 173.128 173.128 175.480 -2.352 18509 6807 1 14 . 1 1 29 29 VAL N N 29 121.267 121.267 124.876 -3.609 18509 6808 1 14 . 1 1 29 29 VAL C C 29 172.198 172.198 175.191 -2.993 18509 6809 1 14 . 1 1 29 29 VAL CA C 29 57.720 57.720 60.978 -3.258 18509 6810 1 14 . 1 1 29 29 VAL H H 29 9.089 9.089 7.911 1.178 18509 6811 1 14 . 1 1 30 30 LYS N N 30 127.589 127.589 128.742 -1.153 18509 6812 1 14 . 1 1 30 30 LYS C C 30 172.098 172.098 174.765 -2.667 18509 6813 1 14 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.481 -2.839 18509 6814 1 14 . 1 1 30 30 LYS H H 30 9.200 9.200 8.664 0.536 18509 6815 1 14 . 1 1 31 31 VAL N N 31 126.037 126.037 126.605 -0.568 18509 6816 1 14 . 1 1 31 31 VAL C C 31 172.244 172.244 173.692 -1.448 18509 6817 1 14 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.510 -2.371 18509 6818 1 14 . 1 1 31 31 VAL H H 31 9.282 9.282 7.901 1.381 18509 6819 1 14 . 1 1 32 32 TRP N N 32 125.414 125.414 128.450 -3.036 18509 6820 1 14 . 1 1 32 32 TRP C C 32 170.156 170.156 175.044 -4.888 18509 6821 1 14 . 1 1 32 32 TRP CA C 32 53.137 53.137 55.942 -2.805 18509 6822 1 14 . 1 1 32 32 TRP H H 32 8.983 8.983 7.922 1.061 18509 6823 1 14 . 1 1 33 33 GLY N N 33 107.848 107.848 110.330 -2.482 18509 6824 1 14 . 1 1 33 33 GLY C C 33 168.400 168.400 172.416 -4.016 18509 6825 1 14 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.418 -3.851 18509 6826 1 14 . 1 1 33 33 GLY H H 33 8.360 8.360 8.207 0.153 18509 6827 1 14 . 1 1 34 34 SER N N 34 114.377 114.377 118.812 -4.435 18509 6828 1 14 . 1 1 34 34 SER C C 34 169.618 169.618 172.823 -3.205 18509 6829 1 14 . 1 1 34 34 SER CA C 34 53.875 53.875 57.350 -3.475 18509 6830 1 14 . 1 1 34 34 SER H H 34 7.838 7.838 8.280 -0.442 18509 6831 1 14 . 1 1 35 35 ILE N N 35 123.149 123.149 124.337 -1.188 18509 6832 1 14 . 1 1 35 35 ILE C C 35 169.713 169.713 173.541 -3.828 18509 6833 1 14 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.058 -2.289 18509 6834 1 14 . 1 1 35 35 ILE H H 35 8.496 8.496 9.029 -0.533 18509 6835 1 14 . 1 1 36 36 LYS N N 36 123.803 123.803 127.356 -3.553 18509 6836 1 14 . 1 1 36 36 LYS C C 36 172.260 172.260 175.850 -3.590 18509 6837 1 14 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.080 -2.930 18509 6838 1 14 . 1 1 36 36 LYS H H 36 9.091 9.091 8.714 0.377 18509 6839 1 14 . 1 1 37 37 GLY N N 37 105.495 105.495 109.738 -4.243 18509 6840 1 14 . 1 1 37 37 GLY C C 37 171.641 171.641 173.207 -1.566 18509 6841 1 14 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.254 -1.893 18509 6842 1 14 . 1 1 37 37 GLY H H 37 8.237 8.237 7.982 0.255 18509 6843 1 14 . 1 1 38 38 LEU N N 38 120.966 120.966 119.875 1.091 18509 6844 1 14 . 1 1 38 38 LEU C C 38 174.112 174.112 177.314 -3.202 18509 6845 1 14 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.614 -4.143 18509 6846 1 14 . 1 1 38 38 LEU H H 38 8.156 8.156 8.411 -0.255 18509 6847 1 14 . 1 1 39 39 THR N N 39 110.363 110.363 115.193 -4.830 18509 6848 1 14 . 1 1 39 39 THR C C 39 173.102 173.102 174.040 -0.938 18509 6849 1 14 . 1 1 39 39 THR CA C 39 58.194 58.194 63.157 -4.963 18509 6850 1 14 . 1 1 39 39 THR H H 39 8.660 8.660 8.256 0.404 18509 6851 1 14 . 1 1 40 40 GLU N N 40 125.818 125.818 126.284 -0.466 18509 6852 1 14 . 1 1 40 40 GLU C C 40 173.134 173.134 174.046 -0.912 18509 6853 1 14 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.001 -1.645 18509 6854 1 14 . 1 1 40 40 GLU H H 40 8.804 8.804 8.086 0.718 18509 6855 1 14 . 1 1 41 41 GLY N N 41 113.875 113.875 107.873 6.002 18509 6856 1 14 . 1 1 41 41 GLY C C 41 170.046 170.046 173.006 -2.960 18509 6857 1 14 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.392 -5.338 18509 6858 1 14 . 1 1 41 41 GLY H H 41 8.763 8.763 8.298 0.465 18509 6859 1 14 . 1 1 42 42 LEU N N 42 120.137 120.137 123.677 -3.540 18509 6860 1 14 . 1 1 42 42 LEU C C 42 174.218 174.218 175.931 -1.713 18509 6861 1 14 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.256 -3.101 18509 6862 1 14 . 1 1 42 42 LEU H H 42 8.313 8.313 8.212 0.101 18509 6863 1 14 . 1 1 43 43 HIS N N 43 114.385 114.385 117.116 -2.731 18509 6864 1 14 . 1 1 43 43 HIS C C 43 171.504 171.504 174.229 -2.725 18509 6865 1 14 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.721 -4.736 18509 6866 1 14 . 1 1 43 43 HIS H H 43 8.712 8.712 7.571 1.141 18509 6867 1 14 . 1 1 44 44 GLY N N 44 108.872 108.872 114.674 -5.802 18509 6868 1 14 . 1 1 44 44 GLY C C 44 168.656 168.656 172.572 -3.916 18509 6869 1 14 . 1 1 44 44 GLY CA C 44 44.195 44.195 44.601 -0.406 18509 6870 1 14 . 1 1 44 44 GLY H H 44 8.875 8.875 8.045 0.830 18509 6871 1 14 . 1 1 45 45 PHE N N 45 126.439 126.439 122.928 3.511 18509 6872 1 14 . 1 1 45 45 PHE CA C 45 53.098 53.098 55.671 -2.573 18509 6873 1 14 . 1 1 45 45 PHE H H 45 8.111 8.111 8.276 -0.165 18509 6874 1 14 . 1 1 46 46 HIS N N 46 115.353 115.353 118.637 -3.284 18509 6875 1 14 . 1 1 46 46 HIS C C 46 172.415 172.415 174.357 -1.942 18509 6876 1 14 . 1 1 46 46 HIS CA C 46 49.206 49.206 55.820 -6.614 18509 6877 1 14 . 1 1 46 46 HIS H H 46 8.107 8.107 8.629 -0.522 18509 6878 1 14 . 1 1 47 47 VAL N N 47 120.548 120.548 122.998 -2.450 18509 6879 1 14 . 1 1 47 47 VAL C C 47 173.900 173.900 173.945 -0.045 18509 6880 1 14 . 1 1 47 47 VAL CA C 47 58.792 58.792 62.401 -3.609 18509 6881 1 14 . 1 1 47 47 VAL H H 47 9.366 9.366 9.246 0.120 18509 6882 1 14 . 1 1 48 48 HIS N N 48 129.236 129.236 123.811 5.425 18509 6883 1 14 . 1 1 48 48 HIS C C 48 171.084 171.084 173.447 -2.363 18509 6884 1 14 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.228 -1.472 18509 6885 1 14 . 1 1 48 48 HIS H H 48 10.210 10.210 8.612 1.598 18509 6886 1 14 . 1 1 49 49 GLU N N 49 118.119 118.119 119.078 -0.959 18509 6887 1 14 . 1 1 49 49 GLU C C 49 171.635 171.635 176.485 -4.850 18509 6888 1 14 . 1 1 49 49 GLU CA C 49 57.759 57.759 56.959 0.800 18509 6889 1 14 . 1 1 49 49 GLU H H 49 8.492 8.492 8.130 0.361 18509 6890 1 14 . 1 1 50 50 PHE N N 50 110.329 110.329 116.679 -6.350 18509 6891 1 14 . 1 1 50 50 PHE C C 50 175.252 175.252 174.681 0.571 18509 6892 1 14 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.426 -5.526 18509 6893 1 14 . 1 1 50 50 PHE H H 50 8.580 8.580 8.992 -0.412 18509 6894 1 14 . 1 1 51 51 GLY N N 51 119.251 119.251 105.731 13.520 18509 6895 1 14 . 1 1 51 51 GLY C C 51 168.248 168.248 172.949 -4.701 18509 6896 1 14 . 1 1 51 51 GLY H H 51 10.208 10.208 7.735 2.473 18509 6897 1 14 . 1 1 52 52 ASP N N 52 114.958 114.958 120.395 -5.437 18509 6898 1 14 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.213 -5.322 18509 6899 1 14 . 1 1 52 52 ASP H H 52 5.834 5.834 7.843 -2.009 18509 6900 1 14 . 1 1 53 53 ASN N N 53 128.224 128.224 117.459 10.765 18509 6901 1 14 . 1 1 53 53 ASN CA C 53 48.233 48.233 51.841 -3.608 18509 6902 1 14 . 1 1 53 53 ASN H H 53 9.360 9.360 8.362 0.998 18509 6903 1 14 . 1 1 54 54 THR C C 54 168.656 168.656 173.856 -5.200 18509 6904 1 14 . 1 1 55 55 ALA N N 55 126.661 126.661 121.455 5.206 18509 6905 1 14 . 1 1 55 55 ALA C C 55 174.185 174.185 176.133 -1.948 18509 6906 1 14 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.270 -5.115 18509 6907 1 14 . 1 1 55 55 ALA H H 55 8.390 8.390 7.936 0.454 18509 6908 1 14 . 1 1 56 56 GLY N N 56 107.903 107.903 106.171 1.732 18509 6909 1 14 . 1 1 56 56 GLY C C 56 171.578 171.578 173.013 -1.435 18509 6910 1 14 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.212 -2.632 18509 6911 1 14 . 1 1 56 56 GLY H H 56 7.282 7.282 7.373 -0.091 18509 6912 1 14 . 1 1 57 57 CYS N N 57 117.952 117.952 123.427 -5.475 18509 6913 1 14 . 1 1 57 57 CYS C C 57 175.209 175.209 176.323 -1.114 18509 6914 1 14 . 1 1 57 57 CYS CA C 57 49.088 49.088 55.494 -6.406 18509 6915 1 14 . 1 1 57 57 CYS H H 57 8.900 8.900 8.333 0.567 18509 6916 1 14 . 1 1 58 58 THR N N 58 119.852 119.852 117.501 2.351 18509 6917 1 14 . 1 1 58 58 THR CA C 58 58.239 58.239 64.935 -6.696 18509 6918 1 14 . 1 1 58 58 THR H H 58 8.505 8.505 8.978 -0.473 18509 6919 1 14 . 1 1 59 59 SER C C 59 170.763 170.763 175.234 -4.471 18509 6920 1 14 . 1 1 59 59 SER CA C 59 55.609 55.609 60.920 -5.311 18509 6921 1 14 . 1 1 60 60 ALA N N 60 119.753 119.753 121.380 -1.627 18509 6922 1 14 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.835 -2.895 18509 6923 1 14 . 1 1 60 60 ALA H H 60 6.898 6.898 7.993 -1.095 18509 6924 1 14 . 1 1 61 61 GLY N N 61 101.351 101.351 106.534 -5.183 18509 6925 1 14 . 1 1 61 61 GLY CA C 61 42.805 42.805 43.027 -0.222 18509 6926 1 14 . 1 1 61 61 GLY H H 61 7.730 7.730 7.438 0.292 18509 6927 1 14 . 1 1 62 62 PRO C C 62 172.276 172.276 176.906 -4.630 18509 6928 1 14 . 1 1 63 63 HIS N N 63 115.023 115.023 114.628 0.395 18509 6929 1 14 . 1 1 63 63 HIS CA C 63 52.119 52.119 58.919 -6.800 18509 6930 1 14 . 1 1 63 63 HIS H H 63 7.474 7.474 7.615 -0.141 18509 6931 1 14 . 1 1 64 64 PHE C C 64 171.731 171.731 174.930 -3.199 18509 6932 1 14 . 1 1 65 65 ASN N N 65 126.978 126.978 124.784 2.194 18509 6933 1 14 . 1 1 65 65 ASN CA C 65 47.753 47.753 49.892 -2.139 18509 6934 1 14 . 1 1 65 65 ASN H H 65 9.426 9.426 7.911 1.515 18509 6935 1 14 . 1 1 67 67 LEU N N 67 117.937 117.937 115.946 1.991 18509 6936 1 14 . 1 1 67 67 LEU C C 67 172.580 172.580 177.430 -4.850 18509 6937 1 14 . 1 1 67 67 LEU CA C 67 50.911 50.911 54.559 -3.648 18509 6938 1 14 . 1 1 67 67 LEU H H 67 7.720 7.720 7.963 -0.243 18509 6939 1 14 . 1 1 68 68 SER N N 68 110.842 110.842 115.498 -4.656 18509 6940 1 14 . 1 1 68 68 SER CA C 68 55.953 55.953 58.751 -2.797 18509 6941 1 14 . 1 1 68 68 SER H H 68 7.428 7.428 7.798 -0.370 18509 6942 1 14 . 1 1 69 69 ARG N N 69 120.782 120.782 120.461 0.321 18509 6943 1 14 . 1 1 69 69 ARG C C 69 173.381 173.381 175.050 -1.669 18509 6944 1 14 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.783 -5.240 18509 6945 1 14 . 1 1 69 69 ARG H H 69 8.508 8.508 7.927 0.581 18509 6946 1 14 . 1 1 70 70 LYS N N 70 118.055 118.055 119.238 -1.183 18509 6947 1 14 . 1 1 70 70 LYS C C 70 169.994 169.994 176.548 -6.554 18509 6948 1 14 . 1 1 70 70 LYS CA C 70 52.596 52.596 55.847 -3.251 18509 6949 1 14 . 1 1 70 70 LYS H H 70 8.745 8.745 7.487 1.258 18509 6950 1 14 . 1 1 71 71 HIS N N 71 111.871 111.871 119.391 -7.520 18509 6951 1 14 . 1 1 71 71 HIS C C 71 171.534 171.534 175.568 -4.034 18509 6952 1 14 . 1 1 71 71 HIS CA C 71 52.549 52.549 58.563 -6.014 18509 6953 1 14 . 1 1 71 71 HIS H H 71 7.152 7.152 9.013 -1.861 18509 6954 1 14 . 1 1 72 72 GLY N N 72 112.910 112.910 104.304 8.606 18509 6955 1 14 . 1 1 72 72 GLY C C 72 168.634 168.634 174.569 -5.935 18509 6956 1 14 . 1 1 72 72 GLY CA C 72 41.274 41.274 45.232 -3.958 18509 6957 1 14 . 1 1 72 72 GLY H H 72 7.209 7.209 8.307 -1.098 18509 6958 1 14 . 1 1 73 73 GLY N N 73 105.207 105.207 108.297 -3.090 18509 6959 1 14 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.159 -1.938 18509 6960 1 14 . 1 1 73 73 GLY H H 73 8.789 8.789 7.716 1.073 18509 6961 1 14 . 1 1 74 74 PRO C C 74 175.753 175.753 176.976 -1.223 18509 6962 1 14 . 1 1 75 75 LYS N N 75 114.868 114.868 119.739 -4.871 18509 6963 1 14 . 1 1 75 75 LYS C C 75 173.640 173.640 176.068 -2.428 18509 6964 1 14 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.050 -4.947 18509 6965 1 14 . 1 1 75 75 LYS H H 75 8.651 8.651 7.926 0.725 18509 6966 1 14 . 1 1 76 76 ASP N N 76 120.414 120.414 112.859 7.555 18509 6967 1 14 . 1 1 76 76 ASP C C 76 172.557 172.557 175.742 -3.185 18509 6968 1 14 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.772 -3.462 18509 6969 1 14 . 1 1 76 76 ASP H H 76 7.461 7.461 8.146 -0.685 18509 6970 1 14 . 1 1 77 77 GLU N N 77 120.820 120.820 115.705 5.115 18509 6971 1 14 . 1 1 77 77 GLU C C 77 174.101 174.101 177.597 -3.496 18509 6972 1 14 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.520 -2.007 18509 6973 1 14 . 1 1 77 77 GLU H H 77 8.315 8.315 7.809 0.506 18509 6974 1 14 . 1 1 78 78 GLU N N 78 119.251 119.251 125.189 -5.938 18509 6975 1 14 . 1 1 78 78 GLU C C 78 168.285 168.285 176.693 -8.408 18509 6976 1 14 . 1 1 78 78 GLU CA C 78 52.078 52.078 59.345 -7.267 18509 6977 1 14 . 1 1 78 78 GLU H H 78 8.109 8.109 8.857 -0.748 18509 6978 1 14 . 1 1 79 79 ARG N N 79 118.991 118.991 116.572 2.419 18509 6979 1 14 . 1 1 79 79 ARG C C 79 172.123 172.123 175.154 -3.031 18509 6980 1 14 . 1 1 79 79 ARG CA C 79 51.074 51.074 54.055 -2.981 18509 6981 1 14 . 1 1 79 79 ARG H H 79 6.999 6.999 7.445 -0.446 18509 6982 1 14 . 1 1 80 80 HIS N N 80 118.000 118.000 118.297 -0.297 18509 6983 1 14 . 1 1 80 80 HIS CA C 80 49.953 49.953 55.902 -5.949 18509 6984 1 14 . 1 1 80 80 HIS H H 80 8.355 8.355 7.951 0.404 18509 6985 1 14 . 1 1 81 81 VAL C C 81 173.460 173.460 175.328 -1.868 18509 6986 1 14 . 1 1 82 82 GLY N N 82 97.322 97.322 107.546 -10.224 18509 6987 1 14 . 1 1 82 82 GLY C C 82 170.370 170.370 171.891 -1.521 18509 6988 1 14 . 1 1 82 82 GLY CA C 82 42.688 42.688 44.295 -1.607 18509 6989 1 14 . 1 1 82 82 GLY H H 82 8.487 8.487 7.816 0.671 18509 6990 1 14 . 1 1 83 83 ASP N N 83 120.890 120.890 118.430 2.460 18509 6991 1 14 . 1 1 83 83 ASP C C 83 168.737 168.737 173.946 -5.209 18509 6992 1 14 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.321 -0.403 18509 6993 1 14 . 1 1 83 83 ASP H H 83 7.127 7.127 8.063 -0.936 18509 6994 1 14 . 1 1 84 84 LEU N N 84 120.154 120.154 121.306 -1.152 18509 6995 1 14 . 1 1 84 84 LEU C C 84 173.212 173.212 175.168 -1.956 18509 6996 1 14 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.174 -3.741 18509 6997 1 14 . 1 1 84 84 LEU H H 84 7.128 7.128 8.366 -1.238 18509 6998 1 14 . 1 1 85 85 GLY N N 85 106.867 106.867 111.722 -4.855 18509 6999 1 14 . 1 1 85 85 GLY C C 85 167.654 167.654 172.480 -4.826 18509 7000 1 14 . 1 1 85 85 GLY CA C 85 43.011 43.011 43.881 -0.870 18509 7001 1 14 . 1 1 85 85 GLY H H 85 8.260 8.260 9.271 -1.011 18509 7002 1 14 . 1 1 86 86 ASN N N 86 117.454 117.454 120.483 -3.029 18509 7003 1 14 . 1 1 86 86 ASN C C 86 173.942 173.942 173.932 0.010 18509 7004 1 14 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.456 -3.191 18509 7005 1 14 . 1 1 86 86 ASN H H 86 8.041 8.041 8.459 -0.418 18509 7006 1 14 . 1 1 87 87 VAL N N 87 113.370 113.370 122.428 -9.058 18509 7007 1 14 . 1 1 87 87 VAL C C 87 171.526 171.526 174.956 -3.430 18509 7008 1 14 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.521 -4.813 18509 7009 1 14 . 1 1 87 87 VAL H H 87 8.960 8.960 8.150 0.810 18509 7010 1 14 . 1 1 88 88 THR N N 88 117.939 117.939 117.501 0.438 18509 7011 1 14 . 1 1 88 88 THR C C 88 170.367 170.367 173.084 -2.717 18509 7012 1 14 . 1 1 88 88 THR CA C 88 58.694 58.694 60.430 -1.736 18509 7013 1 14 . 1 1 88 88 THR H H 88 8.681 8.681 8.197 0.484 18509 7014 1 14 . 1 1 89 89 ALA N N 89 128.674 128.674 128.400 0.274 18509 7015 1 14 . 1 1 89 89 ALA C C 89 174.480 174.480 177.144 -2.664 18509 7016 1 14 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.583 -4.214 18509 7017 1 14 . 1 1 89 89 ALA H H 89 9.377 9.377 8.292 1.085 18509 7018 1 14 . 1 1 90 90 ASP N N 90 124.235 124.235 123.940 0.295 18509 7019 1 14 . 1 1 90 90 ASP C C 90 173.825 173.825 177.217 -3.392 18509 7020 1 14 . 1 1 90 90 ASP CA C 90 49.347 49.347 53.818 -4.471 18509 7021 1 14 . 1 1 90 90 ASP H H 90 8.455 8.455 8.453 0.002 18509 7022 1 14 . 1 1 91 91 LYS N N 91 114.942 114.942 121.096 -6.154 18509 7023 1 14 . 1 1 91 91 LYS C C 91 174.101 174.101 176.150 -2.049 18509 7024 1 14 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.143 -2.864 18509 7025 1 14 . 1 1 91 91 LYS H H 91 8.231 8.231 8.756 -0.525 18509 7026 1 14 . 1 1 92 92 ASP N N 92 119.251 119.251 118.601 0.650 18509 7027 1 14 . 1 1 92 92 ASP C C 92 173.020 173.020 175.732 -2.712 18509 7028 1 14 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.770 -2.643 18509 7029 1 14 . 1 1 92 92 ASP H H 92 8.109 8.109 8.095 0.014 18509 7030 1 14 . 1 1 93 93 GLY N N 93 110.868 110.868 110.330 0.538 18509 7031 1 14 . 1 1 93 93 GLY C C 93 169.706 169.706 172.731 -3.025 18509 7032 1 14 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.860 -2.097 18509 7033 1 14 . 1 1 93 93 GLY H H 93 8.405 8.405 8.602 -0.197 18509 7034 1 14 . 1 1 94 94 VAL N N 94 118.755 118.755 123.132 -4.377 18509 7035 1 14 . 1 1 94 94 VAL C C 94 173.510 173.510 173.218 0.292 18509 7036 1 14 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.249 -3.064 18509 7037 1 14 . 1 1 94 94 VAL H H 94 7.814 7.814 7.576 0.238 18509 7038 1 14 . 1 1 95 95 ALA N N 95 131.313 131.313 130.750 0.563 18509 7039 1 14 . 1 1 95 95 ALA C C 95 171.635 171.635 174.837 -3.202 18509 7040 1 14 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.890 -3.976 18509 7041 1 14 . 1 1 95 95 ALA H H 95 9.763 9.763 8.652 1.111 18509 7042 1 14 . 1 1 96 96 ASP N N 96 125.170 125.170 122.725 2.445 18509 7043 1 14 . 1 1 96 96 ASP C C 96 172.336 172.336 175.211 -2.875 18509 7044 1 14 . 1 1 96 96 ASP H H 96 8.515 8.515 8.647 -0.132 18509 7045 1 14 . 1 1 97 97 VAL N N 97 125.879 125.879 126.532 -0.653 18509 7046 1 14 . 1 1 97 97 VAL C C 97 173.488 173.488 173.648 -0.160 18509 7047 1 14 . 1 1 97 97 VAL CA C 97 58.243 58.243 60.496 -2.253 18509 7048 1 14 . 1 1 97 97 VAL H H 97 8.703 8.703 8.848 -0.145 18509 7049 1 14 . 1 1 98 98 SER N N 98 123.017 123.017 125.123 -2.106 18509 7050 1 14 . 1 1 98 98 SER C C 98 169.715 169.715 172.831 -3.116 18509 7051 1 14 . 1 1 98 98 SER CA C 98 55.068 55.068 57.236 -2.168 18509 7052 1 14 . 1 1 98 98 SER H H 98 8.784 8.784 7.864 0.920 18509 7053 1 14 . 1 1 99 99 ILE N N 99 125.807 125.807 125.482 0.325 18509 7054 1 14 . 1 1 99 99 ILE C C 99 171.321 171.321 175.079 -3.758 18509 7055 1 14 . 1 1 99 99 ILE CA C 99 57.155 57.155 59.788 -2.633 18509 7056 1 14 . 1 1 99 99 ILE H H 99 9.411 9.411 7.876 1.535 18509 7057 1 14 . 1 1 100 100 GLU N N 100 124.068 124.068 127.161 -3.093 18509 7058 1 14 . 1 1 100 100 GLU C C 100 172.098 172.098 175.014 -2.916 18509 7059 1 14 . 1 1 100 100 GLU CA C 100 52.290 52.290 55.754 -3.464 18509 7060 1 14 . 1 1 100 100 GLU H H 100 8.652 8.652 8.515 0.137 18509 7061 1 14 . 1 1 101 101 ASP N N 101 126.109 126.109 123.051 3.058 18509 7062 1 14 . 1 1 101 101 ASP C C 101 171.144 171.144 174.909 -3.765 18509 7063 1 14 . 1 1 101 101 ASP CA C 101 51.419 51.419 52.730 -1.311 18509 7064 1 14 . 1 1 101 101 ASP H H 101 9.317 9.317 8.232 1.085 18509 7065 1 14 . 1 1 102 102 SER N N 102 118.470 118.470 117.931 0.539 18509 7066 1 14 . 1 1 102 102 SER C C 102 171.596 171.596 174.772 -3.176 18509 7067 1 14 . 1 1 102 102 SER CA C 102 55.245 55.245 59.163 -3.918 18509 7068 1 14 . 1 1 102 102 SER H H 102 8.933 8.933 8.695 0.238 18509 7069 1 14 . 1 1 103 103 VAL N N 103 123.179 123.179 123.145 0.034 18509 7070 1 14 . 1 1 103 103 VAL CA C 103 61.450 61.450 61.630 -0.180 18509 7071 1 14 . 1 1 103 103 VAL H H 103 8.148 8.148 8.437 -0.289 18509 7072 1 14 . 1 1 104 104 ILE C C 104 169.576 169.576 174.355 -4.779 18509 7073 1 14 . 1 1 104 104 ILE CA C 104 60.194 60.194 61.553 -1.359 18509 7074 1 14 . 1 1 105 105 SER N N 105 107.618 107.618 115.939 -8.321 18509 7075 1 14 . 1 1 105 105 SER C C 105 170.046 170.046 173.370 -3.324 18509 7076 1 14 . 1 1 105 105 SER CA C 105 52.550 52.550 56.000 -3.450 18509 7077 1 14 . 1 1 105 105 SER H H 105 6.988 6.988 7.650 -0.662 18509 7078 1 14 . 1 1 106 106 LEU N N 106 120.137 120.137 118.961 1.176 18509 7079 1 14 . 1 1 106 106 LEU H H 106 8.313 8.313 8.302 0.011 18509 7080 1 14 . 1 1 107 107 SER C C 107 170.701 170.701 174.070 -3.369 18509 7081 1 14 . 1 1 107 107 SER CA C 107 54.540 54.540 59.277 -4.737 18509 7082 1 14 . 1 1 108 108 GLY N N 108 107.603 107.603 113.488 -5.885 18509 7083 1 14 . 1 1 108 108 GLY C C 108 173.128 173.128 172.965 0.163 18509 7084 1 14 . 1 1 108 108 GLY CA C 108 41.287 41.287 45.142 -3.854 18509 7085 1 14 . 1 1 108 108 GLY H H 108 8.717 8.717 8.244 0.473 18509 7086 1 14 . 1 1 109 109 ASP N N 109 120.664 120.664 120.455 0.209 18509 7087 1 14 . 1 1 109 109 ASP C C 109 171.904 171.904 176.148 -4.244 18509 7088 1 14 . 1 1 109 109 ASP H H 109 9.019 9.019 8.695 0.324 18509 7089 1 14 . 1 1 110 110 HIS N N 110 116.324 116.324 116.873 -0.549 18509 7090 1 14 . 1 1 110 110 HIS H H 110 9.283 9.283 8.262 1.021 18509 7091 1 14 . 1 1 111 111 SER N N 111 110.225 110.225 111.343 -1.118 18509 7092 1 14 . 1 1 111 111 SER CA C 111 54.681 54.681 57.283 -2.602 18509 7093 1 14 . 1 1 111 111 SER H H 111 7.156 7.156 7.925 -0.769 18509 7094 1 14 . 1 1 112 112 ILE N N 112 117.053 117.053 118.716 -1.663 18509 7095 1 14 . 1 1 112 112 ILE C C 112 171.419 171.419 176.737 -5.318 18509 7096 1 14 . 1 1 112 112 ILE CA C 112 57.239 57.239 63.359 -6.120 18509 7097 1 14 . 1 1 112 112 ILE H H 112 7.837 7.837 8.487 -0.650 18509 7098 1 14 . 1 1 113 113 ILE N N 113 121.032 121.032 122.584 -1.552 18509 7099 1 14 . 1 1 113 113 ILE C C 113 173.604 173.604 176.203 -2.599 18509 7100 1 14 . 1 1 113 113 ILE CA C 113 58.318 58.318 62.510 -4.192 18509 7101 1 14 . 1 1 113 113 ILE H H 113 7.592 7.592 7.866 -0.274 18509 7102 1 14 . 1 1 114 114 GLY N N 114 112.661 112.661 114.814 -2.153 18509 7103 1 14 . 1 1 114 114 GLY C C 114 169.739 169.739 173.424 -3.685 18509 7104 1 14 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.857 -2.947 18509 7105 1 14 . 1 1 114 114 GLY H H 114 9.575 9.575 8.386 1.189 18509 7106 1 14 . 1 1 115 115 ARG N N 115 118.398 118.398 121.334 -2.936 18509 7107 1 14 . 1 1 115 115 ARG C C 115 171.079 171.079 174.879 -3.800 18509 7108 1 14 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.316 -2.653 18509 7109 1 14 . 1 1 115 115 ARG H H 115 7.464 7.464 7.765 -0.301 18509 7110 1 14 . 1 1 116 116 THR N N 116 112.218 112.218 117.588 -5.370 18509 7111 1 14 . 1 1 116 116 THR C C 116 169.821 169.821 173.509 -3.688 18509 7112 1 14 . 1 1 116 116 THR CA C 116 59.633 59.633 60.339 -0.706 18509 7113 1 14 . 1 1 116 116 THR H H 116 6.677 6.677 8.445 -1.768 18509 7114 1 14 . 1 1 117 117 LEU N N 117 129.477 129.477 127.692 1.785 18509 7115 1 14 . 1 1 117 117 LEU C C 117 171.126 171.126 175.051 -3.925 18509 7116 1 14 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.465 -4.051 18509 7117 1 14 . 1 1 117 117 LEU H H 117 8.799 8.799 8.740 0.059 18509 7118 1 14 . 1 1 118 118 VAL N N 118 125.091 125.091 124.614 0.477 18509 7119 1 14 . 1 1 118 118 VAL C C 118 170.267 170.267 174.667 -4.400 18509 7120 1 14 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.381 -3.242 18509 7121 1 14 . 1 1 118 118 VAL H H 118 8.906 8.906 8.016 0.890 18509 7122 1 14 . 1 1 119 119 VAL N N 119 120.716 120.716 126.674 -5.958 18509 7123 1 14 . 1 1 119 119 VAL C C 119 171.175 171.175 173.703 -2.528 18509 7124 1 14 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.654 -4.383 18509 7125 1 14 . 1 1 119 119 VAL H H 119 7.982 7.982 7.763 0.219 18509 7126 1 14 . 1 1 120 120 HIS N N 120 125.052 125.052 119.136 5.916 18509 7127 1 14 . 1 1 120 120 HIS C C 120 172.599 172.599 173.843 -1.244 18509 7128 1 14 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.315 -0.921 18509 7129 1 14 . 1 1 120 120 HIS H H 120 8.935 8.935 8.370 0.565 18509 7130 1 14 . 1 1 121 121 GLU N N 121 121.453 121.453 121.273 0.180 18509 7131 1 14 . 1 1 121 121 GLU C C 121 172.304 172.304 175.388 -3.084 18509 7132 1 14 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.487 -0.397 18509 7133 1 14 . 1 1 121 121 GLU H H 121 9.178 9.178 8.027 1.151 18509 7134 1 14 . 1 1 122 122 LYS N N 122 115.248 115.248 121.755 -6.507 18509 7135 1 14 . 1 1 122 122 LYS C C 122 171.523 171.523 174.674 -3.151 18509 7136 1 14 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.139 -4.520 18509 7137 1 14 . 1 1 122 122 LYS H H 122 8.478 8.478 8.029 0.449 18509 7138 1 14 . 1 1 123 123 ALA N N 123 120.866 120.866 123.195 -2.329 18509 7139 1 14 . 1 1 123 123 ALA C C 123 173.219 173.219 177.072 -3.853 18509 7140 1 14 . 1 1 123 123 ALA CA C 123 48.850 48.850 51.396 -2.546 18509 7141 1 14 . 1 1 123 123 ALA H H 123 7.796 7.796 8.472 -0.676 18509 7142 1 14 . 1 1 124 124 ASP N N 124 121.799 121.799 125.914 -4.115 18509 7143 1 14 . 1 1 124 124 ASP C C 124 174.458 174.458 174.534 -0.076 18509 7144 1 14 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.461 -4.053 18509 7145 1 14 . 1 1 124 124 ASP H H 124 10.165 10.165 8.232 1.933 18509 7146 1 14 . 1 1 125 125 ASP N N 125 129.369 129.369 124.305 5.064 18509 7147 1 14 . 1 1 125 125 ASP C C 125 175.231 175.231 175.775 -0.544 18509 7148 1 14 . 1 1 125 125 ASP CA C 125 50.939 50.939 52.167 -1.228 18509 7149 1 14 . 1 1 125 125 ASP H H 125 10.055 10.055 8.117 1.938 18509 7150 1 14 . 1 1 126 126 LEU N N 126 117.190 117.190 123.795 -6.605 18509 7151 1 14 . 1 1 126 126 LEU C C 126 173.964 173.964 177.933 -3.969 18509 7152 1 14 . 1 1 126 126 LEU H H 126 10.483 10.483 8.575 1.908 18509 7153 1 14 . 1 1 127 127 GLY N N 127 103.809 103.809 105.452 -1.643 18509 7154 1 14 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.199 -3.321 18509 7155 1 14 . 1 1 127 127 GLY H H 127 8.637 8.637 7.660 0.977 18509 7156 1 14 . 1 1 128 128 LYS N N 128 118.290 118.290 121.854 -3.564 18509 7157 1 14 . 1 1 128 128 LYS CA C 128 51.740 51.740 54.805 -3.065 18509 7158 1 14 . 1 1 128 128 LYS H H 128 7.158 7.158 8.416 -1.258 18509 7159 1 14 . 1 1 129 129 GLY N N 129 108.507 108.507 108.045 0.462 18509 7160 1 14 . 1 1 129 129 GLY C C 129 171.524 171.524 174.369 -2.845 18509 7161 1 14 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.139 -4.026 18509 7162 1 14 . 1 1 129 129 GLY H H 129 8.913 8.913 7.803 1.110 18509 7163 1 14 . 1 1 130 130 GLY N N 130 108.537 108.537 108.907 -0.370 18509 7164 1 14 . 1 1 130 130 GLY C C 130 169.994 169.994 173.493 -3.499 18509 7165 1 14 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.765 -2.346 18509 7166 1 14 . 1 1 130 130 GLY H H 130 8.723 8.723 8.435 0.288 18509 7167 1 14 . 1 1 131 131 ASN N N 131 111.951 111.951 119.597 -7.646 18509 7168 1 14 . 1 1 131 131 ASN C C 131 172.236 172.236 174.896 -2.660 18509 7169 1 14 . 1 1 131 131 ASN H H 131 7.152 7.152 7.815 -0.663 18509 7170 1 14 . 1 1 132 132 GLU N N 132 120.461 120.461 120.712 -0.251 18509 7171 1 14 . 1 1 132 132 GLU C C 132 171.084 171.084 178.390 -7.306 18509 7172 1 14 . 1 1 132 132 GLU H H 132 8.935 8.935 8.755 0.180 18509 7173 1 14 . 1 1 133 133 GLU N N 133 120.137 120.137 118.178 1.959 18509 7174 1 14 . 1 1 133 133 GLU C C 133 176.239 176.239 178.594 -2.355 18509 7175 1 14 . 1 1 133 133 GLU H H 133 8.775 8.775 8.620 0.155 18509 7176 1 14 . 1 1 134 134 SER N N 134 114.981 114.981 115.803 -0.822 18509 7177 1 14 . 1 1 134 134 SER CA C 134 59.046 59.046 61.341 -2.295 18509 7178 1 14 . 1 1 134 134 SER H H 134 8.117 8.117 8.351 -0.234 18509 7179 1 14 . 1 1 135 135 THR N N 135 102.263 102.263 116.754 -14.491 18509 7180 1 14 . 1 1 135 135 THR C C 135 172.804 172.804 175.401 -2.597 18509 7181 1 14 . 1 1 135 135 THR CA C 135 60.029 60.029 64.754 -4.725 18509 7182 1 14 . 1 1 135 135 THR H H 135 7.206 7.206 7.671 -0.465 18509 7183 1 14 . 1 1 136 136 LYS N N 136 122.108 122.108 120.644 1.464 18509 7184 1 14 . 1 1 136 136 LYS H H 136 7.884 7.884 7.883 0.001 18509 7185 1 14 . 1 1 137 137 THR N N 137 105.718 105.718 109.911 -4.193 18509 7186 1 14 . 1 1 137 137 THR H H 137 8.630 8.630 7.617 1.013 18509 7187 1 14 . 1 1 138 138 GLY N N 138 111.372 111.372 111.708 -0.336 18509 7188 1 14 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.121 -2.639 18509 7189 1 14 . 1 1 138 138 GLY H H 138 7.426 7.426 7.949 -0.523 18509 7190 1 14 . 1 1 139 139 ASN N N 139 107.496 107.496 120.638 -13.142 18509 7191 1 14 . 1 1 139 139 ASN H H 139 7.545 7.545 8.230 -0.685 18509 7192 1 14 . 1 1 140 140 ALA N N 140 114.542 114.542 125.165 -10.623 18509 7193 1 14 . 1 1 140 140 ALA C C 140 173.571 173.571 176.972 -3.401 18509 7194 1 14 . 1 1 140 140 ALA H H 140 6.368 6.368 8.355 -1.987 18509 7195 1 14 . 1 1 141 141 GLY N N 141 105.287 105.287 110.100 -4.813 18509 7196 1 14 . 1 1 141 141 GLY C C 141 173.542 173.542 174.616 -1.074 18509 7197 1 14 . 1 1 141 141 GLY H H 141 8.271 8.271 8.558 -0.287 18509 7198 1 14 . 1 1 142 142 SER N N 142 118.771 118.771 116.892 1.879 18509 7199 1 14 . 1 1 142 142 SER C C 142 170.188 170.188 175.512 -5.324 18509 7200 1 14 . 1 1 142 142 SER H H 142 9.196 9.196 8.158 1.038 18509 7201 1 14 . 1 1 143 143 ARG N N 143 120.189 120.189 115.800 4.389 18509 7202 1 14 . 1 1 143 143 ARG C C 143 171.596 171.596 175.831 -4.235 18509 7203 1 14 . 1 1 143 143 ARG H H 143 8.943 8.943 8.043 0.900 18509 7204 1 14 . 1 1 144 144 LEU N N 144 122.907 122.907 120.954 1.953 18509 7205 1 14 . 1 1 144 144 LEU C C 144 174.393 174.393 176.953 -2.560 18509 7206 1 14 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.105 -2.729 18509 7207 1 14 . 1 1 144 144 LEU H H 144 8.395 8.395 7.626 0.769 18509 7208 1 14 . 1 1 145 145 ALA N N 145 114.159 114.159 117.871 -3.712 18509 7209 1 14 . 1 1 145 145 ALA C C 145 171.752 171.752 174.612 -2.860 18509 7210 1 14 . 1 1 145 145 ALA CA C 145 48.129 48.129 52.347 -4.218 18509 7211 1 14 . 1 1 145 145 ALA H H 145 7.356 7.356 7.677 -0.321 18509 7212 1 14 . 1 1 146 146 CYS N N 146 110.738 110.738 121.452 -10.714 18509 7213 1 14 . 1 1 146 146 CYS C C 146 170.087 170.087 173.579 -3.492 18509 7214 1 14 . 1 1 146 146 CYS CA C 146 51.077 51.077 58.059 -6.982 18509 7215 1 14 . 1 1 146 146 CYS H H 146 9.008 9.008 8.347 0.661 18509 7216 1 14 . 1 1 147 147 GLY N N 147 106.461 106.461 112.759 -6.298 18509 7217 1 14 . 1 1 147 147 GLY C C 147 167.909 167.909 172.107 -4.198 18509 7218 1 14 . 1 1 147 147 GLY CA C 147 42.674 42.674 44.379 -1.705 18509 7219 1 14 . 1 1 147 147 GLY H H 147 8.018 8.018 7.970 0.048 18509 7220 1 14 . 1 1 148 148 VAL N N 148 124.054 124.054 121.208 2.846 18509 7221 1 14 . 1 1 148 148 VAL C C 148 172.084 172.084 175.279 -3.195 18509 7222 1 14 . 1 1 148 148 VAL CA C 148 59.635 59.635 63.743 -4.109 18509 7223 1 14 . 1 1 148 148 VAL H H 148 8.434 8.434 8.435 -0.001 18509 7224 1 14 . 1 1 149 149 ILE N N 149 126.918 126.918 128.772 -1.854 18509 7225 1 14 . 1 1 149 149 ILE C C 149 171.804 171.804 174.195 -2.391 18509 7226 1 14 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.079 0.105 18509 7227 1 14 . 1 1 149 149 ILE H H 149 8.613 8.613 8.728 -0.115 18509 7228 1 14 . 1 1 150 150 GLY N N 150 116.493 116.493 116.065 0.428 18509 7229 1 14 . 1 1 150 150 GLY C C 150 170.188 170.188 172.192 -2.004 18509 7230 1 14 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.475 -4.355 18509 7231 1 14 . 1 1 150 150 GLY H H 150 9.283 9.283 7.546 1.737 18509 7232 1 14 . 1 1 151 151 ILE N N 151 120.189 120.189 120.270 -0.081 18509 7233 1 14 . 1 1 151 151 ILE C C 151 172.231 172.231 174.878 -2.647 18509 7234 1 14 . 1 1 151 151 ILE CA C 151 60.372 60.372 62.742 -2.370 18509 7235 1 14 . 1 1 151 151 ILE H H 151 8.943 8.943 8.292 0.651 18509 7236 1 14 . 1 1 152 152 ALA N N 152 129.719 129.719 130.173 -0.454 18509 7237 1 14 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.536 -4.764 18509 7238 1 14 . 1 1 152 152 ALA H H 152 8.170 8.170 8.056 0.114 18509 7239 1 15 . 1 1 2 2 THR C C 2 170.139 170.139 174.840 -4.701 18509 7240 1 15 . 1 1 3 3 LYS N N 3 123.998 123.998 118.613 5.385 18509 7241 1 15 . 1 1 3 3 LYS C C 3 171.607 171.607 174.380 -2.773 18509 7242 1 15 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.924 -3.746 18509 7243 1 15 . 1 1 3 3 LYS H H 3 8.666 8.666 7.437 1.229 18509 7244 1 15 . 1 1 4 4 ALA N N 4 123.295 123.295 121.429 1.866 18509 7245 1 15 . 1 1 4 4 ALA C C 4 172.145 172.145 175.060 -2.915 18509 7246 1 15 . 1 1 4 4 ALA CA C 4 47.504 47.504 51.739 -4.234 18509 7247 1 15 . 1 1 4 4 ALA H H 4 9.116 9.116 8.382 0.734 18509 7248 1 15 . 1 1 5 5 VAL N N 5 121.466 121.466 120.733 0.733 18509 7249 1 15 . 1 1 5 5 VAL C C 5 167.836 167.836 174.602 -6.766 18509 7250 1 15 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.467 -4.592 18509 7251 1 15 . 1 1 5 5 VAL H H 5 9.545 9.545 9.020 0.525 18509 7252 1 15 . 1 1 6 6 ALA N N 6 125.984 125.984 128.122 -2.138 18509 7253 1 15 . 1 1 6 6 ALA C C 6 171.607 171.607 176.139 -4.532 18509 7254 1 15 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.508 -3.037 18509 7255 1 15 . 1 1 6 6 ALA H H 6 9.177 9.177 8.279 0.898 18509 7256 1 15 . 1 1 7 7 VAL N N 7 123.600 123.600 124.477 -0.877 18509 7257 1 15 . 1 1 7 7 VAL C C 7 172.244 172.244 174.471 -2.227 18509 7258 1 15 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.870 -3.394 18509 7259 1 15 . 1 1 7 7 VAL H H 7 9.116 9.116 7.938 1.178 18509 7260 1 15 . 1 1 8 8 LEU N N 8 126.455 126.455 123.974 2.481 18509 7261 1 15 . 1 1 8 8 LEU C C 8 172.557 172.557 175.731 -3.174 18509 7262 1 15 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.437 -2.385 18509 7263 1 15 . 1 1 8 8 LEU H H 8 8.916 8.916 8.134 0.782 18509 7264 1 15 . 1 1 9 9 LYS N N 9 120.820 120.820 120.655 0.165 18509 7265 1 15 . 1 1 9 9 LYS C C 9 172.509 172.509 175.454 -2.945 18509 7266 1 15 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.316 -3.418 18509 7267 1 15 . 1 1 9 9 LYS H H 9 8.315 8.315 8.684 -0.369 18509 7268 1 15 . 1 1 10 10 GLY N N 10 111.249 111.249 110.236 1.013 18509 7269 1 15 . 1 1 10 10 GLY C C 10 169.847 169.847 173.764 -3.917 18509 7270 1 15 . 1 1 10 10 GLY CA C 10 42.275 42.275 44.956 -2.682 18509 7271 1 15 . 1 1 10 10 GLY H H 10 8.968 8.968 8.286 0.682 18509 7272 1 15 . 1 1 11 11 ASP N N 11 120.904 120.904 120.680 0.224 18509 7273 1 15 . 1 1 11 11 ASP C C 11 173.132 173.132 177.199 -4.067 18509 7274 1 15 . 1 1 11 11 ASP CA C 11 51.317 51.317 56.334 -5.017 18509 7275 1 15 . 1 1 11 11 ASP H H 11 8.745 8.745 8.611 0.134 18509 7276 1 15 . 1 1 12 12 GLY N N 12 109.862 109.862 108.984 0.878 18509 7277 1 15 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.423 -2.223 18509 7278 1 15 . 1 1 12 12 GLY H H 12 7.985 7.985 8.424 -0.439 18509 7279 1 15 . 1 1 13 13 PRO C C 13 173.640 173.640 175.781 -2.141 18509 7280 1 15 . 1 1 14 14 VAL N N 14 120.414 120.414 117.059 3.355 18509 7281 1 15 . 1 1 14 14 VAL C C 14 172.804 172.804 174.523 -1.719 18509 7282 1 15 . 1 1 14 14 VAL CA C 14 59.884 59.884 58.950 0.934 18509 7283 1 15 . 1 1 14 14 VAL H H 14 7.476 7.476 8.057 -0.581 18509 7284 1 15 . 1 1 15 15 GLN N N 15 122.664 122.664 123.328 -0.664 18509 7285 1 15 . 1 1 15 15 GLN C C 15 171.168 171.168 173.849 -2.681 18509 7286 1 15 . 1 1 15 15 GLN CA C 15 50.679 50.679 55.572 -4.893 18509 7287 1 15 . 1 1 15 15 GLN H H 15 7.938 7.938 8.306 -0.368 18509 7288 1 15 . 1 1 16 16 GLY N N 16 107.018 107.018 111.173 -4.155 18509 7289 1 15 . 1 1 16 16 GLY C C 16 167.726 167.726 172.975 -5.249 18509 7290 1 15 . 1 1 16 16 GLY CA C 16 43.625 43.625 44.671 -1.046 18509 7291 1 15 . 1 1 16 16 GLY H H 16 8.288 8.288 8.412 -0.124 18509 7292 1 15 . 1 1 17 17 ILE N N 17 120.248 120.248 118.367 1.881 18509 7293 1 15 . 1 1 17 17 ILE C C 17 171.194 171.194 174.206 -3.012 18509 7294 1 15 . 1 1 17 17 ILE CA C 17 58.497 58.497 60.115 -1.618 18509 7295 1 15 . 1 1 17 17 ILE H H 17 7.948 7.948 8.176 -0.228 18509 7296 1 15 . 1 1 18 18 ILE N N 18 125.851 125.851 128.064 -2.213 18509 7297 1 15 . 1 1 18 18 ILE C C 18 168.889 168.889 175.151 -6.262 18509 7298 1 15 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.298 -5.867 18509 7299 1 15 . 1 1 18 18 ILE H H 18 8.725 8.725 8.554 0.171 18509 7300 1 15 . 1 1 19 19 ASN N N 19 123.256 123.256 124.081 -0.825 18509 7301 1 15 . 1 1 19 19 ASN C C 19 168.903 168.903 173.573 -4.670 18509 7302 1 15 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.008 -1.919 18509 7303 1 15 . 1 1 19 19 ASN H H 19 8.727 8.727 8.810 -0.083 18509 7304 1 15 . 1 1 20 20 PHE N N 20 113.849 113.849 122.879 -9.030 18509 7305 1 15 . 1 1 20 20 PHE C C 20 173.219 173.219 174.043 -0.824 18509 7306 1 15 . 1 1 20 20 PHE CA C 20 52.058 52.058 56.614 -4.556 18509 7307 1 15 . 1 1 20 20 PHE H H 20 8.399 8.399 8.909 -0.510 18509 7308 1 15 . 1 1 21 21 GLU N N 21 121.454 121.454 126.596 -5.142 18509 7309 1 15 . 1 1 21 21 GLU C C 21 170.280 170.280 174.005 -3.725 18509 7310 1 15 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.556 -1.512 18509 7311 1 15 . 1 1 21 21 GLU H H 21 9.526 9.526 7.837 1.689 18509 7312 1 15 . 1 1 22 22 GLN N N 22 130.340 130.340 125.414 4.926 18509 7313 1 15 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.996 -3.816 18509 7314 1 15 . 1 1 22 22 GLN H H 22 9.305 9.305 7.841 1.464 18509 7315 1 15 . 1 1 23 23 LYS N N 23 128.657 128.657 126.801 1.856 18509 7316 1 15 . 1 1 23 23 LYS CA C 23 57.241 57.241 57.845 -0.604 18509 7317 1 15 . 1 1 23 23 LYS H H 23 9.088 9.088 8.513 0.575 18509 7318 1 15 . 1 1 24 24 GLU CA C 24 51.392 51.392 57.669 -6.277 18509 7319 1 15 . 1 1 25 25 SER CA C 25 58.078 58.078 60.533 -2.455 18509 7320 1 15 . 1 1 27 27 GLY N N 27 108.125 108.125 108.497 -0.372 18509 7321 1 15 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.793 -1.868 18509 7322 1 15 . 1 1 27 27 GLY H H 27 8.032 8.032 7.728 0.304 18509 7323 1 15 . 1 1 28 28 PRO C C 28 173.128 173.128 176.150 -3.022 18509 7324 1 15 . 1 1 29 29 VAL N N 29 121.267 121.267 124.531 -3.264 18509 7325 1 15 . 1 1 29 29 VAL C C 29 172.198 172.198 175.808 -3.610 18509 7326 1 15 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.722 -4.002 18509 7327 1 15 . 1 1 29 29 VAL H H 29 9.089 9.089 8.176 0.913 18509 7328 1 15 . 1 1 30 30 LYS N N 30 127.589 127.589 129.747 -2.158 18509 7329 1 15 . 1 1 30 30 LYS C C 30 172.098 172.098 174.768 -2.670 18509 7330 1 15 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.633 -2.991 18509 7331 1 15 . 1 1 30 30 LYS H H 30 9.200 9.200 8.328 0.872 18509 7332 1 15 . 1 1 31 31 VAL N N 31 126.037 126.037 123.743 2.294 18509 7333 1 15 . 1 1 31 31 VAL C C 31 172.244 172.244 173.940 -1.696 18509 7334 1 15 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.662 -2.523 18509 7335 1 15 . 1 1 31 31 VAL H H 31 9.282 9.282 7.943 1.339 18509 7336 1 15 . 1 1 32 32 TRP N N 32 125.414 125.414 127.197 -1.783 18509 7337 1 15 . 1 1 32 32 TRP C C 32 170.156 170.156 173.641 -3.485 18509 7338 1 15 . 1 1 32 32 TRP CA C 32 53.137 53.137 57.351 -4.214 18509 7339 1 15 . 1 1 32 32 TRP H H 32 8.983 8.983 8.323 0.660 18509 7340 1 15 . 1 1 33 33 GLY N N 33 107.848 107.848 112.115 -4.267 18509 7341 1 15 . 1 1 33 33 GLY C C 33 168.400 168.400 172.423 -4.023 18509 7342 1 15 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.775 -3.208 18509 7343 1 15 . 1 1 33 33 GLY H H 33 8.360 8.360 7.768 0.592 18509 7344 1 15 . 1 1 34 34 SER N N 34 114.377 114.377 117.832 -3.455 18509 7345 1 15 . 1 1 34 34 SER C C 34 169.618 169.618 173.684 -4.066 18509 7346 1 15 . 1 1 34 34 SER CA C 34 53.875 53.875 56.624 -2.749 18509 7347 1 15 . 1 1 34 34 SER H H 34 7.838 7.838 7.932 -0.094 18509 7348 1 15 . 1 1 35 35 ILE N N 35 123.149 123.149 123.216 -0.067 18509 7349 1 15 . 1 1 35 35 ILE C C 35 169.713 169.713 174.755 -5.042 18509 7350 1 15 . 1 1 35 35 ILE CA C 35 56.769 56.769 60.101 -3.332 18509 7351 1 15 . 1 1 35 35 ILE H H 35 8.496 8.496 8.326 0.170 18509 7352 1 15 . 1 1 36 36 LYS N N 36 123.803 123.803 125.787 -1.984 18509 7353 1 15 . 1 1 36 36 LYS C C 36 172.260 172.260 175.136 -2.876 18509 7354 1 15 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.979 -3.829 18509 7355 1 15 . 1 1 36 36 LYS H H 36 9.091 9.091 8.888 0.203 18509 7356 1 15 . 1 1 37 37 GLY N N 37 105.495 105.495 109.701 -4.206 18509 7357 1 15 . 1 1 37 37 GLY C C 37 171.641 171.641 172.561 -0.920 18509 7358 1 15 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.633 -1.272 18509 7359 1 15 . 1 1 37 37 GLY H H 37 8.237 8.237 8.100 0.137 18509 7360 1 15 . 1 1 38 38 LEU N N 38 120.966 120.966 115.455 5.511 18509 7361 1 15 . 1 1 38 38 LEU C C 38 174.112 174.112 177.956 -3.844 18509 7362 1 15 . 1 1 38 38 LEU CA C 38 50.471 50.471 53.431 -2.960 18509 7363 1 15 . 1 1 38 38 LEU H H 38 8.156 8.156 8.280 -0.124 18509 7364 1 15 . 1 1 39 39 THR N N 39 110.363 110.363 115.785 -5.422 18509 7365 1 15 . 1 1 39 39 THR C C 39 173.102 173.102 174.405 -1.303 18509 7366 1 15 . 1 1 39 39 THR CA C 39 58.194 58.194 63.531 -5.337 18509 7367 1 15 . 1 1 39 39 THR H H 39 8.660 8.660 8.397 0.263 18509 7368 1 15 . 1 1 40 40 GLU N N 40 125.818 125.818 129.833 -4.015 18509 7369 1 15 . 1 1 40 40 GLU C C 40 173.134 173.134 174.123 -0.989 18509 7370 1 15 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.651 -2.296 18509 7371 1 15 . 1 1 40 40 GLU H H 40 8.804 8.804 8.866 -0.062 18509 7372 1 15 . 1 1 41 41 GLY N N 41 113.875 113.875 113.658 0.217 18509 7373 1 15 . 1 1 41 41 GLY C C 41 170.046 170.046 172.832 -2.786 18509 7374 1 15 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.560 -4.506 18509 7375 1 15 . 1 1 41 41 GLY H H 41 8.763 8.763 8.194 0.569 18509 7376 1 15 . 1 1 42 42 LEU N N 42 120.137 120.137 122.525 -2.388 18509 7377 1 15 . 1 1 42 42 LEU C C 42 174.218 174.218 176.305 -2.087 18509 7378 1 15 . 1 1 42 42 LEU CA C 42 52.155 52.155 53.007 -0.852 18509 7379 1 15 . 1 1 42 42 LEU H H 42 8.313 8.313 7.830 0.483 18509 7380 1 15 . 1 1 43 43 HIS N N 43 114.385 114.385 123.381 -8.996 18509 7381 1 15 . 1 1 43 43 HIS C C 43 171.504 171.504 175.398 -3.894 18509 7382 1 15 . 1 1 43 43 HIS CA C 43 50.985 50.985 56.942 -5.957 18509 7383 1 15 . 1 1 43 43 HIS H H 43 8.712 8.712 8.370 0.342 18509 7384 1 15 . 1 1 44 44 GLY N N 44 108.872 108.872 112.645 -3.773 18509 7385 1 15 . 1 1 44 44 GLY C C 44 168.656 168.656 171.705 -3.049 18509 7386 1 15 . 1 1 44 44 GLY CA C 44 44.195 44.195 44.796 -0.601 18509 7387 1 15 . 1 1 44 44 GLY H H 44 8.875 8.875 8.800 0.075 18509 7388 1 15 . 1 1 45 45 PHE N N 45 126.439 126.439 122.004 4.435 18509 7389 1 15 . 1 1 45 45 PHE CA C 45 53.098 53.098 57.434 -4.337 18509 7390 1 15 . 1 1 45 45 PHE H H 45 8.111 8.111 7.642 0.469 18509 7391 1 15 . 1 1 46 46 HIS N N 46 115.353 115.353 121.554 -6.201 18509 7392 1 15 . 1 1 46 46 HIS C C 46 172.415 172.415 173.755 -1.340 18509 7393 1 15 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.937 -5.731 18509 7394 1 15 . 1 1 46 46 HIS H H 46 8.107 8.107 8.692 -0.585 18509 7395 1 15 . 1 1 47 47 VAL N N 47 120.548 120.548 118.467 2.081 18509 7396 1 15 . 1 1 47 47 VAL C C 47 173.900 173.900 173.520 0.380 18509 7397 1 15 . 1 1 47 47 VAL CA C 47 58.792 58.792 59.967 -1.175 18509 7398 1 15 . 1 1 47 47 VAL H H 47 9.366 9.366 7.488 1.878 18509 7399 1 15 . 1 1 48 48 HIS N N 48 129.236 129.236 118.129 11.107 18509 7400 1 15 . 1 1 48 48 HIS C C 48 171.084 171.084 174.598 -3.514 18509 7401 1 15 . 1 1 48 48 HIS CA C 48 52.756 52.756 55.864 -3.108 18509 7402 1 15 . 1 1 48 48 HIS H H 48 10.210 10.210 8.556 1.654 18509 7403 1 15 . 1 1 49 49 GLU N N 49 118.119 118.119 125.923 -7.804 18509 7404 1 15 . 1 1 49 49 GLU C C 49 171.635 171.635 174.704 -3.069 18509 7405 1 15 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.465 2.294 18509 7406 1 15 . 1 1 49 49 GLU H H 49 8.492 8.492 9.122 -0.630 18509 7407 1 15 . 1 1 50 50 PHE N N 50 110.329 110.329 118.232 -7.903 18509 7408 1 15 . 1 1 50 50 PHE C C 50 175.252 175.252 172.875 2.377 18509 7409 1 15 . 1 1 50 50 PHE CA C 50 52.900 52.900 57.727 -4.827 18509 7410 1 15 . 1 1 50 50 PHE H H 50 8.580 8.580 7.775 0.805 18509 7411 1 15 . 1 1 51 51 GLY N N 51 119.251 119.251 109.193 10.058 18509 7412 1 15 . 1 1 51 51 GLY C C 51 168.248 168.248 171.933 -3.685 18509 7413 1 15 . 1 1 51 51 GLY H H 51 10.208 10.208 7.849 2.359 18509 7414 1 15 . 1 1 52 52 ASP N N 52 114.958 114.958 118.079 -3.121 18509 7415 1 15 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.770 -5.880 18509 7416 1 15 . 1 1 52 52 ASP H H 52 5.834 5.834 8.000 -2.166 18509 7417 1 15 . 1 1 53 53 ASN N N 53 128.224 128.224 119.621 8.603 18509 7418 1 15 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.787 -4.554 18509 7419 1 15 . 1 1 53 53 ASN H H 53 9.360 9.360 8.384 0.976 18509 7420 1 15 . 1 1 54 54 THR C C 54 168.656 168.656 175.337 -6.681 18509 7421 1 15 . 1 1 55 55 ALA N N 55 126.661 126.661 122.049 4.612 18509 7422 1 15 . 1 1 55 55 ALA C C 55 174.185 174.185 176.791 -2.606 18509 7423 1 15 . 1 1 55 55 ALA CA C 55 46.155 46.155 52.062 -5.907 18509 7424 1 15 . 1 1 55 55 ALA H H 55 8.390 8.390 8.429 -0.039 18509 7425 1 15 . 1 1 56 56 GLY N N 56 107.903 107.903 106.775 1.128 18509 7426 1 15 . 1 1 56 56 GLY C C 56 171.578 171.578 173.047 -1.469 18509 7427 1 15 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.068 -2.488 18509 7428 1 15 . 1 1 56 56 GLY H H 56 7.282 7.282 7.550 -0.268 18509 7429 1 15 . 1 1 57 57 CYS N N 57 117.952 117.952 123.499 -5.547 18509 7430 1 15 . 1 1 57 57 CYS C C 57 175.209 175.209 175.178 0.031 18509 7431 1 15 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.512 -7.424 18509 7432 1 15 . 1 1 57 57 CYS H H 57 8.900 8.900 8.364 0.536 18509 7433 1 15 . 1 1 58 58 THR N N 58 119.852 119.852 119.603 0.249 18509 7434 1 15 . 1 1 58 58 THR CA C 58 58.239 58.239 65.018 -6.779 18509 7435 1 15 . 1 1 58 58 THR H H 58 8.505 8.505 8.012 0.493 18509 7436 1 15 . 1 1 59 59 SER C C 59 170.763 170.763 175.292 -4.529 18509 7437 1 15 . 1 1 59 59 SER CA C 59 55.609 55.609 61.425 -5.816 18509 7438 1 15 . 1 1 60 60 ALA N N 60 119.753 119.753 120.927 -1.174 18509 7439 1 15 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.028 -2.088 18509 7440 1 15 . 1 1 60 60 ALA H H 60 6.898 6.898 8.136 -1.238 18509 7441 1 15 . 1 1 61 61 GLY N N 61 101.351 101.351 109.153 -7.802 18509 7442 1 15 . 1 1 61 61 GLY CA C 61 42.805 42.805 47.294 -4.489 18509 7443 1 15 . 1 1 61 61 GLY H H 61 7.730 7.730 7.897 -0.167 18509 7444 1 15 . 1 1 62 62 PRO C C 62 172.276 172.276 176.093 -3.817 18509 7445 1 15 . 1 1 63 63 HIS N N 63 115.023 115.023 112.719 2.304 18509 7446 1 15 . 1 1 63 63 HIS CA C 63 52.119 52.119 56.152 -4.033 18509 7447 1 15 . 1 1 63 63 HIS H H 63 7.474 7.474 7.954 -0.480 18509 7448 1 15 . 1 1 64 64 PHE C C 64 171.731 171.731 174.211 -2.480 18509 7449 1 15 . 1 1 65 65 ASN N N 65 126.978 126.978 124.487 2.491 18509 7450 1 15 . 1 1 65 65 ASN CA C 65 47.753 47.753 50.074 -2.321 18509 7451 1 15 . 1 1 65 65 ASN H H 65 9.426 9.426 7.583 1.843 18509 7452 1 15 . 1 1 67 67 LEU N N 67 117.937 117.937 116.261 1.676 18509 7453 1 15 . 1 1 67 67 LEU C C 67 172.580 172.580 177.240 -4.660 18509 7454 1 15 . 1 1 67 67 LEU CA C 67 50.911 50.911 55.826 -4.915 18509 7455 1 15 . 1 1 67 67 LEU H H 67 7.720 7.720 8.063 -0.343 18509 7456 1 15 . 1 1 68 68 SER N N 68 110.842 110.842 115.008 -4.166 18509 7457 1 15 . 1 1 68 68 SER CA C 68 55.953 55.953 58.798 -2.845 18509 7458 1 15 . 1 1 68 68 SER H H 68 7.428 7.428 8.203 -0.775 18509 7459 1 15 . 1 1 69 69 ARG N N 69 120.782 120.782 121.941 -1.159 18509 7460 1 15 . 1 1 69 69 ARG C C 69 173.381 173.381 175.922 -2.541 18509 7461 1 15 . 1 1 69 69 ARG CA C 69 50.543 50.543 57.081 -6.538 18509 7462 1 15 . 1 1 69 69 ARG H H 69 8.508 8.508 7.843 0.665 18509 7463 1 15 . 1 1 70 70 LYS N N 70 118.055 118.055 118.374 -0.319 18509 7464 1 15 . 1 1 70 70 LYS C C 70 169.994 169.994 176.733 -6.739 18509 7465 1 15 . 1 1 70 70 LYS CA C 70 52.596 52.596 56.000 -3.404 18509 7466 1 15 . 1 1 70 70 LYS H H 70 8.745 8.745 8.384 0.361 18509 7467 1 15 . 1 1 71 71 HIS N N 71 111.871 111.871 117.891 -6.020 18509 7468 1 15 . 1 1 71 71 HIS C C 71 171.534 171.534 173.417 -1.883 18509 7469 1 15 . 1 1 71 71 HIS CA C 71 52.549 52.549 57.768 -5.219 18509 7470 1 15 . 1 1 71 71 HIS H H 71 7.152 7.152 8.698 -1.546 18509 7471 1 15 . 1 1 72 72 GLY N N 72 112.910 112.910 105.377 7.533 18509 7472 1 15 . 1 1 72 72 GLY C C 72 168.634 168.634 172.719 -4.085 18509 7473 1 15 . 1 1 72 72 GLY CA C 72 41.274 41.274 45.056 -3.782 18509 7474 1 15 . 1 1 72 72 GLY H H 72 7.209 7.209 7.630 -0.421 18509 7475 1 15 . 1 1 73 73 GLY N N 73 105.207 105.207 108.469 -3.262 18509 7476 1 15 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.669 -2.447 18509 7477 1 15 . 1 1 73 73 GLY H H 73 8.789 8.789 7.778 1.011 18509 7478 1 15 . 1 1 74 74 PRO C C 74 175.753 175.753 176.644 -0.891 18509 7479 1 15 . 1 1 75 75 LYS N N 75 114.868 114.868 112.825 2.043 18509 7480 1 15 . 1 1 75 75 LYS C C 75 173.640 173.640 175.961 -2.321 18509 7481 1 15 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.126 -5.023 18509 7482 1 15 . 1 1 75 75 LYS H H 75 8.651 8.651 7.740 0.911 18509 7483 1 15 . 1 1 76 76 ASP N N 76 120.414 120.414 118.132 2.282 18509 7484 1 15 . 1 1 76 76 ASP C C 76 172.557 172.557 175.431 -2.874 18509 7485 1 15 . 1 1 76 76 ASP CA C 76 51.309 51.309 56.178 -4.869 18509 7486 1 15 . 1 1 76 76 ASP H H 76 7.461 7.461 8.250 -0.789 18509 7487 1 15 . 1 1 77 77 GLU N N 77 120.820 120.820 120.636 0.184 18509 7488 1 15 . 1 1 77 77 GLU C C 77 174.101 174.101 176.243 -2.142 18509 7489 1 15 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.041 -1.528 18509 7490 1 15 . 1 1 77 77 GLU H H 77 8.315 8.315 8.536 -0.221 18509 7491 1 15 . 1 1 78 78 GLU N N 78 119.251 119.251 115.496 3.755 18509 7492 1 15 . 1 1 78 78 GLU C C 78 168.285 168.285 177.361 -9.076 18509 7493 1 15 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.161 -5.083 18509 7494 1 15 . 1 1 78 78 GLU H H 78 8.109 8.109 8.507 -0.398 18509 7495 1 15 . 1 1 79 79 ARG N N 79 118.991 118.991 121.097 -2.106 18509 7496 1 15 . 1 1 79 79 ARG C C 79 172.123 172.123 175.602 -3.479 18509 7497 1 15 . 1 1 79 79 ARG CA C 79 51.074 51.074 54.163 -3.089 18509 7498 1 15 . 1 1 79 79 ARG H H 79 6.999 6.999 7.974 -0.975 18509 7499 1 15 . 1 1 80 80 HIS N N 80 118.000 118.000 119.457 -1.457 18509 7500 1 15 . 1 1 80 80 HIS CA C 80 49.953 49.953 55.759 -5.806 18509 7501 1 15 . 1 1 80 80 HIS H H 80 8.355 8.355 7.932 0.423 18509 7502 1 15 . 1 1 81 81 VAL C C 81 173.460 173.460 174.682 -1.222 18509 7503 1 15 . 1 1 82 82 GLY N N 82 97.322 97.322 106.269 -8.947 18509 7504 1 15 . 1 1 82 82 GLY C C 82 170.370 170.370 171.815 -1.445 18509 7505 1 15 . 1 1 82 82 GLY CA C 82 42.688 42.688 44.474 -1.786 18509 7506 1 15 . 1 1 82 82 GLY H H 82 8.487 8.487 7.485 1.002 18509 7507 1 15 . 1 1 83 83 ASP N N 83 120.890 120.890 119.091 1.799 18509 7508 1 15 . 1 1 83 83 ASP C C 83 168.737 168.737 173.923 -5.186 18509 7509 1 15 . 1 1 83 83 ASP CA C 83 52.918 52.918 54.381 -1.463 18509 7510 1 15 . 1 1 83 83 ASP H H 83 7.127 7.127 7.905 -0.778 18509 7511 1 15 . 1 1 84 84 LEU N N 84 120.154 120.154 125.137 -4.983 18509 7512 1 15 . 1 1 84 84 LEU C C 84 173.212 173.212 175.158 -1.946 18509 7513 1 15 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.006 -3.573 18509 7514 1 15 . 1 1 84 84 LEU H H 84 7.128 7.128 7.963 -0.836 18509 7515 1 15 . 1 1 85 85 GLY N N 85 106.867 106.867 107.054 -0.187 18509 7516 1 15 . 1 1 85 85 GLY C C 85 167.654 167.654 173.173 -5.519 18509 7517 1 15 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.082 -1.071 18509 7518 1 15 . 1 1 85 85 GLY H H 85 8.260 8.260 8.282 -0.022 18509 7519 1 15 . 1 1 86 86 ASN N N 86 117.454 117.454 118.064 -0.610 18509 7520 1 15 . 1 1 86 86 ASN C C 86 173.942 173.942 174.033 -0.091 18509 7521 1 15 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.843 -3.577 18509 7522 1 15 . 1 1 86 86 ASN H H 86 8.041 8.041 8.597 -0.556 18509 7523 1 15 . 1 1 87 87 VAL N N 87 113.370 113.370 125.749 -12.379 18509 7524 1 15 . 1 1 87 87 VAL C C 87 171.526 171.526 173.798 -2.272 18509 7525 1 15 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.836 -5.128 18509 7526 1 15 . 1 1 87 87 VAL H H 87 8.960 8.960 7.894 1.066 18509 7527 1 15 . 1 1 88 88 THR N N 88 117.939 117.939 121.191 -3.252 18509 7528 1 15 . 1 1 88 88 THR C C 88 170.367 170.367 172.546 -2.179 18509 7529 1 15 . 1 1 88 88 THR CA C 88 58.694 58.694 60.767 -2.072 18509 7530 1 15 . 1 1 88 88 THR H H 88 8.681 8.681 7.943 0.738 18509 7531 1 15 . 1 1 89 89 ALA N N 89 128.674 128.674 128.942 -0.268 18509 7532 1 15 . 1 1 89 89 ALA C C 89 174.480 174.480 175.876 -1.396 18509 7533 1 15 . 1 1 89 89 ALA CA C 89 46.369 46.369 49.417 -3.048 18509 7534 1 15 . 1 1 89 89 ALA H H 89 9.377 9.377 8.305 1.072 18509 7535 1 15 . 1 1 90 90 ASP N N 90 124.235 124.235 126.387 -2.152 18509 7536 1 15 . 1 1 90 90 ASP C C 90 173.825 173.825 177.064 -3.239 18509 7537 1 15 . 1 1 90 90 ASP CA C 90 49.347 49.347 56.870 -7.523 18509 7538 1 15 . 1 1 90 90 ASP H H 90 8.455 8.455 8.736 -0.281 18509 7539 1 15 . 1 1 91 91 LYS N N 91 114.942 114.942 119.638 -4.696 18509 7540 1 15 . 1 1 91 91 LYS C C 91 174.101 174.101 175.479 -1.378 18509 7541 1 15 . 1 1 91 91 LYS CA C 91 55.279 55.279 55.586 -0.307 18509 7542 1 15 . 1 1 91 91 LYS H H 91 8.231 8.231 8.306 -0.075 18509 7543 1 15 . 1 1 92 92 ASP N N 92 119.251 119.251 117.416 1.835 18509 7544 1 15 . 1 1 92 92 ASP C C 92 173.020 173.020 175.843 -2.823 18509 7545 1 15 . 1 1 92 92 ASP CA C 92 51.127 51.127 54.535 -3.408 18509 7546 1 15 . 1 1 92 92 ASP H H 92 8.109 8.109 7.474 0.635 18509 7547 1 15 . 1 1 93 93 GLY N N 93 110.868 110.868 110.352 0.516 18509 7548 1 15 . 1 1 93 93 GLY C C 93 169.706 169.706 173.079 -3.373 18509 7549 1 15 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.032 -1.269 18509 7550 1 15 . 1 1 93 93 GLY H H 93 8.405 8.405 8.397 0.008 18509 7551 1 15 . 1 1 94 94 VAL N N 94 118.755 118.755 118.726 0.029 18509 7552 1 15 . 1 1 94 94 VAL C C 94 173.510 173.510 173.773 -0.263 18509 7553 1 15 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.176 -2.991 18509 7554 1 15 . 1 1 94 94 VAL H H 94 7.814 7.814 7.461 0.353 18509 7555 1 15 . 1 1 95 95 ALA N N 95 131.313 131.313 130.426 0.887 18509 7556 1 15 . 1 1 95 95 ALA C C 95 171.635 171.635 175.912 -4.277 18509 7557 1 15 . 1 1 95 95 ALA CA C 95 46.914 46.914 49.778 -2.864 18509 7558 1 15 . 1 1 95 95 ALA H H 95 9.763 9.763 8.254 1.509 18509 7559 1 15 . 1 1 96 96 ASP N N 96 125.170 125.170 124.886 0.284 18509 7560 1 15 . 1 1 96 96 ASP C C 96 172.336 172.336 175.552 -3.216 18509 7561 1 15 . 1 1 96 96 ASP H H 96 8.515 8.515 8.520 -0.005 18509 7562 1 15 . 1 1 97 97 VAL N N 97 125.879 125.879 126.956 -1.077 18509 7563 1 15 . 1 1 97 97 VAL C C 97 173.488 173.488 175.095 -1.607 18509 7564 1 15 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.095 -2.852 18509 7565 1 15 . 1 1 97 97 VAL H H 97 8.703 8.703 7.964 0.739 18509 7566 1 15 . 1 1 98 98 SER N N 98 123.017 123.017 127.196 -4.179 18509 7567 1 15 . 1 1 98 98 SER C C 98 169.715 169.715 172.931 -3.216 18509 7568 1 15 . 1 1 98 98 SER CA C 98 55.068 55.068 57.054 -1.986 18509 7569 1 15 . 1 1 98 98 SER H H 98 8.784 8.784 8.896 -0.112 18509 7570 1 15 . 1 1 99 99 ILE N N 99 125.807 125.807 121.634 4.173 18509 7571 1 15 . 1 1 99 99 ILE C C 99 171.321 171.321 175.142 -3.821 18509 7572 1 15 . 1 1 99 99 ILE CA C 99 57.155 57.155 60.252 -3.097 18509 7573 1 15 . 1 1 99 99 ILE H H 99 9.411 9.411 8.528 0.883 18509 7574 1 15 . 1 1 100 100 GLU N N 100 124.068 124.068 123.563 0.505 18509 7575 1 15 . 1 1 100 100 GLU C C 100 172.098 172.098 175.333 -3.235 18509 7576 1 15 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.929 -2.639 18509 7577 1 15 . 1 1 100 100 GLU H H 100 8.652 8.652 8.600 0.052 18509 7578 1 15 . 1 1 101 101 ASP N N 101 126.109 126.109 122.198 3.911 18509 7579 1 15 . 1 1 101 101 ASP C C 101 171.144 171.144 175.437 -4.293 18509 7580 1 15 . 1 1 101 101 ASP CA C 101 51.419 51.419 54.555 -3.136 18509 7581 1 15 . 1 1 101 101 ASP H H 101 9.317 9.317 8.555 0.762 18509 7582 1 15 . 1 1 102 102 SER N N 102 118.470 118.470 118.725 -0.255 18509 7583 1 15 . 1 1 102 102 SER C C 102 171.596 171.596 175.015 -3.419 18509 7584 1 15 . 1 1 102 102 SER CA C 102 55.245 55.245 57.050 -1.805 18509 7585 1 15 . 1 1 102 102 SER H H 102 8.933 8.933 8.044 0.889 18509 7586 1 15 . 1 1 103 103 VAL N N 103 123.179 123.179 116.413 6.766 18509 7587 1 15 . 1 1 103 103 VAL CA C 103 61.450 61.450 63.331 -1.881 18509 7588 1 15 . 1 1 103 103 VAL H H 103 8.148 8.148 8.387 -0.239 18509 7589 1 15 . 1 1 104 104 ILE C C 104 169.576 169.576 174.574 -4.998 18509 7590 1 15 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.066 0.128 18509 7591 1 15 . 1 1 105 105 SER N N 105 107.618 107.618 119.078 -11.460 18509 7592 1 15 . 1 1 105 105 SER C C 105 170.046 170.046 174.105 -4.059 18509 7593 1 15 . 1 1 105 105 SER CA C 105 52.550 52.550 58.064 -5.514 18509 7594 1 15 . 1 1 105 105 SER H H 105 6.988 6.988 8.193 -1.205 18509 7595 1 15 . 1 1 106 106 LEU N N 106 120.137 120.137 128.464 -8.327 18509 7596 1 15 . 1 1 106 106 LEU H H 106 8.313 8.313 8.111 0.202 18509 7597 1 15 . 1 1 107 107 SER C C 107 170.701 170.701 173.619 -2.918 18509 7598 1 15 . 1 1 107 107 SER CA C 107 54.540 54.540 58.674 -4.134 18509 7599 1 15 . 1 1 108 108 GLY N N 108 107.603 107.603 114.121 -6.518 18509 7600 1 15 . 1 1 108 108 GLY C C 108 173.128 173.128 173.128 0.000 18509 7601 1 15 . 1 1 108 108 GLY CA C 108 41.287 41.287 45.038 -3.751 18509 7602 1 15 . 1 1 108 108 GLY H H 108 8.717 8.717 8.202 0.515 18509 7603 1 15 . 1 1 109 109 ASP N N 109 120.664 120.664 123.899 -3.235 18509 7604 1 15 . 1 1 109 109 ASP C C 109 171.904 171.904 176.668 -4.764 18509 7605 1 15 . 1 1 109 109 ASP H H 109 9.019 9.019 8.905 0.114 18509 7606 1 15 . 1 1 110 110 HIS N N 110 116.324 116.324 117.879 -1.555 18509 7607 1 15 . 1 1 110 110 HIS H H 110 9.283 9.283 8.754 0.529 18509 7608 1 15 . 1 1 111 111 SER N N 111 110.225 110.225 108.733 1.492 18509 7609 1 15 . 1 1 111 111 SER CA C 111 54.681 54.681 57.976 -3.295 18509 7610 1 15 . 1 1 111 111 SER H H 111 7.156 7.156 7.639 -0.483 18509 7611 1 15 . 1 1 112 112 ILE N N 112 117.053 117.053 121.498 -4.445 18509 7612 1 15 . 1 1 112 112 ILE C C 112 171.419 171.419 176.356 -4.937 18509 7613 1 15 . 1 1 112 112 ILE CA C 112 57.239 57.239 62.322 -5.083 18509 7614 1 15 . 1 1 112 112 ILE H H 112 7.837 7.837 8.516 -0.679 18509 7615 1 15 . 1 1 113 113 ILE N N 113 121.032 121.032 121.464 -0.432 18509 7616 1 15 . 1 1 113 113 ILE C C 113 173.604 173.604 176.556 -2.952 18509 7617 1 15 . 1 1 113 113 ILE CA C 113 58.318 58.318 62.886 -4.568 18509 7618 1 15 . 1 1 113 113 ILE H H 113 7.592 7.592 7.320 0.272 18509 7619 1 15 . 1 1 114 114 GLY N N 114 112.661 112.661 115.975 -3.314 18509 7620 1 15 . 1 1 114 114 GLY C C 114 169.739 169.739 174.189 -4.450 18509 7621 1 15 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.506 -3.596 18509 7622 1 15 . 1 1 114 114 GLY H H 114 9.575 9.575 8.735 0.840 18509 7623 1 15 . 1 1 115 115 ARG N N 115 118.398 118.398 123.071 -4.673 18509 7624 1 15 . 1 1 115 115 ARG C C 115 171.079 171.079 175.712 -4.633 18509 7625 1 15 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.099 -2.436 18509 7626 1 15 . 1 1 115 115 ARG H H 115 7.464 7.464 7.565 -0.101 18509 7627 1 15 . 1 1 116 116 THR N N 116 112.218 112.218 116.842 -4.624 18509 7628 1 15 . 1 1 116 116 THR C C 116 169.821 169.821 173.985 -4.164 18509 7629 1 15 . 1 1 116 116 THR CA C 116 59.633 59.633 60.923 -1.290 18509 7630 1 15 . 1 1 116 116 THR H H 116 6.677 6.677 8.477 -1.800 18509 7631 1 15 . 1 1 117 117 LEU N N 117 129.477 129.477 128.876 0.601 18509 7632 1 15 . 1 1 117 117 LEU C C 117 171.126 171.126 176.497 -5.371 18509 7633 1 15 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.169 -3.755 18509 7634 1 15 . 1 1 117 117 LEU H H 117 8.799 8.799 7.951 0.848 18509 7635 1 15 . 1 1 118 118 VAL N N 118 125.091 125.091 124.793 0.298 18509 7636 1 15 . 1 1 118 118 VAL C C 118 170.267 170.267 175.475 -5.208 18509 7637 1 15 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.925 -3.786 18509 7638 1 15 . 1 1 118 118 VAL H H 118 8.906 8.906 8.358 0.548 18509 7639 1 15 . 1 1 119 119 VAL N N 119 120.716 120.716 126.690 -5.974 18509 7640 1 15 . 1 1 119 119 VAL C C 119 171.175 171.175 174.188 -3.013 18509 7641 1 15 . 1 1 119 119 VAL CA C 119 55.271 55.271 60.506 -5.235 18509 7642 1 15 . 1 1 119 119 VAL H H 119 7.982 7.982 7.749 0.233 18509 7643 1 15 . 1 1 120 120 HIS N N 120 125.052 125.052 124.292 0.760 18509 7644 1 15 . 1 1 120 120 HIS C C 120 172.599 172.599 173.612 -1.013 18509 7645 1 15 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.776 -1.382 18509 7646 1 15 . 1 1 120 120 HIS H H 120 8.935 8.935 7.525 1.410 18509 7647 1 15 . 1 1 121 121 GLU N N 121 121.453 121.453 123.120 -1.667 18509 7648 1 15 . 1 1 121 121 GLU C C 121 172.304 172.304 175.640 -3.336 18509 7649 1 15 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.267 -0.177 18509 7650 1 15 . 1 1 121 121 GLU H H 121 9.178 9.178 8.167 1.011 18509 7651 1 15 . 1 1 122 122 LYS N N 122 115.248 115.248 122.892 -7.644 18509 7652 1 15 . 1 1 122 122 LYS C C 122 171.523 171.523 174.218 -2.695 18509 7653 1 15 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.659 -5.040 18509 7654 1 15 . 1 1 122 122 LYS H H 122 8.478 8.478 7.877 0.601 18509 7655 1 15 . 1 1 123 123 ALA N N 123 120.866 120.866 126.312 -5.446 18509 7656 1 15 . 1 1 123 123 ALA C C 123 173.219 173.219 176.736 -3.517 18509 7657 1 15 . 1 1 123 123 ALA CA C 123 48.850 48.850 53.220 -4.370 18509 7658 1 15 . 1 1 123 123 ALA H H 123 7.796 7.796 8.491 -0.695 18509 7659 1 15 . 1 1 124 124 ASP N N 124 121.799 121.799 125.096 -3.297 18509 7660 1 15 . 1 1 124 124 ASP C C 124 174.458 174.458 176.493 -2.035 18509 7661 1 15 . 1 1 124 124 ASP CA C 124 49.408 49.408 54.300 -4.892 18509 7662 1 15 . 1 1 124 124 ASP H H 124 10.165 10.165 8.428 1.737 18509 7663 1 15 . 1 1 125 125 ASP N N 125 129.369 129.369 118.018 11.351 18509 7664 1 15 . 1 1 125 125 ASP C C 125 175.231 175.231 176.001 -0.770 18509 7665 1 15 . 1 1 125 125 ASP CA C 125 50.939 50.939 55.030 -4.091 18509 7666 1 15 . 1 1 125 125 ASP H H 125 10.055 10.055 7.715 2.340 18509 7667 1 15 . 1 1 126 126 LEU N N 126 117.190 117.190 121.719 -4.529 18509 7668 1 15 . 1 1 126 126 LEU C C 126 173.964 173.964 178.521 -4.557 18509 7669 1 15 . 1 1 126 126 LEU H H 126 10.483 10.483 8.506 1.977 18509 7670 1 15 . 1 1 127 127 GLY N N 127 103.809 103.809 105.914 -2.105 18509 7671 1 15 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.088 -3.210 18509 7672 1 15 . 1 1 127 127 GLY H H 127 8.637 8.637 8.007 0.630 18509 7673 1 15 . 1 1 128 128 LYS N N 128 118.290 118.290 121.728 -3.438 18509 7674 1 15 . 1 1 128 128 LYS CA C 128 51.740 51.740 57.668 -5.928 18509 7675 1 15 . 1 1 128 128 LYS H H 128 7.158 7.158 8.263 -1.105 18509 7676 1 15 . 1 1 129 129 GLY N N 129 108.507 108.507 106.837 1.670 18509 7677 1 15 . 1 1 129 129 GLY C C 129 171.524 171.524 174.058 -2.534 18509 7678 1 15 . 1 1 129 129 GLY CA C 129 42.113 42.113 44.894 -2.781 18509 7679 1 15 . 1 1 129 129 GLY H H 129 8.913 8.913 7.851 1.062 18509 7680 1 15 . 1 1 130 130 GLY N N 130 108.537 108.537 109.493 -0.956 18509 7681 1 15 . 1 1 130 130 GLY C C 130 169.994 169.994 172.854 -2.860 18509 7682 1 15 . 1 1 130 130 GLY CA C 130 42.419 42.419 45.377 -2.958 18509 7683 1 15 . 1 1 130 130 GLY H H 130 8.723 8.723 8.273 0.450 18509 7684 1 15 . 1 1 131 131 ASN N N 131 111.951 111.951 117.771 -5.820 18509 7685 1 15 . 1 1 131 131 ASN C C 131 172.236 172.236 175.951 -3.715 18509 7686 1 15 . 1 1 131 131 ASN H H 131 7.152 7.152 7.696 -0.544 18509 7687 1 15 . 1 1 132 132 GLU N N 132 120.461 120.461 121.605 -1.144 18509 7688 1 15 . 1 1 132 132 GLU C C 132 171.084 171.084 176.745 -5.661 18509 7689 1 15 . 1 1 132 132 GLU H H 132 8.935 8.935 8.725 0.210 18509 7690 1 15 . 1 1 133 133 GLU N N 133 120.137 120.137 117.362 2.775 18509 7691 1 15 . 1 1 133 133 GLU C C 133 176.239 176.239 178.666 -2.427 18509 7692 1 15 . 1 1 133 133 GLU H H 133 8.775 8.775 8.464 0.311 18509 7693 1 15 . 1 1 134 134 SER N N 134 114.981 114.981 115.240 -0.259 18509 7694 1 15 . 1 1 134 134 SER CA C 134 59.046 59.046 61.224 -2.178 18509 7695 1 15 . 1 1 134 134 SER H H 134 8.117 8.117 8.150 -0.033 18509 7696 1 15 . 1 1 135 135 THR N N 135 102.263 102.263 116.863 -14.600 18509 7697 1 15 . 1 1 135 135 THR C C 135 172.804 172.804 175.280 -2.476 18509 7698 1 15 . 1 1 135 135 THR CA C 135 60.029 60.029 64.159 -4.130 18509 7699 1 15 . 1 1 135 135 THR H H 135 7.206 7.206 8.432 -1.226 18509 7700 1 15 . 1 1 136 136 LYS N N 136 122.108 122.108 120.464 1.644 18509 7701 1 15 . 1 1 136 136 LYS H H 136 7.884 7.884 7.750 0.134 18509 7702 1 15 . 1 1 137 137 THR N N 137 105.718 105.718 111.519 -5.801 18509 7703 1 15 . 1 1 137 137 THR H H 137 8.630 8.630 7.718 0.912 18509 7704 1 15 . 1 1 138 138 GLY N N 138 111.372 111.372 109.674 1.698 18509 7705 1 15 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.289 -2.806 18509 7706 1 15 . 1 1 138 138 GLY H H 138 7.426 7.426 8.192 -0.766 18509 7707 1 15 . 1 1 139 139 ASN N N 139 107.496 107.496 117.332 -9.836 18509 7708 1 15 . 1 1 139 139 ASN H H 139 7.545 7.545 7.336 0.209 18509 7709 1 15 . 1 1 140 140 ALA N N 140 114.542 114.542 127.225 -12.683 18509 7710 1 15 . 1 1 140 140 ALA C C 140 173.571 173.571 176.590 -3.019 18509 7711 1 15 . 1 1 140 140 ALA H H 140 6.368 6.368 8.245 -1.877 18509 7712 1 15 . 1 1 141 141 GLY N N 141 105.287 105.287 107.206 -1.919 18509 7713 1 15 . 1 1 141 141 GLY C C 141 173.542 173.542 174.739 -1.197 18509 7714 1 15 . 1 1 141 141 GLY H H 141 8.271 8.271 7.953 0.318 18509 7715 1 15 . 1 1 142 142 SER N N 142 118.771 118.771 116.526 2.245 18509 7716 1 15 . 1 1 142 142 SER C C 142 170.188 170.188 175.168 -4.980 18509 7717 1 15 . 1 1 142 142 SER H H 142 9.196 9.196 8.795 0.401 18509 7718 1 15 . 1 1 143 143 ARG N N 143 120.189 120.189 118.303 1.886 18509 7719 1 15 . 1 1 143 143 ARG C C 143 171.596 171.596 177.540 -5.944 18509 7720 1 15 . 1 1 143 143 ARG H H 143 8.943 8.943 7.931 1.012 18509 7721 1 15 . 1 1 144 144 LEU N N 144 122.907 122.907 119.925 2.982 18509 7722 1 15 . 1 1 144 144 LEU C C 144 174.393 174.393 176.446 -2.053 18509 7723 1 15 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.845 -3.470 18509 7724 1 15 . 1 1 144 144 LEU H H 144 8.395 8.395 7.976 0.419 18509 7725 1 15 . 1 1 145 145 ALA N N 145 114.159 114.159 115.766 -1.607 18509 7726 1 15 . 1 1 145 145 ALA C C 145 171.752 171.752 175.077 -3.325 18509 7727 1 15 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.800 -3.671 18509 7728 1 15 . 1 1 145 145 ALA H H 145 7.356 7.356 7.651 -0.295 18509 7729 1 15 . 1 1 146 146 CYS N N 146 110.738 110.738 121.450 -10.712 18509 7730 1 15 . 1 1 146 146 CYS C C 146 170.087 170.087 174.265 -4.178 18509 7731 1 15 . 1 1 146 146 CYS CA C 146 51.077 51.077 58.726 -7.649 18509 7732 1 15 . 1 1 146 146 CYS H H 146 9.008 9.008 8.268 0.740 18509 7733 1 15 . 1 1 147 147 GLY N N 147 106.461 106.461 110.064 -3.603 18509 7734 1 15 . 1 1 147 147 GLY C C 147 167.909 167.909 172.391 -4.482 18509 7735 1 15 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.188 -2.514 18509 7736 1 15 . 1 1 147 147 GLY H H 147 8.018 8.018 8.116 -0.098 18509 7737 1 15 . 1 1 148 148 VAL N N 148 124.054 124.054 123.469 0.585 18509 7738 1 15 . 1 1 148 148 VAL C C 148 172.084 172.084 175.259 -3.175 18509 7739 1 15 . 1 1 148 148 VAL CA C 148 59.635 59.635 63.736 -4.101 18509 7740 1 15 . 1 1 148 148 VAL H H 148 8.434 8.434 8.483 -0.049 18509 7741 1 15 . 1 1 149 149 ILE N N 149 126.918 126.918 128.788 -1.870 18509 7742 1 15 . 1 1 149 149 ILE C C 149 171.804 171.804 175.429 -3.625 18509 7743 1 15 . 1 1 149 149 ILE CA C 149 59.184 59.184 58.912 0.272 18509 7744 1 15 . 1 1 149 149 ILE H H 149 8.613 8.613 8.843 -0.230 18509 7745 1 15 . 1 1 150 150 GLY N N 150 116.493 116.493 114.382 2.111 18509 7746 1 15 . 1 1 150 150 GLY C C 150 170.188 170.188 172.629 -2.441 18509 7747 1 15 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.848 -4.728 18509 7748 1 15 . 1 1 150 150 GLY H H 150 9.283 9.283 8.103 1.180 18509 7749 1 15 . 1 1 151 151 ILE N N 151 120.189 120.189 122.205 -2.016 18509 7750 1 15 . 1 1 151 151 ILE C C 151 172.231 172.231 173.989 -1.758 18509 7751 1 15 . 1 1 151 151 ILE CA C 151 60.372 60.372 62.344 -1.972 18509 7752 1 15 . 1 1 151 151 ILE H H 151 8.943 8.943 8.656 0.287 18509 7753 1 15 . 1 1 152 152 ALA N N 152 129.719 129.719 131.274 -1.555 18509 7754 1 15 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.815 -5.043 18509 7755 1 15 . 1 1 152 152 ALA H H 152 8.170 8.170 7.749 0.421 18509 7756 1 16 . 1 1 2 2 THR C C 2 170.139 170.139 173.827 -3.688 18509 7757 1 16 . 1 1 3 3 LYS N N 3 123.998 123.998 118.703 5.295 18509 7758 1 16 . 1 1 3 3 LYS C C 3 171.607 171.607 174.051 -2.444 18509 7759 1 16 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.418 -3.240 18509 7760 1 16 . 1 1 3 3 LYS H H 3 8.666 8.666 7.488 1.178 18509 7761 1 16 . 1 1 4 4 ALA N N 4 123.295 123.295 123.759 -0.464 18509 7762 1 16 . 1 1 4 4 ALA C C 4 172.145 172.145 175.429 -3.284 18509 7763 1 16 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.750 -3.246 18509 7764 1 16 . 1 1 4 4 ALA H H 4 9.116 9.116 8.288 0.828 18509 7765 1 16 . 1 1 5 5 VAL N N 5 121.466 121.466 120.939 0.527 18509 7766 1 16 . 1 1 5 5 VAL C C 5 167.836 167.836 174.189 -6.353 18509 7767 1 16 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.046 -4.171 18509 7768 1 16 . 1 1 5 5 VAL H H 5 9.545 9.545 8.966 0.579 18509 7769 1 16 . 1 1 6 6 ALA N N 6 125.984 125.984 130.146 -4.162 18509 7770 1 16 . 1 1 6 6 ALA C C 6 171.607 171.607 176.094 -4.487 18509 7771 1 16 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.672 -3.201 18509 7772 1 16 . 1 1 6 6 ALA H H 6 9.177 9.177 8.345 0.832 18509 7773 1 16 . 1 1 7 7 VAL N N 7 123.600 123.600 120.730 2.870 18509 7774 1 16 . 1 1 7 7 VAL C C 7 172.244 172.244 174.124 -1.880 18509 7775 1 16 . 1 1 7 7 VAL CA C 7 58.476 58.476 61.292 -2.816 18509 7776 1 16 . 1 1 7 7 VAL H H 7 9.116 9.116 8.059 1.057 18509 7777 1 16 . 1 1 8 8 LEU N N 8 126.455 126.455 126.931 -0.476 18509 7778 1 16 . 1 1 8 8 LEU C C 8 172.557 172.557 176.649 -4.092 18509 7779 1 16 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.910 -2.858 18509 7780 1 16 . 1 1 8 8 LEU H H 8 8.916 8.916 8.289 0.627 18509 7781 1 16 . 1 1 9 9 LYS N N 9 120.820 120.820 123.780 -2.960 18509 7782 1 16 . 1 1 9 9 LYS C C 9 172.509 172.509 174.841 -2.332 18509 7783 1 16 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.694 -3.797 18509 7784 1 16 . 1 1 9 9 LYS H H 9 8.315 8.315 8.924 -0.609 18509 7785 1 16 . 1 1 10 10 GLY N N 10 111.249 111.249 112.149 -0.900 18509 7786 1 16 . 1 1 10 10 GLY C C 10 169.847 169.847 172.723 -2.876 18509 7787 1 16 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.407 -3.132 18509 7788 1 16 . 1 1 10 10 GLY H H 10 8.968 8.968 8.355 0.613 18509 7789 1 16 . 1 1 11 11 ASP N N 11 120.904 120.904 122.426 -1.522 18509 7790 1 16 . 1 1 11 11 ASP C C 11 173.132 173.132 176.072 -2.940 18509 7791 1 16 . 1 1 11 11 ASP CA C 11 51.317 51.317 53.533 -2.216 18509 7792 1 16 . 1 1 11 11 ASP H H 11 8.745 8.745 8.520 0.225 18509 7793 1 16 . 1 1 12 12 GLY N N 12 109.862 109.862 111.204 -1.342 18509 7794 1 16 . 1 1 12 12 GLY CA C 12 41.200 41.200 44.305 -3.105 18509 7795 1 16 . 1 1 12 12 GLY H H 12 7.985 7.985 7.473 0.512 18509 7796 1 16 . 1 1 13 13 PRO C C 13 173.640 173.640 175.030 -1.390 18509 7797 1 16 . 1 1 14 14 VAL N N 14 120.414 120.414 123.922 -3.508 18509 7798 1 16 . 1 1 14 14 VAL C C 14 172.804 172.804 174.225 -1.421 18509 7799 1 16 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.282 -0.398 18509 7800 1 16 . 1 1 14 14 VAL H H 14 7.476 7.476 8.412 -0.936 18509 7801 1 16 . 1 1 15 15 GLN N N 15 122.664 122.664 128.782 -6.118 18509 7802 1 16 . 1 1 15 15 GLN C C 15 171.168 171.168 174.089 -2.921 18509 7803 1 16 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.413 -3.733 18509 7804 1 16 . 1 1 15 15 GLN H H 15 7.938 7.938 8.893 -0.955 18509 7805 1 16 . 1 1 16 16 GLY N N 16 107.018 107.018 111.665 -4.647 18509 7806 1 16 . 1 1 16 16 GLY C C 16 167.726 167.726 172.785 -5.059 18509 7807 1 16 . 1 1 16 16 GLY CA C 16 43.625 43.625 44.881 -1.256 18509 7808 1 16 . 1 1 16 16 GLY H H 16 8.288 8.288 8.343 -0.055 18509 7809 1 16 . 1 1 17 17 ILE N N 17 120.248 120.248 118.886 1.362 18509 7810 1 16 . 1 1 17 17 ILE C C 17 171.194 171.194 174.205 -3.011 18509 7811 1 16 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.868 -1.371 18509 7812 1 16 . 1 1 17 17 ILE H H 17 7.948 7.948 7.849 0.099 18509 7813 1 16 . 1 1 18 18 ILE N N 18 125.851 125.851 125.906 -0.055 18509 7814 1 16 . 1 1 18 18 ILE C C 18 168.889 168.889 174.842 -5.953 18509 7815 1 16 . 1 1 18 18 ILE CA C 18 53.431 53.431 58.598 -5.167 18509 7816 1 16 . 1 1 18 18 ILE H H 18 8.725 8.725 8.262 0.463 18509 7817 1 16 . 1 1 19 19 ASN N N 19 123.256 123.256 123.960 -0.704 18509 7818 1 16 . 1 1 19 19 ASN C C 19 168.903 168.903 173.177 -4.274 18509 7819 1 16 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.211 -2.123 18509 7820 1 16 . 1 1 19 19 ASN H H 19 8.727 8.727 7.969 0.758 18509 7821 1 16 . 1 1 20 20 PHE N N 20 113.849 113.849 119.977 -6.128 18509 7822 1 16 . 1 1 20 20 PHE C C 20 173.219 173.219 174.097 -0.878 18509 7823 1 16 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.377 -5.319 18509 7824 1 16 . 1 1 20 20 PHE H H 20 8.399 8.399 8.364 0.035 18509 7825 1 16 . 1 1 21 21 GLU N N 21 121.454 121.454 125.729 -4.275 18509 7826 1 16 . 1 1 21 21 GLU C C 21 170.280 170.280 174.641 -4.361 18509 7827 1 16 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.802 -1.758 18509 7828 1 16 . 1 1 21 21 GLU H H 21 9.526 9.526 8.503 1.023 18509 7829 1 16 . 1 1 22 22 GLN N N 22 130.340 130.340 123.798 6.542 18509 7830 1 16 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.389 -4.208 18509 7831 1 16 . 1 1 22 22 GLN H H 22 9.305 9.305 8.249 1.056 18509 7832 1 16 . 1 1 23 23 LYS N N 23 128.657 128.657 122.095 6.562 18509 7833 1 16 . 1 1 23 23 LYS CA C 23 57.241 57.241 54.226 3.015 18509 7834 1 16 . 1 1 23 23 LYS H H 23 9.088 9.088 8.455 0.633 18509 7835 1 16 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.814 -7.422 18509 7836 1 16 . 1 1 25 25 SER CA C 25 58.078 58.078 59.413 -1.335 18509 7837 1 16 . 1 1 27 27 GLY N N 27 108.125 108.125 111.894 -3.769 18509 7838 1 16 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.843 -1.918 18509 7839 1 16 . 1 1 27 27 GLY H H 27 8.032 8.032 7.937 0.095 18509 7840 1 16 . 1 1 28 28 PRO C C 28 173.128 173.128 176.425 -3.297 18509 7841 1 16 . 1 1 29 29 VAL N N 29 121.267 121.267 127.081 -5.814 18509 7842 1 16 . 1 1 29 29 VAL C C 29 172.198 172.198 175.310 -3.112 18509 7843 1 16 . 1 1 29 29 VAL CA C 29 57.720 57.720 62.644 -4.924 18509 7844 1 16 . 1 1 29 29 VAL H H 29 9.089 9.089 8.217 0.872 18509 7845 1 16 . 1 1 30 30 LYS N N 30 127.589 127.589 129.781 -2.192 18509 7846 1 16 . 1 1 30 30 LYS C C 30 172.098 172.098 175.516 -3.418 18509 7847 1 16 . 1 1 30 30 LYS CA C 30 52.642 52.642 54.532 -1.890 18509 7848 1 16 . 1 1 30 30 LYS H H 30 9.200 9.200 8.193 1.007 18509 7849 1 16 . 1 1 31 31 VAL N N 31 126.037 126.037 117.341 8.696 18509 7850 1 16 . 1 1 31 31 VAL C C 31 172.244 172.244 173.822 -1.578 18509 7851 1 16 . 1 1 31 31 VAL CA C 31 57.139 57.139 60.318 -3.179 18509 7852 1 16 . 1 1 31 31 VAL H H 31 9.282 9.282 8.108 1.174 18509 7853 1 16 . 1 1 32 32 TRP N N 32 125.414 125.414 118.673 6.741 18509 7854 1 16 . 1 1 32 32 TRP C C 32 170.156 170.156 174.121 -3.965 18509 7855 1 16 . 1 1 32 32 TRP CA C 32 53.137 53.137 55.404 -2.267 18509 7856 1 16 . 1 1 32 32 TRP H H 32 8.983 8.983 7.948 1.035 18509 7857 1 16 . 1 1 33 33 GLY N N 33 107.848 107.848 108.196 -0.348 18509 7858 1 16 . 1 1 33 33 GLY C C 33 168.400 168.400 171.996 -3.596 18509 7859 1 16 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.440 -3.873 18509 7860 1 16 . 1 1 33 33 GLY H H 33 8.360 8.360 8.455 -0.095 18509 7861 1 16 . 1 1 34 34 SER N N 34 114.377 114.377 116.496 -2.119 18509 7862 1 16 . 1 1 34 34 SER C C 34 169.618 169.618 173.671 -4.053 18509 7863 1 16 . 1 1 34 34 SER CA C 34 53.875 53.875 55.752 -1.877 18509 7864 1 16 . 1 1 34 34 SER H H 34 7.838 7.838 8.284 -0.446 18509 7865 1 16 . 1 1 35 35 ILE N N 35 123.149 123.149 120.902 2.247 18509 7866 1 16 . 1 1 35 35 ILE C C 35 169.713 169.713 174.405 -4.692 18509 7867 1 16 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.057 -2.288 18509 7868 1 16 . 1 1 35 35 ILE H H 35 8.496 8.496 8.387 0.109 18509 7869 1 16 . 1 1 36 36 LYS N N 36 123.803 123.803 123.302 0.501 18509 7870 1 16 . 1 1 36 36 LYS C C 36 172.260 172.260 175.512 -3.252 18509 7871 1 16 . 1 1 36 36 LYS CA C 36 51.150 51.150 55.107 -3.957 18509 7872 1 16 . 1 1 36 36 LYS H H 36 9.091 9.091 8.544 0.547 18509 7873 1 16 . 1 1 37 37 GLY N N 37 105.495 105.495 110.675 -5.180 18509 7874 1 16 . 1 1 37 37 GLY C C 37 171.641 171.641 172.715 -1.074 18509 7875 1 16 . 1 1 37 37 GLY CA C 37 42.361 42.361 43.144 -0.783 18509 7876 1 16 . 1 1 37 37 GLY H H 37 8.237 8.237 8.129 0.108 18509 7877 1 16 . 1 1 38 38 LEU N N 38 120.966 120.966 118.398 2.568 18509 7878 1 16 . 1 1 38 38 LEU C C 38 174.112 174.112 177.583 -3.471 18509 7879 1 16 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.655 -4.184 18509 7880 1 16 . 1 1 38 38 LEU H H 38 8.156 8.156 8.276 -0.120 18509 7881 1 16 . 1 1 39 39 THR N N 39 110.363 110.363 116.288 -5.925 18509 7882 1 16 . 1 1 39 39 THR C C 39 173.102 173.102 173.768 -0.666 18509 7883 1 16 . 1 1 39 39 THR CA C 39 58.194 58.194 63.908 -5.714 18509 7884 1 16 . 1 1 39 39 THR H H 39 8.660 8.660 8.346 0.314 18509 7885 1 16 . 1 1 40 40 GLU N N 40 125.818 125.818 126.551 -0.733 18509 7886 1 16 . 1 1 40 40 GLU C C 40 173.134 173.134 174.487 -1.353 18509 7887 1 16 . 1 1 40 40 GLU CA C 40 54.356 54.356 54.966 -0.610 18509 7888 1 16 . 1 1 40 40 GLU H H 40 8.804 8.804 7.896 0.908 18509 7889 1 16 . 1 1 41 41 GLY N N 41 113.875 113.875 107.219 6.656 18509 7890 1 16 . 1 1 41 41 GLY C C 41 170.046 170.046 172.935 -2.889 18509 7891 1 16 . 1 1 41 41 GLY CA C 41 40.054 40.054 44.040 -3.986 18509 7892 1 16 . 1 1 41 41 GLY H H 41 8.763 8.763 8.437 0.326 18509 7893 1 16 . 1 1 42 42 LEU N N 42 120.137 120.137 119.638 0.499 18509 7894 1 16 . 1 1 42 42 LEU C C 42 174.218 174.218 174.449 -0.231 18509 7895 1 16 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.020 -2.865 18509 7896 1 16 . 1 1 42 42 LEU H H 42 8.313 8.313 8.279 0.034 18509 7897 1 16 . 1 1 43 43 HIS N N 43 114.385 114.385 122.351 -7.966 18509 7898 1 16 . 1 1 43 43 HIS C C 43 171.504 171.504 174.418 -2.914 18509 7899 1 16 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.944 -4.959 18509 7900 1 16 . 1 1 43 43 HIS H H 43 8.712 8.712 8.247 0.465 18509 7901 1 16 . 1 1 44 44 GLY N N 44 108.872 108.872 114.987 -6.115 18509 7902 1 16 . 1 1 44 44 GLY C C 44 168.656 168.656 172.174 -3.518 18509 7903 1 16 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.342 -1.147 18509 7904 1 16 . 1 1 44 44 GLY H H 44 8.875 8.875 7.881 0.994 18509 7905 1 16 . 1 1 45 45 PHE N N 45 126.439 126.439 119.669 6.770 18509 7906 1 16 . 1 1 45 45 PHE CA C 45 53.098 53.098 54.011 -0.913 18509 7907 1 16 . 1 1 45 45 PHE H H 45 8.111 8.111 8.244 -0.133 18509 7908 1 16 . 1 1 46 46 HIS N N 46 115.353 115.353 126.374 -11.021 18509 7909 1 16 . 1 1 46 46 HIS C C 46 172.415 172.415 174.118 -1.703 18509 7910 1 16 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.697 -5.491 18509 7911 1 16 . 1 1 46 46 HIS H H 46 8.107 8.107 8.642 -0.535 18509 7912 1 16 . 1 1 47 47 VAL N N 47 120.548 120.548 123.068 -2.520 18509 7913 1 16 . 1 1 47 47 VAL C C 47 173.900 173.900 173.716 0.184 18509 7914 1 16 . 1 1 47 47 VAL CA C 47 58.792 58.792 60.107 -1.315 18509 7915 1 16 . 1 1 47 47 VAL H H 47 9.366 9.366 7.444 1.922 18509 7916 1 16 . 1 1 48 48 HIS N N 48 129.236 129.236 120.245 8.991 18509 7917 1 16 . 1 1 48 48 HIS C C 48 171.084 171.084 173.057 -1.973 18509 7918 1 16 . 1 1 48 48 HIS CA C 48 52.756 52.756 55.191 -2.435 18509 7919 1 16 . 1 1 48 48 HIS H H 48 10.210 10.210 6.892 3.318 18509 7920 1 16 . 1 1 49 49 GLU N N 49 118.119 118.119 120.569 -2.450 18509 7921 1 16 . 1 1 49 49 GLU C C 49 171.635 171.635 174.378 -2.743 18509 7922 1 16 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.671 2.088 18509 7923 1 16 . 1 1 49 49 GLU H H 49 8.492 8.492 8.705 -0.213 18509 7924 1 16 . 1 1 50 50 PHE N N 50 110.329 110.329 122.529 -12.200 18509 7925 1 16 . 1 1 50 50 PHE C C 50 175.252 175.252 174.981 0.271 18509 7926 1 16 . 1 1 50 50 PHE CA C 50 52.900 52.900 56.949 -4.049 18509 7927 1 16 . 1 1 50 50 PHE H H 50 8.580 8.580 8.832 -0.252 18509 7928 1 16 . 1 1 51 51 GLY N N 51 119.251 119.251 111.309 7.942 18509 7929 1 16 . 1 1 51 51 GLY C C 51 168.248 168.248 172.533 -4.285 18509 7930 1 16 . 1 1 51 51 GLY H H 51 10.208 10.208 7.585 2.623 18509 7931 1 16 . 1 1 52 52 ASP N N 52 114.958 114.958 118.142 -3.184 18509 7932 1 16 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.743 -5.852 18509 7933 1 16 . 1 1 52 52 ASP H H 52 5.834 5.834 8.575 -2.741 18509 7934 1 16 . 1 1 53 53 ASN N N 53 128.224 128.224 119.433 8.791 18509 7935 1 16 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.933 -4.700 18509 7936 1 16 . 1 1 53 53 ASN H H 53 9.360 9.360 8.009 1.351 18509 7937 1 16 . 1 1 54 54 THR C C 54 168.656 168.656 175.076 -6.420 18509 7938 1 16 . 1 1 55 55 ALA N N 55 126.661 126.661 122.456 4.205 18509 7939 1 16 . 1 1 55 55 ALA C C 55 174.185 174.185 176.390 -2.205 18509 7940 1 16 . 1 1 55 55 ALA CA C 55 46.155 46.155 52.429 -6.274 18509 7941 1 16 . 1 1 55 55 ALA H H 55 8.390 8.390 8.056 0.334 18509 7942 1 16 . 1 1 56 56 GLY N N 56 107.903 107.903 106.305 1.598 18509 7943 1 16 . 1 1 56 56 GLY C C 56 171.578 171.578 173.620 -2.042 18509 7944 1 16 . 1 1 56 56 GLY CA C 56 42.580 42.580 44.531 -1.950 18509 7945 1 16 . 1 1 56 56 GLY H H 56 7.282 7.282 7.374 -0.092 18509 7946 1 16 . 1 1 57 57 CYS N N 57 117.952 117.952 124.650 -6.698 18509 7947 1 16 . 1 1 57 57 CYS C C 57 175.209 175.209 175.347 -0.138 18509 7948 1 16 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.171 -7.083 18509 7949 1 16 . 1 1 57 57 CYS H H 57 8.900 8.900 8.257 0.643 18509 7950 1 16 . 1 1 58 58 THR N N 58 119.852 119.852 120.255 -0.403 18509 7951 1 16 . 1 1 58 58 THR CA C 58 58.239 58.239 64.939 -6.700 18509 7952 1 16 . 1 1 58 58 THR H H 58 8.505 8.505 8.076 0.429 18509 7953 1 16 . 1 1 59 59 SER C C 59 170.763 170.763 175.170 -4.407 18509 7954 1 16 . 1 1 59 59 SER CA C 59 55.609 55.609 60.757 -5.148 18509 7955 1 16 . 1 1 60 60 ALA N N 60 119.753 119.753 123.352 -3.599 18509 7956 1 16 . 1 1 60 60 ALA CA C 60 49.940 49.940 51.909 -1.969 18509 7957 1 16 . 1 1 60 60 ALA H H 60 6.898 6.898 8.099 -1.201 18509 7958 1 16 . 1 1 61 61 GLY N N 61 101.351 101.351 107.371 -6.020 18509 7959 1 16 . 1 1 61 61 GLY CA C 61 42.805 42.805 43.985 -1.180 18509 7960 1 16 . 1 1 61 61 GLY H H 61 7.730 7.730 7.586 0.144 18509 7961 1 16 . 1 1 62 62 PRO C C 62 172.276 172.276 174.898 -2.622 18509 7962 1 16 . 1 1 63 63 HIS N N 63 115.023 115.023 118.283 -3.260 18509 7963 1 16 . 1 1 63 63 HIS CA C 63 52.119 52.119 55.693 -3.574 18509 7964 1 16 . 1 1 63 63 HIS H H 63 7.474 7.474 7.405 0.069 18509 7965 1 16 . 1 1 64 64 PHE C C 64 171.731 171.731 175.159 -3.428 18509 7966 1 16 . 1 1 65 65 ASN N N 65 126.978 126.978 120.835 6.143 18509 7967 1 16 . 1 1 65 65 ASN CA C 65 47.753 47.753 49.648 -1.895 18509 7968 1 16 . 1 1 65 65 ASN H H 65 9.426 9.426 8.874 0.552 18509 7969 1 16 . 1 1 67 67 LEU N N 67 117.937 117.937 113.764 4.173 18509 7970 1 16 . 1 1 67 67 LEU C C 67 172.580 172.580 177.072 -4.492 18509 7971 1 16 . 1 1 67 67 LEU CA C 67 50.911 50.911 54.877 -3.966 18509 7972 1 16 . 1 1 67 67 LEU H H 67 7.720 7.720 7.898 -0.178 18509 7973 1 16 . 1 1 68 68 SER N N 68 110.842 110.842 112.778 -1.936 18509 7974 1 16 . 1 1 68 68 SER CA C 68 55.953 55.953 57.468 -1.515 18509 7975 1 16 . 1 1 68 68 SER H H 68 7.428 7.428 7.838 -0.410 18509 7976 1 16 . 1 1 69 69 ARG N N 69 120.782 120.782 121.099 -0.317 18509 7977 1 16 . 1 1 69 69 ARG C C 69 173.381 173.381 175.864 -2.483 18509 7978 1 16 . 1 1 69 69 ARG CA C 69 50.543 50.543 56.247 -5.704 18509 7979 1 16 . 1 1 69 69 ARG H H 69 8.508 8.508 7.621 0.887 18509 7980 1 16 . 1 1 70 70 LYS N N 70 118.055 118.055 121.288 -3.233 18509 7981 1 16 . 1 1 70 70 LYS C C 70 169.994 169.994 176.630 -6.636 18509 7982 1 16 . 1 1 70 70 LYS CA C 70 52.596 52.596 57.751 -5.155 18509 7983 1 16 . 1 1 70 70 LYS H H 70 8.745 8.745 8.462 0.283 18509 7984 1 16 . 1 1 71 71 HIS N N 71 111.871 111.871 116.447 -4.576 18509 7985 1 16 . 1 1 71 71 HIS C C 71 171.534 171.534 174.493 -2.959 18509 7986 1 16 . 1 1 71 71 HIS CA C 71 52.549 52.549 58.185 -5.636 18509 7987 1 16 . 1 1 71 71 HIS H H 71 7.152 7.152 9.087 -1.935 18509 7988 1 16 . 1 1 72 72 GLY N N 72 112.910 112.910 107.227 5.683 18509 7989 1 16 . 1 1 72 72 GLY C C 72 168.634 168.634 172.847 -4.213 18509 7990 1 16 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.795 -3.521 18509 7991 1 16 . 1 1 72 72 GLY H H 72 7.209 7.209 7.659 -0.450 18509 7992 1 16 . 1 1 73 73 GLY N N 73 105.207 105.207 107.499 -2.292 18509 7993 1 16 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.075 -2.853 18509 7994 1 16 . 1 1 73 73 GLY H H 73 8.789 8.789 8.086 0.703 18509 7995 1 16 . 1 1 74 74 PRO C C 74 175.753 175.753 176.333 -0.580 18509 7996 1 16 . 1 1 75 75 LYS N N 75 114.868 114.868 113.268 1.600 18509 7997 1 16 . 1 1 75 75 LYS C C 75 173.640 173.640 174.747 -1.107 18509 7998 1 16 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.846 -5.743 18509 7999 1 16 . 1 1 75 75 LYS H H 75 8.651 8.651 7.856 0.795 18509 8000 1 16 . 1 1 76 76 ASP N N 76 120.414 120.414 114.821 5.593 18509 8001 1 16 . 1 1 76 76 ASP C C 76 172.557 172.557 174.892 -2.335 18509 8002 1 16 . 1 1 76 76 ASP CA C 76 51.309 51.309 53.644 -2.335 18509 8003 1 16 . 1 1 76 76 ASP H H 76 7.461 7.461 7.496 -0.035 18509 8004 1 16 . 1 1 77 77 GLU N N 77 120.820 120.820 119.834 0.986 18509 8005 1 16 . 1 1 77 77 GLU C C 77 174.101 174.101 175.553 -1.452 18509 8006 1 16 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.968 -2.455 18509 8007 1 16 . 1 1 77 77 GLU H H 77 8.315 8.315 8.653 -0.338 18509 8008 1 16 . 1 1 78 78 GLU N N 78 119.251 119.251 118.456 0.795 18509 8009 1 16 . 1 1 78 78 GLU C C 78 168.285 168.285 175.163 -6.878 18509 8010 1 16 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.306 -5.228 18509 8011 1 16 . 1 1 78 78 GLU H H 78 8.109 8.109 8.563 -0.454 18509 8012 1 16 . 1 1 79 79 ARG N N 79 118.991 118.991 119.981 -0.990 18509 8013 1 16 . 1 1 79 79 ARG C C 79 172.123 172.123 175.297 -3.174 18509 8014 1 16 . 1 1 79 79 ARG CA C 79 51.074 51.074 54.358 -3.284 18509 8015 1 16 . 1 1 79 79 ARG H H 79 6.999 6.999 8.190 -1.191 18509 8016 1 16 . 1 1 80 80 HIS N N 80 118.000 118.000 122.994 -4.994 18509 8017 1 16 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.575 -6.622 18509 8018 1 16 . 1 1 80 80 HIS H H 80 8.355 8.355 8.479 -0.124 18509 8019 1 16 . 1 1 81 81 VAL C C 81 173.460 173.460 176.028 -2.568 18509 8020 1 16 . 1 1 82 82 GLY N N 82 97.322 97.322 108.421 -11.099 18509 8021 1 16 . 1 1 82 82 GLY C C 82 170.370 170.370 172.967 -2.597 18509 8022 1 16 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.696 -3.007 18509 8023 1 16 . 1 1 82 82 GLY H H 82 8.487 8.487 7.697 0.790 18509 8024 1 16 . 1 1 83 83 ASP N N 83 120.890 120.890 118.505 2.385 18509 8025 1 16 . 1 1 83 83 ASP C C 83 168.737 168.737 173.515 -4.778 18509 8026 1 16 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.742 -0.824 18509 8027 1 16 . 1 1 83 83 ASP H H 83 7.127 7.127 7.357 -0.230 18509 8028 1 16 . 1 1 84 84 LEU N N 84 120.154 120.154 120.676 -0.522 18509 8029 1 16 . 1 1 84 84 LEU C C 84 173.212 173.212 174.102 -0.890 18509 8030 1 16 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.174 -3.741 18509 8031 1 16 . 1 1 84 84 LEU H H 84 7.128 7.128 7.912 -0.784 18509 8032 1 16 . 1 1 85 85 GLY N N 85 106.867 106.867 107.854 -0.987 18509 8033 1 16 . 1 1 85 85 GLY C C 85 167.654 167.654 172.172 -4.518 18509 8034 1 16 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.164 -2.153 18509 8035 1 16 . 1 1 85 85 GLY H H 85 8.260 8.260 7.774 0.486 18509 8036 1 16 . 1 1 86 86 ASN N N 86 117.454 117.454 119.009 -1.555 18509 8037 1 16 . 1 1 86 86 ASN C C 86 173.942 173.942 174.069 -0.127 18509 8038 1 16 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.226 -2.960 18509 8039 1 16 . 1 1 86 86 ASN H H 86 8.041 8.041 8.343 -0.302 18509 8040 1 16 . 1 1 87 87 VAL N N 87 113.370 113.370 123.869 -10.499 18509 8041 1 16 . 1 1 87 87 VAL C C 87 171.526 171.526 174.665 -3.139 18509 8042 1 16 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.089 -4.380 18509 8043 1 16 . 1 1 87 87 VAL H H 87 8.960 8.960 8.303 0.657 18509 8044 1 16 . 1 1 88 88 THR N N 88 117.939 117.939 116.255 1.684 18509 8045 1 16 . 1 1 88 88 THR C C 88 170.367 170.367 172.661 -2.294 18509 8046 1 16 . 1 1 88 88 THR CA C 88 58.694 58.694 59.572 -0.878 18509 8047 1 16 . 1 1 88 88 THR H H 88 8.681 8.681 8.342 0.339 18509 8048 1 16 . 1 1 89 89 ALA N N 89 128.674 128.674 126.014 2.660 18509 8049 1 16 . 1 1 89 89 ALA C C 89 174.480 174.480 175.001 -0.521 18509 8050 1 16 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.605 -4.236 18509 8051 1 16 . 1 1 89 89 ALA H H 89 9.377 9.377 8.173 1.204 18509 8052 1 16 . 1 1 90 90 ASP N N 90 124.235 124.235 118.563 5.672 18509 8053 1 16 . 1 1 90 90 ASP C C 90 173.825 173.825 176.643 -2.818 18509 8054 1 16 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.305 -2.958 18509 8055 1 16 . 1 1 90 90 ASP H H 90 8.455 8.455 8.095 0.360 18509 8056 1 16 . 1 1 91 91 LYS N N 91 114.942 114.942 120.396 -5.454 18509 8057 1 16 . 1 1 91 91 LYS C C 91 174.101 174.101 177.508 -3.407 18509 8058 1 16 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.988 -3.709 18509 8059 1 16 . 1 1 91 91 LYS H H 91 8.231 8.231 8.598 -0.367 18509 8060 1 16 . 1 1 92 92 ASP N N 92 119.251 119.251 118.040 1.211 18509 8061 1 16 . 1 1 92 92 ASP C C 92 173.020 173.020 175.692 -2.672 18509 8062 1 16 . 1 1 92 92 ASP CA C 92 51.127 51.127 54.803 -3.676 18509 8063 1 16 . 1 1 92 92 ASP H H 92 8.109 8.109 8.200 -0.090 18509 8064 1 16 . 1 1 93 93 GLY N N 93 110.868 110.868 108.087 2.781 18509 8065 1 16 . 1 1 93 93 GLY C C 93 169.706 169.706 173.484 -3.778 18509 8066 1 16 . 1 1 93 93 GLY CA C 93 43.763 43.763 44.905 -1.142 18509 8067 1 16 . 1 1 93 93 GLY H H 93 8.405 8.405 7.759 0.646 18509 8068 1 16 . 1 1 94 94 VAL N N 94 118.755 118.755 117.551 1.204 18509 8069 1 16 . 1 1 94 94 VAL C C 94 173.510 173.510 173.904 -0.394 18509 8070 1 16 . 1 1 94 94 VAL CA C 94 58.185 58.185 59.487 -1.302 18509 8071 1 16 . 1 1 94 94 VAL H H 94 7.814 7.814 7.450 0.364 18509 8072 1 16 . 1 1 95 95 ALA N N 95 131.313 131.313 129.831 1.482 18509 8073 1 16 . 1 1 95 95 ALA C C 95 171.635 171.635 176.138 -4.503 18509 8074 1 16 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.597 -3.683 18509 8075 1 16 . 1 1 95 95 ALA H H 95 9.763 9.763 8.342 1.421 18509 8076 1 16 . 1 1 96 96 ASP N N 96 125.170 125.170 121.867 3.303 18509 8077 1 16 . 1 1 96 96 ASP C C 96 172.336 172.336 175.799 -3.463 18509 8078 1 16 . 1 1 96 96 ASP H H 96 8.515 8.515 8.533 -0.018 18509 8079 1 16 . 1 1 97 97 VAL N N 97 125.879 125.879 117.330 8.549 18509 8080 1 16 . 1 1 97 97 VAL C C 97 173.488 173.488 176.096 -2.608 18509 8081 1 16 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.370 -3.127 18509 8082 1 16 . 1 1 97 97 VAL H H 97 8.703 8.703 8.254 0.449 18509 8083 1 16 . 1 1 98 98 SER N N 98 123.017 123.017 121.343 1.674 18509 8084 1 16 . 1 1 98 98 SER C C 98 169.715 169.715 173.933 -4.218 18509 8085 1 16 . 1 1 98 98 SER CA C 98 55.068 55.068 58.742 -3.674 18509 8086 1 16 . 1 1 98 98 SER H H 98 8.784 8.784 8.379 0.405 18509 8087 1 16 . 1 1 99 99 ILE N N 99 125.807 125.807 122.487 3.320 18509 8088 1 16 . 1 1 99 99 ILE C C 99 171.321 171.321 174.911 -3.590 18509 8089 1 16 . 1 1 99 99 ILE CA C 99 57.155 57.155 59.999 -2.844 18509 8090 1 16 . 1 1 99 99 ILE H H 99 9.411 9.411 7.867 1.544 18509 8091 1 16 . 1 1 100 100 GLU N N 100 124.068 124.068 126.455 -2.387 18509 8092 1 16 . 1 1 100 100 GLU C C 100 172.098 172.098 174.584 -2.486 18509 8093 1 16 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.703 -2.413 18509 8094 1 16 . 1 1 100 100 GLU H H 100 8.652 8.652 8.718 -0.066 18509 8095 1 16 . 1 1 101 101 ASP N N 101 126.109 126.109 123.445 2.664 18509 8096 1 16 . 1 1 101 101 ASP C C 101 171.144 171.144 175.047 -3.903 18509 8097 1 16 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.630 -2.211 18509 8098 1 16 . 1 1 101 101 ASP H H 101 9.317 9.317 8.522 0.795 18509 8099 1 16 . 1 1 102 102 SER N N 102 118.470 118.470 118.665 -0.195 18509 8100 1 16 . 1 1 102 102 SER C C 102 171.596 171.596 173.476 -1.880 18509 8101 1 16 . 1 1 102 102 SER CA C 102 55.245 55.245 57.297 -2.052 18509 8102 1 16 . 1 1 102 102 SER H H 102 8.933 8.933 8.218 0.715 18509 8103 1 16 . 1 1 103 103 VAL N N 103 123.179 123.179 124.907 -1.728 18509 8104 1 16 . 1 1 103 103 VAL CA C 103 61.450 61.450 63.504 -2.054 18509 8105 1 16 . 1 1 103 103 VAL H H 103 8.148 8.148 9.375 -1.227 18509 8106 1 16 . 1 1 104 104 ILE C C 104 169.576 169.576 173.466 -3.890 18509 8107 1 16 . 1 1 104 104 ILE CA C 104 60.194 60.194 59.889 0.305 18509 8108 1 16 . 1 1 105 105 SER N N 105 107.618 107.618 117.502 -9.884 18509 8109 1 16 . 1 1 105 105 SER C C 105 170.046 170.046 173.833 -3.787 18509 8110 1 16 . 1 1 105 105 SER CA C 105 52.550 52.550 56.821 -4.271 18509 8111 1 16 . 1 1 105 105 SER H H 105 6.988 6.988 7.943 -0.955 18509 8112 1 16 . 1 1 106 106 LEU N N 106 120.137 120.137 126.489 -6.352 18509 8113 1 16 . 1 1 106 106 LEU H H 106 8.313 8.313 7.871 0.442 18509 8114 1 16 . 1 1 107 107 SER C C 107 170.701 170.701 173.499 -2.798 18509 8115 1 16 . 1 1 107 107 SER CA C 107 54.540 54.540 58.777 -4.237 18509 8116 1 16 . 1 1 108 108 GLY N N 108 107.603 107.603 115.147 -7.544 18509 8117 1 16 . 1 1 108 108 GLY C C 108 173.128 173.128 173.376 -0.248 18509 8118 1 16 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.753 -3.466 18509 8119 1 16 . 1 1 108 108 GLY H H 108 8.717 8.717 7.857 0.860 18509 8120 1 16 . 1 1 109 109 ASP N N 109 120.664 120.664 123.433 -2.769 18509 8121 1 16 . 1 1 109 109 ASP C C 109 171.904 171.904 176.202 -4.298 18509 8122 1 16 . 1 1 109 109 ASP H H 109 9.019 9.019 8.327 0.692 18509 8123 1 16 . 1 1 110 110 HIS N N 110 116.324 116.324 114.557 1.767 18509 8124 1 16 . 1 1 110 110 HIS H H 110 9.283 9.283 8.643 0.640 18509 8125 1 16 . 1 1 111 111 SER N N 111 110.225 110.225 117.635 -7.410 18509 8126 1 16 . 1 1 111 111 SER CA C 111 54.681 54.681 57.728 -3.047 18509 8127 1 16 . 1 1 111 111 SER H H 111 7.156 7.156 8.394 -1.238 18509 8128 1 16 . 1 1 112 112 ILE N N 112 117.053 117.053 125.473 -8.420 18509 8129 1 16 . 1 1 112 112 ILE C C 112 171.419 171.419 176.462 -5.043 18509 8130 1 16 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.438 -4.199 18509 8131 1 16 . 1 1 112 112 ILE H H 112 7.837 7.837 8.013 -0.176 18509 8132 1 16 . 1 1 113 113 ILE N N 113 121.032 121.032 117.560 3.472 18509 8133 1 16 . 1 1 113 113 ILE C C 113 173.604 173.604 175.540 -1.936 18509 8134 1 16 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.694 -2.376 18509 8135 1 16 . 1 1 113 113 ILE H H 113 7.592 7.592 7.763 -0.171 18509 8136 1 16 . 1 1 114 114 GLY N N 114 112.661 112.661 111.660 1.001 18509 8137 1 16 . 1 1 114 114 GLY C C 114 169.739 169.739 173.383 -3.644 18509 8138 1 16 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.327 -3.417 18509 8139 1 16 . 1 1 114 114 GLY H H 114 9.575 9.575 8.605 0.970 18509 8140 1 16 . 1 1 115 115 ARG N N 115 118.398 118.398 120.132 -1.734 18509 8141 1 16 . 1 1 115 115 ARG C C 115 171.079 171.079 174.948 -3.869 18509 8142 1 16 . 1 1 115 115 ARG CA C 115 51.663 51.663 55.534 -3.871 18509 8143 1 16 . 1 1 115 115 ARG H H 115 7.464 7.464 7.759 -0.295 18509 8144 1 16 . 1 1 116 116 THR N N 116 112.218 112.218 117.929 -5.711 18509 8145 1 16 . 1 1 116 116 THR C C 116 169.821 169.821 173.562 -3.741 18509 8146 1 16 . 1 1 116 116 THR CA C 116 59.633 59.633 61.622 -1.989 18509 8147 1 16 . 1 1 116 116 THR H H 116 6.677 6.677 8.317 -1.640 18509 8148 1 16 . 1 1 117 117 LEU N N 117 129.477 129.477 127.623 1.854 18509 8149 1 16 . 1 1 117 117 LEU C C 117 171.126 171.126 174.989 -3.863 18509 8150 1 16 . 1 1 117 117 LEU CA C 117 50.415 50.415 53.909 -3.494 18509 8151 1 16 . 1 1 117 117 LEU H H 117 8.799 8.799 8.941 -0.142 18509 8152 1 16 . 1 1 118 118 VAL N N 118 125.091 125.091 120.440 4.651 18509 8153 1 16 . 1 1 118 118 VAL C C 118 170.267 170.267 174.420 -4.153 18509 8154 1 16 . 1 1 118 118 VAL CA C 118 58.139 58.139 60.847 -2.708 18509 8155 1 16 . 1 1 118 118 VAL H H 118 8.906 8.906 8.373 0.533 18509 8156 1 16 . 1 1 119 119 VAL N N 119 120.716 120.716 124.526 -3.810 18509 8157 1 16 . 1 1 119 119 VAL C C 119 171.175 171.175 173.753 -2.578 18509 8158 1 16 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.883 -4.612 18509 8159 1 16 . 1 1 119 119 VAL H H 119 7.982 7.982 8.016 -0.034 18509 8160 1 16 . 1 1 120 120 HIS N N 120 125.052 125.052 119.066 5.986 18509 8161 1 16 . 1 1 120 120 HIS C C 120 172.599 172.599 173.981 -1.382 18509 8162 1 16 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.422 -2.027 18509 8163 1 16 . 1 1 120 120 HIS H H 120 8.935 8.935 8.574 0.361 18509 8164 1 16 . 1 1 121 121 GLU N N 121 121.453 121.453 121.566 -0.113 18509 8165 1 16 . 1 1 121 121 GLU C C 121 172.304 172.304 175.481 -3.177 18509 8166 1 16 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.285 -0.195 18509 8167 1 16 . 1 1 121 121 GLU H H 121 9.178 9.178 8.132 1.046 18509 8168 1 16 . 1 1 122 122 LYS N N 122 115.248 115.248 122.894 -7.646 18509 8169 1 16 . 1 1 122 122 LYS C C 122 171.523 171.523 174.923 -3.400 18509 8170 1 16 . 1 1 122 122 LYS CA C 122 50.619 50.619 56.093 -5.474 18509 8171 1 16 . 1 1 122 122 LYS H H 122 8.478 8.478 8.006 0.472 18509 8172 1 16 . 1 1 123 123 ALA N N 123 120.866 120.866 126.927 -6.061 18509 8173 1 16 . 1 1 123 123 ALA C C 123 173.219 173.219 176.949 -3.730 18509 8174 1 16 . 1 1 123 123 ALA CA C 123 48.850 48.850 53.139 -4.289 18509 8175 1 16 . 1 1 123 123 ALA H H 123 7.796 7.796 8.759 -0.963 18509 8176 1 16 . 1 1 124 124 ASP N N 124 121.799 121.799 124.267 -2.468 18509 8177 1 16 . 1 1 124 124 ASP C C 124 174.458 174.458 175.640 -1.182 18509 8178 1 16 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.319 -3.911 18509 8179 1 16 . 1 1 124 124 ASP H H 124 10.165 10.165 8.020 2.145 18509 8180 1 16 . 1 1 125 125 ASP N N 125 129.369 129.369 121.895 7.474 18509 8181 1 16 . 1 1 125 125 ASP C C 125 175.231 175.231 175.957 -0.726 18509 8182 1 16 . 1 1 125 125 ASP CA C 125 50.939 50.939 55.868 -4.929 18509 8183 1 16 . 1 1 125 125 ASP H H 125 10.055 10.055 7.729 2.326 18509 8184 1 16 . 1 1 126 126 LEU N N 126 117.190 117.190 126.433 -9.243 18509 8185 1 16 . 1 1 126 126 LEU C C 126 173.964 173.964 178.768 -4.804 18509 8186 1 16 . 1 1 126 126 LEU H H 126 10.483 10.483 8.207 2.276 18509 8187 1 16 . 1 1 127 127 GLY N N 127 103.809 103.809 106.779 -2.970 18509 8188 1 16 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.425 -3.547 18509 8189 1 16 . 1 1 127 127 GLY H H 127 8.637 8.637 8.009 0.628 18509 8190 1 16 . 1 1 128 128 LYS N N 128 118.290 118.290 120.050 -1.760 18509 8191 1 16 . 1 1 128 128 LYS CA C 128 51.740 51.740 56.823 -5.083 18509 8192 1 16 . 1 1 128 128 LYS H H 128 7.158 7.158 8.495 -1.337 18509 8193 1 16 . 1 1 129 129 GLY N N 129 108.507 108.507 107.739 0.768 18509 8194 1 16 . 1 1 129 129 GLY C C 129 171.524 171.524 174.761 -3.237 18509 8195 1 16 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.342 -4.229 18509 8196 1 16 . 1 1 129 129 GLY H H 129 8.913 8.913 7.988 0.925 18509 8197 1 16 . 1 1 130 130 GLY N N 130 108.537 108.537 110.468 -1.931 18509 8198 1 16 . 1 1 130 130 GLY C C 130 169.994 169.994 173.179 -3.185 18509 8199 1 16 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.733 -2.314 18509 8200 1 16 . 1 1 130 130 GLY H H 130 8.723 8.723 8.409 0.314 18509 8201 1 16 . 1 1 131 131 ASN N N 131 111.951 111.951 117.301 -5.350 18509 8202 1 16 . 1 1 131 131 ASN C C 131 172.236 172.236 174.300 -2.064 18509 8203 1 16 . 1 1 131 131 ASN H H 131 7.152 7.152 7.757 -0.605 18509 8204 1 16 . 1 1 132 132 GLU N N 132 120.461 120.461 121.973 -1.512 18509 8205 1 16 . 1 1 132 132 GLU C C 132 171.084 171.084 177.759 -6.675 18509 8206 1 16 . 1 1 132 132 GLU H H 132 8.935 8.935 8.819 0.116 18509 8207 1 16 . 1 1 133 133 GLU N N 133 120.137 120.137 118.633 1.504 18509 8208 1 16 . 1 1 133 133 GLU C C 133 176.239 176.239 178.732 -2.493 18509 8209 1 16 . 1 1 133 133 GLU H H 133 8.775 8.775 8.462 0.313 18509 8210 1 16 . 1 1 134 134 SER N N 134 114.981 114.981 113.945 1.036 18509 8211 1 16 . 1 1 134 134 SER CA C 134 59.046 59.046 61.877 -2.831 18509 8212 1 16 . 1 1 134 134 SER H H 134 8.117 8.117 8.424 -0.307 18509 8213 1 16 . 1 1 135 135 THR N N 135 102.263 102.263 117.751 -15.488 18509 8214 1 16 . 1 1 135 135 THR C C 135 172.804 172.804 175.695 -2.891 18509 8215 1 16 . 1 1 135 135 THR CA C 135 60.029 60.029 65.697 -5.668 18509 8216 1 16 . 1 1 135 135 THR H H 135 7.206 7.206 7.972 -0.766 18509 8217 1 16 . 1 1 136 136 LYS N N 136 122.108 122.108 120.285 1.823 18509 8218 1 16 . 1 1 136 136 LYS H H 136 7.884 7.884 7.670 0.214 18509 8219 1 16 . 1 1 137 137 THR N N 137 105.718 105.718 110.734 -5.016 18509 8220 1 16 . 1 1 137 137 THR H H 137 8.630 8.630 8.293 0.337 18509 8221 1 16 . 1 1 138 138 GLY N N 138 111.372 111.372 110.847 0.525 18509 8222 1 16 . 1 1 138 138 GLY CA C 138 42.483 42.483 44.280 -1.797 18509 8223 1 16 . 1 1 138 138 GLY H H 138 7.426 7.426 7.666 -0.240 18509 8224 1 16 . 1 1 139 139 ASN N N 139 107.496 107.496 121.503 -14.007 18509 8225 1 16 . 1 1 139 139 ASN H H 139 7.545 7.545 8.037 -0.492 18509 8226 1 16 . 1 1 140 140 ALA N N 140 114.542 114.542 126.239 -11.697 18509 8227 1 16 . 1 1 140 140 ALA C C 140 173.571 173.571 176.805 -3.234 18509 8228 1 16 . 1 1 140 140 ALA H H 140 6.368 6.368 7.849 -1.481 18509 8229 1 16 . 1 1 141 141 GLY N N 141 105.287 105.287 109.009 -3.722 18509 8230 1 16 . 1 1 141 141 GLY C C 141 173.542 173.542 175.068 -1.526 18509 8231 1 16 . 1 1 141 141 GLY H H 141 8.271 8.271 8.893 -0.622 18509 8232 1 16 . 1 1 142 142 SER N N 142 118.771 118.771 118.986 -0.215 18509 8233 1 16 . 1 1 142 142 SER C C 142 170.188 170.188 174.180 -3.992 18509 8234 1 16 . 1 1 142 142 SER H H 142 9.196 9.196 8.224 0.972 18509 8235 1 16 . 1 1 143 143 ARG N N 143 120.189 120.189 113.116 7.073 18509 8236 1 16 . 1 1 143 143 ARG C C 143 171.596 171.596 176.346 -4.750 18509 8237 1 16 . 1 1 143 143 ARG H H 143 8.943 8.943 7.586 1.357 18509 8238 1 16 . 1 1 144 144 LEU N N 144 122.907 122.907 121.519 1.388 18509 8239 1 16 . 1 1 144 144 LEU C C 144 174.393 174.393 175.860 -1.467 18509 8240 1 16 . 1 1 144 144 LEU CA C 144 53.375 53.375 55.271 -1.896 18509 8241 1 16 . 1 1 144 144 LEU H H 144 8.395 8.395 8.185 0.210 18509 8242 1 16 . 1 1 145 145 ALA N N 145 114.159 114.159 117.631 -3.472 18509 8243 1 16 . 1 1 145 145 ALA C C 145 171.752 171.752 174.820 -3.068 18509 8244 1 16 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.662 -3.533 18509 8245 1 16 . 1 1 145 145 ALA H H 145 7.356 7.356 7.674 -0.318 18509 8246 1 16 . 1 1 146 146 CYS N N 146 110.738 110.738 122.227 -11.489 18509 8247 1 16 . 1 1 146 146 CYS C C 146 170.087 170.087 174.392 -4.305 18509 8248 1 16 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.871 -6.794 18509 8249 1 16 . 1 1 146 146 CYS H H 146 9.008 9.008 8.131 0.877 18509 8250 1 16 . 1 1 147 147 GLY N N 147 106.461 106.461 110.962 -4.501 18509 8251 1 16 . 1 1 147 147 GLY C C 147 167.909 167.909 172.176 -4.267 18509 8252 1 16 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.561 -2.887 18509 8253 1 16 . 1 1 147 147 GLY H H 147 8.018 8.018 8.331 -0.313 18509 8254 1 16 . 1 1 148 148 VAL N N 148 124.054 124.054 127.687 -3.633 18509 8255 1 16 . 1 1 148 148 VAL C C 148 172.084 172.084 175.773 -3.689 18509 8256 1 16 . 1 1 148 148 VAL CA C 148 59.635 59.635 63.500 -3.865 18509 8257 1 16 . 1 1 148 148 VAL H H 148 8.434 8.434 8.137 0.297 18509 8258 1 16 . 1 1 149 149 ILE N N 149 126.918 126.918 127.874 -0.956 18509 8259 1 16 . 1 1 149 149 ILE C C 149 171.804 171.804 175.076 -3.272 18509 8260 1 16 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.786 -0.602 18509 8261 1 16 . 1 1 149 149 ILE H H 149 8.613 8.613 7.966 0.647 18509 8262 1 16 . 1 1 150 150 GLY N N 150 116.493 116.493 113.198 3.295 18509 8263 1 16 . 1 1 150 150 GLY C C 150 170.188 170.188 172.301 -2.113 18509 8264 1 16 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.973 -4.853 18509 8265 1 16 . 1 1 150 150 GLY H H 150 9.283 9.283 8.182 1.101 18509 8266 1 16 . 1 1 151 151 ILE N N 151 120.189 120.189 119.104 1.085 18509 8267 1 16 . 1 1 151 151 ILE C C 151 172.231 172.231 175.043 -2.812 18509 8268 1 16 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.279 -0.907 18509 8269 1 16 . 1 1 151 151 ILE H H 151 8.943 8.943 8.436 0.507 18509 8270 1 16 . 1 1 152 152 ALA N N 152 129.719 129.719 130.897 -1.178 18509 8271 1 16 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.230 -4.458 18509 8272 1 16 . 1 1 152 152 ALA H H 152 8.170 8.170 8.215 -0.045 18509 8273 1 17 . 1 1 2 2 THR C C 2 170.139 170.139 173.453 -3.314 18509 8274 1 17 . 1 1 3 3 LYS N N 3 123.998 123.998 117.908 6.090 18509 8275 1 17 . 1 1 3 3 LYS C C 3 171.607 171.607 173.984 -2.377 18509 8276 1 17 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.959 -3.781 18509 8277 1 17 . 1 1 3 3 LYS H H 3 8.666 8.666 7.772 0.894 18509 8278 1 17 . 1 1 4 4 ALA N N 4 123.295 123.295 121.775 1.520 18509 8279 1 17 . 1 1 4 4 ALA C C 4 172.145 172.145 175.279 -3.134 18509 8280 1 17 . 1 1 4 4 ALA CA C 4 47.504 47.504 51.023 -3.519 18509 8281 1 17 . 1 1 4 4 ALA H H 4 9.116 9.116 8.376 0.740 18509 8282 1 17 . 1 1 5 5 VAL N N 5 121.466 121.466 116.281 5.185 18509 8283 1 17 . 1 1 5 5 VAL C C 5 167.836 167.836 173.838 -6.002 18509 8284 1 17 . 1 1 5 5 VAL CA C 5 56.875 56.875 59.672 -2.797 18509 8285 1 17 . 1 1 5 5 VAL H H 5 9.545 9.545 8.287 1.258 18509 8286 1 17 . 1 1 6 6 ALA N N 6 125.984 125.984 127.027 -1.043 18509 8287 1 17 . 1 1 6 6 ALA C C 6 171.607 171.607 176.561 -4.954 18509 8288 1 17 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.086 -2.615 18509 8289 1 17 . 1 1 6 6 ALA H H 6 9.177 9.177 8.293 0.884 18509 8290 1 17 . 1 1 7 7 VAL N N 7 123.600 123.600 120.070 3.530 18509 8291 1 17 . 1 1 7 7 VAL C C 7 172.244 172.244 174.071 -1.827 18509 8292 1 17 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.764 -2.288 18509 8293 1 17 . 1 1 7 7 VAL H H 7 9.116 9.116 7.976 1.140 18509 8294 1 17 . 1 1 8 8 LEU N N 8 126.455 126.455 122.393 4.062 18509 8295 1 17 . 1 1 8 8 LEU C C 8 172.557 172.557 175.495 -2.938 18509 8296 1 17 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.244 -2.192 18509 8297 1 17 . 1 1 8 8 LEU H H 8 8.916 8.916 8.319 0.597 18509 8298 1 17 . 1 1 9 9 LYS N N 9 120.820 120.820 119.646 1.174 18509 8299 1 17 . 1 1 9 9 LYS C C 9 172.509 172.509 174.886 -2.377 18509 8300 1 17 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.830 -3.933 18509 8301 1 17 . 1 1 9 9 LYS H H 9 8.315 8.315 7.753 0.562 18509 8302 1 17 . 1 1 10 10 GLY N N 10 111.249 111.249 110.068 1.181 18509 8303 1 17 . 1 1 10 10 GLY C C 10 169.847 169.847 173.032 -3.185 18509 8304 1 17 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.197 -2.922 18509 8305 1 17 . 1 1 10 10 GLY H H 10 8.968 8.968 8.053 0.915 18509 8306 1 17 . 1 1 11 11 ASP N N 11 120.904 120.904 120.928 -0.024 18509 8307 1 17 . 1 1 11 11 ASP C C 11 173.132 173.132 177.356 -4.224 18509 8308 1 17 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.755 -4.438 18509 8309 1 17 . 1 1 11 11 ASP H H 11 8.745 8.745 8.548 0.197 18509 8310 1 17 . 1 1 12 12 GLY N N 12 109.862 109.862 108.694 1.168 18509 8311 1 17 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.618 -2.418 18509 8312 1 17 . 1 1 12 12 GLY H H 12 7.985 7.985 8.296 -0.311 18509 8313 1 17 . 1 1 13 13 PRO C C 13 173.640 173.640 175.533 -1.893 18509 8314 1 17 . 1 1 14 14 VAL N N 14 120.414 120.414 119.811 0.603 18509 8315 1 17 . 1 1 14 14 VAL C C 14 172.804 172.804 174.722 -1.918 18509 8316 1 17 . 1 1 14 14 VAL CA C 14 59.884 59.884 59.666 0.218 18509 8317 1 17 . 1 1 14 14 VAL H H 14 7.476 7.476 8.168 -0.692 18509 8318 1 17 . 1 1 15 15 GLN N N 15 122.664 122.664 124.847 -2.183 18509 8319 1 17 . 1 1 15 15 GLN C C 15 171.168 171.168 174.884 -3.716 18509 8320 1 17 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.830 -4.151 18509 8321 1 17 . 1 1 15 15 GLN H H 15 7.938 7.938 8.598 -0.660 18509 8322 1 17 . 1 1 16 16 GLY N N 16 107.018 107.018 109.498 -2.480 18509 8323 1 17 . 1 1 16 16 GLY C C 16 167.726 167.726 171.480 -3.754 18509 8324 1 17 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.141 -1.516 18509 8325 1 17 . 1 1 16 16 GLY H H 16 8.288 8.288 8.437 -0.149 18509 8326 1 17 . 1 1 17 17 ILE N N 17 120.248 120.248 119.766 0.482 18509 8327 1 17 . 1 1 17 17 ILE C C 17 171.194 171.194 172.997 -1.803 18509 8328 1 17 . 1 1 17 17 ILE CA C 17 58.497 58.497 60.466 -1.969 18509 8329 1 17 . 1 1 17 17 ILE H H 17 7.948 7.948 7.891 0.057 18509 8330 1 17 . 1 1 18 18 ILE N N 18 125.851 125.851 127.435 -1.584 18509 8331 1 17 . 1 1 18 18 ILE C C 18 168.889 168.889 173.753 -4.864 18509 8332 1 17 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.142 -5.711 18509 8333 1 17 . 1 1 18 18 ILE H H 18 8.725 8.725 8.016 0.709 18509 8334 1 17 . 1 1 19 19 ASN N N 19 123.256 123.256 122.073 1.183 18509 8335 1 17 . 1 1 19 19 ASN C C 19 168.903 168.903 173.026 -4.123 18509 8336 1 17 . 1 1 19 19 ASN CA C 19 49.088 49.088 50.763 -1.675 18509 8337 1 17 . 1 1 19 19 ASN H H 19 8.727 8.727 7.956 0.771 18509 8338 1 17 . 1 1 20 20 PHE N N 20 113.849 113.849 120.331 -6.482 18509 8339 1 17 . 1 1 20 20 PHE C C 20 173.219 173.219 175.021 -1.802 18509 8340 1 17 . 1 1 20 20 PHE CA C 20 52.058 52.058 56.668 -4.610 18509 8341 1 17 . 1 1 20 20 PHE H H 20 8.399 8.399 8.656 -0.257 18509 8342 1 17 . 1 1 21 21 GLU N N 21 121.454 121.454 122.899 -1.445 18509 8343 1 17 . 1 1 21 21 GLU C C 21 170.280 170.280 175.926 -5.646 18509 8344 1 17 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.584 -1.540 18509 8345 1 17 . 1 1 21 21 GLU H H 21 9.526 9.526 8.835 0.691 18509 8346 1 17 . 1 1 22 22 GLN N N 22 130.340 130.340 124.928 5.412 18509 8347 1 17 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.575 -3.395 18509 8348 1 17 . 1 1 22 22 GLN H H 22 9.305 9.305 8.840 0.465 18509 8349 1 17 . 1 1 23 23 LYS N N 23 128.657 128.657 126.456 2.201 18509 8350 1 17 . 1 1 23 23 LYS CA C 23 57.241 57.241 56.405 0.836 18509 8351 1 17 . 1 1 23 23 LYS H H 23 9.088 9.088 7.986 1.102 18509 8352 1 17 . 1 1 24 24 GLU CA C 24 51.392 51.392 59.078 -7.686 18509 8353 1 17 . 1 1 25 25 SER CA C 25 58.078 58.078 60.472 -2.394 18509 8354 1 17 . 1 1 27 27 GLY N N 27 108.125 108.125 105.798 2.327 18509 8355 1 17 . 1 1 27 27 GLY CA C 27 42.925 42.925 45.330 -2.405 18509 8356 1 17 . 1 1 27 27 GLY H H 27 8.032 8.032 8.491 -0.459 18509 8357 1 17 . 1 1 28 28 PRO C C 28 173.128 173.128 175.944 -2.816 18509 8358 1 17 . 1 1 29 29 VAL N N 29 121.267 121.267 119.696 1.571 18509 8359 1 17 . 1 1 29 29 VAL C C 29 172.198 172.198 175.094 -2.896 18509 8360 1 17 . 1 1 29 29 VAL CA C 29 57.720 57.720 60.067 -2.347 18509 8361 1 17 . 1 1 29 29 VAL H H 29 9.089 9.089 8.250 0.839 18509 8362 1 17 . 1 1 30 30 LYS N N 30 127.589 127.589 129.362 -1.773 18509 8363 1 17 . 1 1 30 30 LYS C C 30 172.098 172.098 175.148 -3.050 18509 8364 1 17 . 1 1 30 30 LYS CA C 30 52.642 52.642 56.239 -3.597 18509 8365 1 17 . 1 1 30 30 LYS H H 30 9.200 9.200 8.549 0.651 18509 8366 1 17 . 1 1 31 31 VAL N N 31 126.037 126.037 120.083 5.954 18509 8367 1 17 . 1 1 31 31 VAL C C 31 172.244 172.244 174.417 -2.173 18509 8368 1 17 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.226 -2.087 18509 8369 1 17 . 1 1 31 31 VAL H H 31 9.282 9.282 7.857 1.425 18509 8370 1 17 . 1 1 32 32 TRP N N 32 125.414 125.414 122.387 3.027 18509 8371 1 17 . 1 1 32 32 TRP C C 32 170.156 170.156 174.047 -3.891 18509 8372 1 17 . 1 1 32 32 TRP CA C 32 53.137 53.137 55.115 -1.978 18509 8373 1 17 . 1 1 32 32 TRP H H 32 8.983 8.983 7.619 1.364 18509 8374 1 17 . 1 1 33 33 GLY N N 33 107.848 107.848 108.892 -1.044 18509 8375 1 17 . 1 1 33 33 GLY C C 33 168.400 168.400 172.101 -3.701 18509 8376 1 17 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.139 -3.572 18509 8377 1 17 . 1 1 33 33 GLY H H 33 8.360 8.360 8.383 -0.023 18509 8378 1 17 . 1 1 34 34 SER N N 34 114.377 114.377 118.109 -3.732 18509 8379 1 17 . 1 1 34 34 SER C C 34 169.618 169.618 173.570 -3.952 18509 8380 1 17 . 1 1 34 34 SER CA C 34 53.875 53.875 56.276 -2.401 18509 8381 1 17 . 1 1 34 34 SER H H 34 7.838 7.838 8.221 -0.383 18509 8382 1 17 . 1 1 35 35 ILE N N 35 123.149 123.149 123.012 0.137 18509 8383 1 17 . 1 1 35 35 ILE C C 35 169.713 169.713 174.340 -4.627 18509 8384 1 17 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.421 -2.652 18509 8385 1 17 . 1 1 35 35 ILE H H 35 8.496 8.496 8.810 -0.314 18509 8386 1 17 . 1 1 36 36 LYS N N 36 123.803 123.803 127.404 -3.601 18509 8387 1 17 . 1 1 36 36 LYS C C 36 172.260 172.260 174.994 -2.734 18509 8388 1 17 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.588 -3.438 18509 8389 1 17 . 1 1 36 36 LYS H H 36 9.091 9.091 8.815 0.276 18509 8390 1 17 . 1 1 37 37 GLY N N 37 105.495 105.495 110.885 -5.390 18509 8391 1 17 . 1 1 37 37 GLY C C 37 171.641 171.641 172.051 -0.410 18509 8392 1 17 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.596 -2.235 18509 8393 1 17 . 1 1 37 37 GLY H H 37 8.237 8.237 8.199 0.038 18509 8394 1 17 . 1 1 38 38 LEU N N 38 120.966 120.966 119.120 1.846 18509 8395 1 17 . 1 1 38 38 LEU C C 38 174.112 174.112 176.121 -2.009 18509 8396 1 17 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.954 -4.483 18509 8397 1 17 . 1 1 38 38 LEU H H 38 8.156 8.156 9.233 -1.077 18509 8398 1 17 . 1 1 39 39 THR N N 39 110.363 110.363 118.985 -8.622 18509 8399 1 17 . 1 1 39 39 THR C C 39 173.102 173.102 173.887 -0.785 18509 8400 1 17 . 1 1 39 39 THR CA C 39 58.194 58.194 63.062 -4.868 18509 8401 1 17 . 1 1 39 39 THR H H 39 8.660 8.660 8.399 0.261 18509 8402 1 17 . 1 1 40 40 GLU N N 40 125.818 125.818 126.739 -0.921 18509 8403 1 17 . 1 1 40 40 GLU C C 40 173.134 173.134 174.243 -1.109 18509 8404 1 17 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.358 -2.002 18509 8405 1 17 . 1 1 40 40 GLU H H 40 8.804 8.804 7.933 0.871 18509 8406 1 17 . 1 1 41 41 GLY N N 41 113.875 113.875 111.144 2.731 18509 8407 1 17 . 1 1 41 41 GLY C C 41 170.046 170.046 173.475 -3.429 18509 8408 1 17 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.112 -5.059 18509 8409 1 17 . 1 1 41 41 GLY H H 41 8.763 8.763 8.312 0.451 18509 8410 1 17 . 1 1 42 42 LEU N N 42 120.137 120.137 126.043 -5.906 18509 8411 1 17 . 1 1 42 42 LEU C C 42 174.218 174.218 176.414 -2.196 18509 8412 1 17 . 1 1 42 42 LEU CA C 42 52.155 52.155 55.276 -3.121 18509 8413 1 17 . 1 1 42 42 LEU H H 42 8.313 8.313 8.638 -0.325 18509 8414 1 17 . 1 1 43 43 HIS N N 43 114.385 114.385 110.355 4.030 18509 8415 1 17 . 1 1 43 43 HIS C C 43 171.504 171.504 173.942 -2.438 18509 8416 1 17 . 1 1 43 43 HIS CA C 43 50.985 50.985 54.807 -3.822 18509 8417 1 17 . 1 1 43 43 HIS H H 43 8.712 8.712 7.477 1.235 18509 8418 1 17 . 1 1 44 44 GLY N N 44 108.872 108.872 108.453 0.419 18509 8419 1 17 . 1 1 44 44 GLY C C 44 168.656 168.656 172.530 -3.874 18509 8420 1 17 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.555 -1.360 18509 8421 1 17 . 1 1 44 44 GLY H H 44 8.875 8.875 8.453 0.422 18509 8422 1 17 . 1 1 45 45 PHE N N 45 126.439 126.439 120.239 6.200 18509 8423 1 17 . 1 1 45 45 PHE CA C 45 53.098 53.098 55.009 -1.911 18509 8424 1 17 . 1 1 45 45 PHE H H 45 8.111 8.111 7.796 0.315 18509 8425 1 17 . 1 1 46 46 HIS N N 46 115.353 115.353 125.103 -9.750 18509 8426 1 17 . 1 1 46 46 HIS C C 46 172.415 172.415 173.121 -0.706 18509 8427 1 17 . 1 1 46 46 HIS CA C 46 49.206 49.206 56.842 -7.636 18509 8428 1 17 . 1 1 46 46 HIS H H 46 8.107 8.107 8.863 -0.756 18509 8429 1 17 . 1 1 47 47 VAL N N 47 120.548 120.548 127.021 -6.473 18509 8430 1 17 . 1 1 47 47 VAL C C 47 173.900 173.900 173.954 -0.054 18509 8431 1 17 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.760 -2.968 18509 8432 1 17 . 1 1 47 47 VAL H H 47 9.366 9.366 8.898 0.468 18509 8433 1 17 . 1 1 48 48 HIS N N 48 129.236 129.236 123.942 5.294 18509 8434 1 17 . 1 1 48 48 HIS C C 48 171.084 171.084 172.656 -1.572 18509 8435 1 17 . 1 1 48 48 HIS CA C 48 52.756 52.756 55.563 -2.807 18509 8436 1 17 . 1 1 48 48 HIS H H 48 10.210 10.210 8.520 1.690 18509 8437 1 17 . 1 1 49 49 GLU N N 49 118.119 118.119 122.753 -4.634 18509 8438 1 17 . 1 1 49 49 GLU C C 49 171.635 171.635 175.656 -4.021 18509 8439 1 17 . 1 1 49 49 GLU CA C 49 57.759 57.759 54.107 3.652 18509 8440 1 17 . 1 1 49 49 GLU H H 49 8.492 8.492 8.289 0.203 18509 8441 1 17 . 1 1 50 50 PHE N N 50 110.329 110.329 118.209 -7.880 18509 8442 1 17 . 1 1 50 50 PHE C C 50 175.252 175.252 176.664 -1.412 18509 8443 1 17 . 1 1 50 50 PHE CA C 50 52.900 52.900 57.316 -4.416 18509 8444 1 17 . 1 1 50 50 PHE H H 50 8.580 8.580 7.793 0.787 18509 8445 1 17 . 1 1 51 51 GLY N N 51 119.251 119.251 106.992 12.259 18509 8446 1 17 . 1 1 51 51 GLY C C 51 168.248 168.248 173.590 -5.342 18509 8447 1 17 . 1 1 51 51 GLY H H 51 10.208 10.208 8.699 1.509 18509 8448 1 17 . 1 1 52 52 ASP N N 52 114.958 114.958 124.526 -9.568 18509 8449 1 17 . 1 1 52 52 ASP CA C 52 48.891 48.891 52.410 -3.519 18509 8450 1 17 . 1 1 52 52 ASP H H 52 5.834 5.834 7.812 -1.978 18509 8451 1 17 . 1 1 53 53 ASN N N 53 128.224 128.224 118.128 10.096 18509 8452 1 17 . 1 1 53 53 ASN CA C 53 48.233 48.233 53.123 -4.890 18509 8453 1 17 . 1 1 53 53 ASN H H 53 9.360 9.360 8.353 1.007 18509 8454 1 17 . 1 1 54 54 THR C C 54 168.656 168.656 174.401 -5.745 18509 8455 1 17 . 1 1 55 55 ALA N N 55 126.661 126.661 121.765 4.896 18509 8456 1 17 . 1 1 55 55 ALA C C 55 174.185 174.185 175.741 -1.556 18509 8457 1 17 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.033 -4.878 18509 8458 1 17 . 1 1 55 55 ALA H H 55 8.390 8.390 7.404 0.986 18509 8459 1 17 . 1 1 56 56 GLY N N 56 107.903 107.903 106.516 1.387 18509 8460 1 17 . 1 1 56 56 GLY C C 56 171.578 171.578 172.419 -0.841 18509 8461 1 17 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.839 -3.259 18509 8462 1 17 . 1 1 56 56 GLY H H 56 7.282 7.282 7.865 -0.583 18509 8463 1 17 . 1 1 57 57 CYS N N 57 117.952 117.952 123.286 -5.334 18509 8464 1 17 . 1 1 57 57 CYS C C 57 175.209 175.209 175.537 -0.328 18509 8465 1 17 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.310 -7.222 18509 8466 1 17 . 1 1 57 57 CYS H H 57 8.900 8.900 8.372 0.528 18509 8467 1 17 . 1 1 58 58 THR N N 58 119.852 119.852 121.912 -2.060 18509 8468 1 17 . 1 1 58 58 THR CA C 58 58.239 58.239 65.326 -7.087 18509 8469 1 17 . 1 1 58 58 THR H H 58 8.505 8.505 9.154 -0.649 18509 8470 1 17 . 1 1 59 59 SER C C 59 170.763 170.763 174.901 -4.138 18509 8471 1 17 . 1 1 59 59 SER CA C 59 55.609 55.609 60.632 -5.023 18509 8472 1 17 . 1 1 60 60 ALA N N 60 119.753 119.753 121.959 -2.206 18509 8473 1 17 . 1 1 60 60 ALA CA C 60 49.940 49.940 53.219 -3.279 18509 8474 1 17 . 1 1 60 60 ALA H H 60 6.898 6.898 8.840 -1.942 18509 8475 1 17 . 1 1 61 61 GLY N N 61 101.351 101.351 108.630 -7.279 18509 8476 1 17 . 1 1 61 61 GLY CA C 61 42.805 42.805 47.264 -4.459 18509 8477 1 17 . 1 1 61 61 GLY H H 61 7.730 7.730 7.982 -0.252 18509 8478 1 17 . 1 1 62 62 PRO C C 62 172.276 172.276 175.784 -3.508 18509 8479 1 17 . 1 1 63 63 HIS N N 63 115.023 115.023 121.323 -6.300 18509 8480 1 17 . 1 1 63 63 HIS CA C 63 52.119 52.119 56.758 -4.639 18509 8481 1 17 . 1 1 63 63 HIS H H 63 7.474 7.474 7.616 -0.142 18509 8482 1 17 . 1 1 64 64 PHE C C 64 171.731 171.731 173.026 -1.295 18509 8483 1 17 . 1 1 65 65 ASN N N 65 126.978 126.978 123.067 3.911 18509 8484 1 17 . 1 1 65 65 ASN CA C 65 47.753 47.753 51.099 -3.346 18509 8485 1 17 . 1 1 65 65 ASN H H 65 9.426 9.426 8.553 0.873 18509 8486 1 17 . 1 1 67 67 LEU N N 67 117.937 117.937 116.907 1.030 18509 8487 1 17 . 1 1 67 67 LEU C C 67 172.580 172.580 178.962 -6.382 18509 8488 1 17 . 1 1 67 67 LEU CA C 67 50.911 50.911 57.656 -6.745 18509 8489 1 17 . 1 1 67 67 LEU H H 67 7.720 7.720 8.271 -0.551 18509 8490 1 17 . 1 1 68 68 SER N N 68 110.842 110.842 113.525 -2.683 18509 8491 1 17 . 1 1 68 68 SER CA C 68 55.953 55.953 59.499 -3.546 18509 8492 1 17 . 1 1 68 68 SER H H 68 7.428 7.428 8.579 -1.151 18509 8493 1 17 . 1 1 69 69 ARG N N 69 120.782 120.782 116.980 3.802 18509 8494 1 17 . 1 1 69 69 ARG C C 69 173.381 173.381 177.228 -3.847 18509 8495 1 17 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.687 -5.144 18509 8496 1 17 . 1 1 69 69 ARG H H 69 8.508 8.508 8.260 0.248 18509 8497 1 17 . 1 1 70 70 LYS N N 70 118.055 118.055 121.177 -3.122 18509 8498 1 17 . 1 1 70 70 LYS C C 70 169.994 169.994 175.808 -5.814 18509 8499 1 17 . 1 1 70 70 LYS CA C 70 52.596 52.596 59.947 -7.351 18509 8500 1 17 . 1 1 70 70 LYS H H 70 8.745 8.745 8.508 0.237 18509 8501 1 17 . 1 1 71 71 HIS N N 71 111.871 111.871 117.378 -5.507 18509 8502 1 17 . 1 1 71 71 HIS C C 71 171.534 171.534 173.259 -1.725 18509 8503 1 17 . 1 1 71 71 HIS CA C 71 52.549 52.549 55.818 -3.269 18509 8504 1 17 . 1 1 71 71 HIS H H 71 7.152 7.152 8.102 -0.950 18509 8505 1 17 . 1 1 72 72 GLY N N 72 112.910 112.910 106.873 6.037 18509 8506 1 17 . 1 1 72 72 GLY C C 72 168.634 168.634 171.648 -3.014 18509 8507 1 17 . 1 1 72 72 GLY CA C 72 41.274 41.274 45.282 -4.008 18509 8508 1 17 . 1 1 72 72 GLY H H 72 7.209 7.209 7.587 -0.378 18509 8509 1 17 . 1 1 73 73 GLY N N 73 105.207 105.207 107.508 -2.301 18509 8510 1 17 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.366 -3.145 18509 8511 1 17 . 1 1 73 73 GLY H H 73 8.789 8.789 8.005 0.784 18509 8512 1 17 . 1 1 74 74 PRO C C 74 175.753 175.753 176.234 -0.481 18509 8513 1 17 . 1 1 75 75 LYS N N 75 114.868 114.868 115.351 -0.483 18509 8514 1 17 . 1 1 75 75 LYS C C 75 173.640 173.640 175.378 -1.738 18509 8515 1 17 . 1 1 75 75 LYS CA C 75 51.103 51.103 55.731 -4.628 18509 8516 1 17 . 1 1 75 75 LYS H H 75 8.651 8.651 7.865 0.786 18509 8517 1 17 . 1 1 76 76 ASP N N 76 120.414 120.414 118.298 2.116 18509 8518 1 17 . 1 1 76 76 ASP C C 76 172.557 172.557 174.627 -2.070 18509 8519 1 17 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.328 -3.019 18509 8520 1 17 . 1 1 76 76 ASP H H 76 7.461 7.461 8.087 -0.626 18509 8521 1 17 . 1 1 77 77 GLU N N 77 120.820 120.820 122.819 -1.999 18509 8522 1 17 . 1 1 77 77 GLU C C 77 174.101 174.101 175.642 -1.541 18509 8523 1 17 . 1 1 77 77 GLU CA C 77 55.513 55.513 57.946 -2.433 18509 8524 1 17 . 1 1 77 77 GLU H H 77 8.315 8.315 9.080 -0.765 18509 8525 1 17 . 1 1 78 78 GLU N N 78 119.251 119.251 120.396 -1.145 18509 8526 1 17 . 1 1 78 78 GLU C C 78 168.285 168.285 176.615 -8.330 18509 8527 1 17 . 1 1 78 78 GLU CA C 78 52.078 52.078 56.694 -4.615 18509 8528 1 17 . 1 1 78 78 GLU H H 78 8.109 8.109 8.529 -0.420 18509 8529 1 17 . 1 1 79 79 ARG N N 79 118.991 118.991 117.586 1.405 18509 8530 1 17 . 1 1 79 79 ARG C C 79 172.123 172.123 175.638 -3.515 18509 8531 1 17 . 1 1 79 79 ARG CA C 79 51.074 51.074 56.566 -5.492 18509 8532 1 17 . 1 1 79 79 ARG H H 79 6.999 6.999 8.645 -1.646 18509 8533 1 17 . 1 1 80 80 HIS N N 80 118.000 118.000 116.624 1.376 18509 8534 1 17 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.352 -6.399 18509 8535 1 17 . 1 1 80 80 HIS H H 80 8.355 8.355 8.861 -0.506 18509 8536 1 17 . 1 1 81 81 VAL C C 81 173.460 173.460 176.509 -3.049 18509 8537 1 17 . 1 1 82 82 GLY N N 82 97.322 97.322 109.345 -12.023 18509 8538 1 17 . 1 1 82 82 GLY C C 82 170.370 170.370 172.981 -2.611 18509 8539 1 17 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.714 -3.026 18509 8540 1 17 . 1 1 82 82 GLY H H 82 8.487 8.487 8.155 0.332 18509 8541 1 17 . 1 1 83 83 ASP N N 83 120.890 120.890 124.174 -3.284 18509 8542 1 17 . 1 1 83 83 ASP C C 83 168.737 168.737 174.747 -6.010 18509 8543 1 17 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.234 -0.316 18509 8544 1 17 . 1 1 83 83 ASP H H 83 7.127 7.127 8.120 -0.993 18509 8545 1 17 . 1 1 84 84 LEU N N 84 120.154 120.154 128.516 -8.362 18509 8546 1 17 . 1 1 84 84 LEU C C 84 173.212 173.212 174.428 -1.216 18509 8547 1 17 . 1 1 84 84 LEU CA C 84 50.433 50.433 53.624 -3.191 18509 8548 1 17 . 1 1 84 84 LEU H H 84 7.128 7.128 8.588 -1.460 18509 8549 1 17 . 1 1 85 85 GLY N N 85 106.867 106.867 111.898 -5.031 18509 8550 1 17 . 1 1 85 85 GLY C C 85 167.654 167.654 172.395 -4.741 18509 8551 1 17 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.842 -1.831 18509 8552 1 17 . 1 1 85 85 GLY H H 85 8.260 8.260 8.094 0.166 18509 8553 1 17 . 1 1 86 86 ASN N N 86 117.454 117.454 121.844 -4.390 18509 8554 1 17 . 1 1 86 86 ASN C C 86 173.942 173.942 174.335 -0.393 18509 8555 1 17 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.661 -3.395 18509 8556 1 17 . 1 1 86 86 ASN H H 86 8.041 8.041 8.551 -0.510 18509 8557 1 17 . 1 1 87 87 VAL N N 87 113.370 113.370 121.356 -7.986 18509 8558 1 17 . 1 1 87 87 VAL C C 87 171.526 171.526 175.164 -3.638 18509 8559 1 17 . 1 1 87 87 VAL CA C 87 55.708 55.708 61.463 -5.755 18509 8560 1 17 . 1 1 87 87 VAL H H 87 8.960 8.960 8.499 0.461 18509 8561 1 17 . 1 1 88 88 THR N N 88 117.939 117.939 120.893 -2.954 18509 8562 1 17 . 1 1 88 88 THR C C 88 170.367 170.367 173.267 -2.900 18509 8563 1 17 . 1 1 88 88 THR CA C 88 58.694 58.694 60.440 -1.746 18509 8564 1 17 . 1 1 88 88 THR H H 88 8.681 8.681 8.712 -0.031 18509 8565 1 17 . 1 1 89 89 ALA N N 89 128.674 128.674 131.543 -2.869 18509 8566 1 17 . 1 1 89 89 ALA C C 89 174.480 174.480 177.043 -2.563 18509 8567 1 17 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.909 -4.540 18509 8568 1 17 . 1 1 89 89 ALA H H 89 9.377 9.377 8.760 0.617 18509 8569 1 17 . 1 1 90 90 ASP N N 90 124.235 124.235 125.960 -1.725 18509 8570 1 17 . 1 1 90 90 ASP C C 90 173.825 173.825 177.552 -3.727 18509 8571 1 17 . 1 1 90 90 ASP CA C 90 49.347 49.347 54.376 -5.029 18509 8572 1 17 . 1 1 90 90 ASP H H 90 8.455 8.455 8.098 0.357 18509 8573 1 17 . 1 1 91 91 LYS N N 91 114.942 114.942 120.826 -5.884 18509 8574 1 17 . 1 1 91 91 LYS C C 91 174.101 174.101 175.629 -1.528 18509 8575 1 17 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.407 -3.128 18509 8576 1 17 . 1 1 91 91 LYS H H 91 8.231 8.231 8.816 -0.585 18509 8577 1 17 . 1 1 92 92 ASP N N 92 119.251 119.251 118.812 0.439 18509 8578 1 17 . 1 1 92 92 ASP C C 92 173.020 173.020 175.781 -2.761 18509 8579 1 17 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.392 -2.265 18509 8580 1 17 . 1 1 92 92 ASP H H 92 8.109 8.109 7.913 0.196 18509 8581 1 17 . 1 1 93 93 GLY N N 93 110.868 110.868 109.328 1.540 18509 8582 1 17 . 1 1 93 93 GLY C C 93 169.706 169.706 172.844 -3.138 18509 8583 1 17 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.104 -1.341 18509 8584 1 17 . 1 1 93 93 GLY H H 93 8.405 8.405 8.485 -0.080 18509 8585 1 17 . 1 1 94 94 VAL N N 94 118.755 118.755 119.688 -0.933 18509 8586 1 17 . 1 1 94 94 VAL C C 94 173.510 173.510 173.086 0.424 18509 8587 1 17 . 1 1 94 94 VAL CA C 94 58.185 58.185 60.922 -2.737 18509 8588 1 17 . 1 1 94 94 VAL H H 94 7.814 7.814 7.671 0.143 18509 8589 1 17 . 1 1 95 95 ALA N N 95 131.313 131.313 131.674 -0.361 18509 8590 1 17 . 1 1 95 95 ALA C C 95 171.635 171.635 175.099 -3.464 18509 8591 1 17 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.476 -3.562 18509 8592 1 17 . 1 1 95 95 ALA H H 95 9.763 9.763 8.624 1.139 18509 8593 1 17 . 1 1 96 96 ASP N N 96 125.170 125.170 125.418 -0.248 18509 8594 1 17 . 1 1 96 96 ASP C C 96 172.336 172.336 176.172 -3.836 18509 8595 1 17 . 1 1 96 96 ASP H H 96 8.515 8.515 8.639 -0.124 18509 8596 1 17 . 1 1 97 97 VAL N N 97 125.879 125.879 122.727 3.152 18509 8597 1 17 . 1 1 97 97 VAL C C 97 173.488 173.488 174.336 -0.848 18509 8598 1 17 . 1 1 97 97 VAL CA C 97 58.243 58.243 60.952 -2.709 18509 8599 1 17 . 1 1 97 97 VAL H H 97 8.703 8.703 8.872 -0.169 18509 8600 1 17 . 1 1 98 98 SER N N 98 123.017 123.017 121.921 1.096 18509 8601 1 17 . 1 1 98 98 SER C C 98 169.715 169.715 173.235 -3.520 18509 8602 1 17 . 1 1 98 98 SER CA C 98 55.068 55.068 58.232 -3.164 18509 8603 1 17 . 1 1 98 98 SER H H 98 8.784 8.784 8.613 0.171 18509 8604 1 17 . 1 1 99 99 ILE N N 99 125.807 125.807 123.624 2.183 18509 8605 1 17 . 1 1 99 99 ILE C C 99 171.321 171.321 174.334 -3.013 18509 8606 1 17 . 1 1 99 99 ILE CA C 99 57.155 57.155 59.366 -2.211 18509 8607 1 17 . 1 1 99 99 ILE H H 99 9.411 9.411 8.084 1.327 18509 8608 1 17 . 1 1 100 100 GLU N N 100 124.068 124.068 124.024 0.044 18509 8609 1 17 . 1 1 100 100 GLU C C 100 172.098 172.098 174.593 -2.495 18509 8610 1 17 . 1 1 100 100 GLU CA C 100 52.290 52.290 55.379 -3.089 18509 8611 1 17 . 1 1 100 100 GLU H H 100 8.652 8.652 8.539 0.113 18509 8612 1 17 . 1 1 101 101 ASP N N 101 126.109 126.109 123.045 3.064 18509 8613 1 17 . 1 1 101 101 ASP C C 101 171.144 171.144 174.967 -3.823 18509 8614 1 17 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.849 -2.430 18509 8615 1 17 . 1 1 101 101 ASP H H 101 9.317 9.317 8.572 0.745 18509 8616 1 17 . 1 1 102 102 SER N N 102 118.470 118.470 120.383 -1.913 18509 8617 1 17 . 1 1 102 102 SER C C 102 171.596 171.596 173.890 -2.294 18509 8618 1 17 . 1 1 102 102 SER CA C 102 55.245 55.245 59.318 -4.072 18509 8619 1 17 . 1 1 102 102 SER H H 102 8.933 8.933 8.748 0.185 18509 8620 1 17 . 1 1 103 103 VAL N N 103 123.179 123.179 122.058 1.121 18509 8621 1 17 . 1 1 103 103 VAL CA C 103 61.450 61.450 61.755 -0.305 18509 8622 1 17 . 1 1 103 103 VAL H H 103 8.148 8.148 7.834 0.314 18509 8623 1 17 . 1 1 104 104 ILE C C 104 169.576 169.576 175.275 -5.699 18509 8624 1 17 . 1 1 104 104 ILE CA C 104 60.194 60.194 61.051 -0.857 18509 8625 1 17 . 1 1 105 105 SER N N 105 107.618 107.618 117.126 -9.508 18509 8626 1 17 . 1 1 105 105 SER C C 105 170.046 170.046 174.584 -4.538 18509 8627 1 17 . 1 1 105 105 SER CA C 105 52.550 52.550 58.942 -6.392 18509 8628 1 17 . 1 1 105 105 SER H H 105 6.988 6.988 7.834 -0.846 18509 8629 1 17 . 1 1 106 106 LEU N N 106 120.137 120.137 127.958 -7.821 18509 8630 1 17 . 1 1 106 106 LEU H H 106 8.313 8.313 8.626 -0.313 18509 8631 1 17 . 1 1 107 107 SER C C 107 170.701 170.701 172.784 -2.083 18509 8632 1 17 . 1 1 107 107 SER CA C 107 54.540 54.540 58.520 -3.980 18509 8633 1 17 . 1 1 108 108 GLY N N 108 107.603 107.603 112.340 -4.737 18509 8634 1 17 . 1 1 108 108 GLY C C 108 173.128 173.128 173.207 -0.079 18509 8635 1 17 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.872 -3.585 18509 8636 1 17 . 1 1 108 108 GLY H H 108 8.717 8.717 7.554 1.163 18509 8637 1 17 . 1 1 109 109 ASP N N 109 120.664 120.664 123.174 -2.510 18509 8638 1 17 . 1 1 109 109 ASP C C 109 171.904 171.904 175.491 -3.587 18509 8639 1 17 . 1 1 109 109 ASP H H 109 9.019 9.019 8.797 0.222 18509 8640 1 17 . 1 1 110 110 HIS N N 110 116.324 116.324 119.892 -3.568 18509 8641 1 17 . 1 1 110 110 HIS H H 110 9.283 9.283 8.408 0.875 18509 8642 1 17 . 1 1 111 111 SER N N 111 110.225 110.225 113.807 -3.582 18509 8643 1 17 . 1 1 111 111 SER CA C 111 54.681 54.681 57.726 -3.045 18509 8644 1 17 . 1 1 111 111 SER H H 111 7.156 7.156 8.040 -0.884 18509 8645 1 17 . 1 1 112 112 ILE N N 112 117.053 117.053 122.345 -5.292 18509 8646 1 17 . 1 1 112 112 ILE C C 112 171.419 171.419 174.190 -2.771 18509 8647 1 17 . 1 1 112 112 ILE CA C 112 57.239 57.239 59.774 -2.535 18509 8648 1 17 . 1 1 112 112 ILE H H 112 7.837 7.837 8.560 -0.723 18509 8649 1 17 . 1 1 113 113 ILE N N 113 121.032 121.032 116.986 4.046 18509 8650 1 17 . 1 1 113 113 ILE C C 113 173.604 173.604 176.534 -2.930 18509 8651 1 17 . 1 1 113 113 ILE CA C 113 58.318 58.318 60.114 -1.796 18509 8652 1 17 . 1 1 113 113 ILE H H 113 7.592 7.592 7.238 0.354 18509 8653 1 17 . 1 1 114 114 GLY N N 114 112.661 112.661 109.536 3.125 18509 8654 1 17 . 1 1 114 114 GLY C C 114 169.739 169.739 174.461 -4.722 18509 8655 1 17 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.803 -3.893 18509 8656 1 17 . 1 1 114 114 GLY H H 114 9.575 9.575 8.749 0.826 18509 8657 1 17 . 1 1 115 115 ARG N N 115 118.398 118.398 122.723 -4.325 18509 8658 1 17 . 1 1 115 115 ARG C C 115 171.079 171.079 176.090 -5.011 18509 8659 1 17 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.700 -3.037 18509 8660 1 17 . 1 1 115 115 ARG H H 115 7.464 7.464 7.722 -0.258 18509 8661 1 17 . 1 1 116 116 THR N N 116 112.218 112.218 116.791 -4.573 18509 8662 1 17 . 1 1 116 116 THR C C 116 169.821 169.821 175.385 -5.564 18509 8663 1 17 . 1 1 116 116 THR CA C 116 59.633 59.633 60.646 -1.013 18509 8664 1 17 . 1 1 116 116 THR H H 116 6.677 6.677 7.803 -1.126 18509 8665 1 17 . 1 1 117 117 LEU N N 117 129.477 129.477 123.236 6.241 18509 8666 1 17 . 1 1 117 117 LEU C C 117 171.126 171.126 175.381 -4.255 18509 8667 1 17 . 1 1 117 117 LEU CA C 117 50.415 50.415 55.151 -4.736 18509 8668 1 17 . 1 1 117 117 LEU H H 117 8.799 8.799 8.917 -0.118 18509 8669 1 17 . 1 1 118 118 VAL N N 118 125.091 125.091 124.572 0.519 18509 8670 1 17 . 1 1 118 118 VAL C C 118 170.267 170.267 175.019 -4.752 18509 8671 1 17 . 1 1 118 118 VAL CA C 118 58.139 58.139 60.634 -2.495 18509 8672 1 17 . 1 1 118 118 VAL H H 118 8.906 8.906 8.185 0.721 18509 8673 1 17 . 1 1 119 119 VAL N N 119 120.716 120.716 121.513 -0.797 18509 8674 1 17 . 1 1 119 119 VAL C C 119 171.175 171.175 173.553 -2.378 18509 8675 1 17 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.703 -4.432 18509 8676 1 17 . 1 1 119 119 VAL H H 119 7.982 7.982 7.795 0.187 18509 8677 1 17 . 1 1 120 120 HIS N N 120 125.052 125.052 116.753 8.299 18509 8678 1 17 . 1 1 120 120 HIS C C 120 172.599 172.599 174.290 -1.691 18509 8679 1 17 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.281 -1.887 18509 8680 1 17 . 1 1 120 120 HIS H H 120 8.935 8.935 8.423 0.512 18509 8681 1 17 . 1 1 121 121 GLU N N 121 121.453 121.453 121.088 0.365 18509 8682 1 17 . 1 1 121 121 GLU C C 121 172.304 172.304 175.825 -3.521 18509 8683 1 17 . 1 1 121 121 GLU CA C 121 56.090 56.090 57.150 -1.060 18509 8684 1 17 . 1 1 121 121 GLU H H 121 9.178 9.178 8.771 0.407 18509 8685 1 17 . 1 1 122 122 LYS N N 122 115.248 115.248 119.984 -4.736 18509 8686 1 17 . 1 1 122 122 LYS C C 122 171.523 171.523 174.321 -2.798 18509 8687 1 17 . 1 1 122 122 LYS CA C 122 50.619 50.619 54.683 -4.064 18509 8688 1 17 . 1 1 122 122 LYS H H 122 8.478 8.478 8.008 0.470 18509 8689 1 17 . 1 1 123 123 ALA N N 123 120.866 120.866 121.779 -0.913 18509 8690 1 17 . 1 1 123 123 ALA C C 123 173.219 173.219 176.216 -2.997 18509 8691 1 17 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.068 -3.217 18509 8692 1 17 . 1 1 123 123 ALA H H 123 7.796 7.796 8.276 -0.480 18509 8693 1 17 . 1 1 124 124 ASP N N 124 121.799 121.799 121.201 0.598 18509 8694 1 17 . 1 1 124 124 ASP C C 124 174.458 174.458 175.057 -0.599 18509 8695 1 17 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.072 -3.664 18509 8696 1 17 . 1 1 124 124 ASP H H 124 10.165 10.165 7.958 2.207 18509 8697 1 17 . 1 1 125 125 ASP N N 125 129.369 129.369 116.826 12.543 18509 8698 1 17 . 1 1 125 125 ASP C C 125 175.231 175.231 175.779 -0.548 18509 8699 1 17 . 1 1 125 125 ASP CA C 125 50.939 50.939 55.618 -4.679 18509 8700 1 17 . 1 1 125 125 ASP H H 125 10.055 10.055 7.891 2.163 18509 8701 1 17 . 1 1 126 126 LEU N N 126 117.190 117.190 121.487 -4.297 18509 8702 1 17 . 1 1 126 126 LEU C C 126 173.964 173.964 178.431 -4.467 18509 8703 1 17 . 1 1 126 126 LEU H H 126 10.483 10.483 8.467 2.016 18509 8704 1 17 . 1 1 127 127 GLY N N 127 103.809 103.809 105.461 -1.652 18509 8705 1 17 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.468 -3.590 18509 8706 1 17 . 1 1 127 127 GLY H H 127 8.637 8.637 8.124 0.513 18509 8707 1 17 . 1 1 128 128 LYS N N 128 118.290 118.290 119.678 -1.388 18509 8708 1 17 . 1 1 128 128 LYS CA C 128 51.740 51.740 54.588 -2.848 18509 8709 1 17 . 1 1 128 128 LYS H H 128 7.158 7.158 7.409 -0.251 18509 8710 1 17 . 1 1 129 129 GLY N N 129 108.507 108.507 106.862 1.645 18509 8711 1 17 . 1 1 129 129 GLY C C 129 171.524 171.524 174.720 -3.196 18509 8712 1 17 . 1 1 129 129 GLY CA C 129 42.113 42.113 45.940 -3.827 18509 8713 1 17 . 1 1 129 129 GLY H H 129 8.913 8.913 7.883 1.030 18509 8714 1 17 . 1 1 130 130 GLY N N 130 108.537 108.537 108.829 -0.292 18509 8715 1 17 . 1 1 130 130 GLY C C 130 169.994 169.994 173.922 -3.928 18509 8716 1 17 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.717 -2.298 18509 8717 1 17 . 1 1 130 130 GLY H H 130 8.723 8.723 7.721 1.002 18509 8718 1 17 . 1 1 131 131 ASN N N 131 111.951 111.951 120.921 -8.970 18509 8719 1 17 . 1 1 131 131 ASN C C 131 172.236 172.236 176.775 -4.539 18509 8720 1 17 . 1 1 131 131 ASN H H 131 7.152 7.152 8.186 -1.034 18509 8721 1 17 . 1 1 132 132 GLU N N 132 120.461 120.461 121.816 -1.355 18509 8722 1 17 . 1 1 132 132 GLU C C 132 171.084 171.084 177.751 -6.667 18509 8723 1 17 . 1 1 132 132 GLU H H 132 8.935 8.935 8.915 0.020 18509 8724 1 17 . 1 1 133 133 GLU N N 133 120.137 120.137 119.494 0.643 18509 8725 1 17 . 1 1 133 133 GLU C C 133 176.239 176.239 178.540 -2.301 18509 8726 1 17 . 1 1 133 133 GLU H H 133 8.775 8.775 8.646 0.129 18509 8727 1 17 . 1 1 134 134 SER N N 134 114.981 114.981 114.858 0.123 18509 8728 1 17 . 1 1 134 134 SER CA C 134 59.046 59.046 61.389 -2.344 18509 8729 1 17 . 1 1 134 134 SER H H 134 8.117 8.117 8.358 -0.241 18509 8730 1 17 . 1 1 135 135 THR N N 135 102.263 102.263 116.720 -14.457 18509 8731 1 17 . 1 1 135 135 THR C C 135 172.804 172.804 175.056 -2.252 18509 8732 1 17 . 1 1 135 135 THR CA C 135 60.029 60.029 65.279 -5.250 18509 8733 1 17 . 1 1 135 135 THR H H 135 7.206 7.206 8.153 -0.947 18509 8734 1 17 . 1 1 136 136 LYS N N 136 122.108 122.108 120.292 1.816 18509 8735 1 17 . 1 1 136 136 LYS H H 136 7.884 7.884 7.739 0.145 18509 8736 1 17 . 1 1 137 137 THR N N 137 105.718 105.718 112.041 -6.323 18509 8737 1 17 . 1 1 137 137 THR H H 137 8.630 8.630 7.700 0.930 18509 8738 1 17 . 1 1 138 138 GLY N N 138 111.372 111.372 111.383 -0.011 18509 8739 1 17 . 1 1 138 138 GLY CA C 138 42.483 42.483 44.697 -2.213 18509 8740 1 17 . 1 1 138 138 GLY H H 138 7.426 7.426 7.507 -0.081 18509 8741 1 17 . 1 1 139 139 ASN N N 139 107.496 107.496 119.550 -12.054 18509 8742 1 17 . 1 1 139 139 ASN H H 139 7.545 7.545 7.856 -0.311 18509 8743 1 17 . 1 1 140 140 ALA N N 140 114.542 114.542 127.980 -13.438 18509 8744 1 17 . 1 1 140 140 ALA C C 140 173.571 173.571 177.056 -3.485 18509 8745 1 17 . 1 1 140 140 ALA H H 140 6.368 6.368 8.260 -1.892 18509 8746 1 17 . 1 1 141 141 GLY N N 141 105.287 105.287 109.250 -3.963 18509 8747 1 17 . 1 1 141 141 GLY C C 141 173.542 173.542 175.564 -2.022 18509 8748 1 17 . 1 1 141 141 GLY H H 141 8.271 8.271 8.840 -0.569 18509 8749 1 17 . 1 1 142 142 SER N N 142 118.771 118.771 120.853 -2.082 18509 8750 1 17 . 1 1 142 142 SER C C 142 170.188 170.188 175.354 -5.166 18509 8751 1 17 . 1 1 142 142 SER H H 142 9.196 9.196 8.377 0.819 18509 8752 1 17 . 1 1 143 143 ARG N N 143 120.189 120.189 115.695 4.494 18509 8753 1 17 . 1 1 143 143 ARG C C 143 171.596 171.596 176.242 -4.646 18509 8754 1 17 . 1 1 143 143 ARG H H 143 8.943 8.943 7.974 0.969 18509 8755 1 17 . 1 1 144 144 LEU N N 144 122.907 122.907 122.290 0.617 18509 8756 1 17 . 1 1 144 144 LEU C C 144 174.393 174.393 175.983 -1.590 18509 8757 1 17 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.456 -3.081 18509 8758 1 17 . 1 1 144 144 LEU H H 144 8.395 8.395 7.644 0.751 18509 8759 1 17 . 1 1 145 145 ALA N N 145 114.159 114.159 116.901 -2.742 18509 8760 1 17 . 1 1 145 145 ALA C C 145 171.752 171.752 174.850 -3.098 18509 8761 1 17 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.927 -3.798 18509 8762 1 17 . 1 1 145 145 ALA H H 145 7.356 7.356 7.611 -0.255 18509 8763 1 17 . 1 1 146 146 CYS N N 146 110.738 110.738 120.687 -9.949 18509 8764 1 17 . 1 1 146 146 CYS C C 146 170.087 170.087 174.014 -3.927 18509 8765 1 17 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.135 -6.058 18509 8766 1 17 . 1 1 146 146 CYS H H 146 9.008 9.008 8.149 0.859 18509 8767 1 17 . 1 1 147 147 GLY N N 147 106.461 106.461 108.656 -2.195 18509 8768 1 17 . 1 1 147 147 GLY C C 147 167.909 167.909 172.435 -4.526 18509 8769 1 17 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.048 -2.374 18509 8770 1 17 . 1 1 147 147 GLY H H 147 8.018 8.018 8.191 -0.173 18509 8771 1 17 . 1 1 148 148 VAL N N 148 124.054 124.054 124.635 -0.581 18509 8772 1 17 . 1 1 148 148 VAL C C 148 172.084 172.084 174.884 -2.800 18509 8773 1 17 . 1 1 148 148 VAL CA C 148 59.635 59.635 63.188 -3.553 18509 8774 1 17 . 1 1 148 148 VAL H H 148 8.434 8.434 8.248 0.186 18509 8775 1 17 . 1 1 149 149 ILE N N 149 126.918 126.918 129.162 -2.244 18509 8776 1 17 . 1 1 149 149 ILE C C 149 171.804 171.804 174.176 -2.372 18509 8777 1 17 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.273 -0.089 18509 8778 1 17 . 1 1 149 149 ILE H H 149 8.613 8.613 8.522 0.091 18509 8779 1 17 . 1 1 150 150 GLY N N 150 116.493 116.493 115.546 0.947 18509 8780 1 17 . 1 1 150 150 GLY C C 150 170.188 170.188 172.410 -2.222 18509 8781 1 17 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.941 -4.821 18509 8782 1 17 . 1 1 150 150 GLY H H 150 9.283 9.283 7.692 1.591 18509 8783 1 17 . 1 1 151 151 ILE N N 151 120.189 120.189 122.627 -2.438 18509 8784 1 17 . 1 1 151 151 ILE C C 151 172.231 172.231 174.710 -2.479 18509 8785 1 17 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.944 -1.572 18509 8786 1 17 . 1 1 151 151 ILE H H 151 8.943 8.943 8.608 0.335 18509 8787 1 17 . 1 1 152 152 ALA N N 152 129.719 129.719 132.043 -2.324 18509 8788 1 17 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.092 -4.320 18509 8789 1 17 . 1 1 152 152 ALA H H 152 8.170 8.170 8.237 -0.067 18509 8790 1 18 . 1 1 2 2 THR C C 2 170.139 170.139 173.955 -3.816 18509 8791 1 18 . 1 1 3 3 LYS N N 3 123.998 123.998 120.473 3.525 18509 8792 1 18 . 1 1 3 3 LYS C C 3 171.607 171.607 174.582 -2.975 18509 8793 1 18 . 1 1 3 3 LYS CA C 3 51.178 51.178 55.430 -4.252 18509 8794 1 18 . 1 1 3 3 LYS H H 3 8.666 8.666 7.798 0.868 18509 8795 1 18 . 1 1 4 4 ALA N N 4 123.295 123.295 126.412 -3.117 18509 8796 1 18 . 1 1 4 4 ALA C C 4 172.145 172.145 175.047 -2.902 18509 8797 1 18 . 1 1 4 4 ALA CA C 4 47.504 47.504 52.263 -4.758 18509 8798 1 18 . 1 1 4 4 ALA H H 4 9.116 9.116 8.920 0.196 18509 8799 1 18 . 1 1 5 5 VAL N N 5 121.466 121.466 120.047 1.419 18509 8800 1 18 . 1 1 5 5 VAL C C 5 167.836 167.836 175.029 -7.193 18509 8801 1 18 . 1 1 5 5 VAL CA C 5 56.875 56.875 59.191 -2.316 18509 8802 1 18 . 1 1 5 5 VAL H H 5 9.545 9.545 7.811 1.734 18509 8803 1 18 . 1 1 6 6 ALA N N 6 125.984 125.984 128.637 -2.653 18509 8804 1 18 . 1 1 6 6 ALA C C 6 171.607 171.607 175.516 -3.909 18509 8805 1 18 . 1 1 6 6 ALA CA C 6 47.471 47.471 49.859 -2.388 18509 8806 1 18 . 1 1 6 6 ALA H H 6 9.177 9.177 8.135 1.042 18509 8807 1 18 . 1 1 7 7 VAL N N 7 123.600 123.600 122.520 1.080 18509 8808 1 18 . 1 1 7 7 VAL C C 7 172.244 172.244 173.968 -1.724 18509 8809 1 18 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.423 -1.947 18509 8810 1 18 . 1 1 7 7 VAL H H 7 9.116 9.116 8.380 0.736 18509 8811 1 18 . 1 1 8 8 LEU N N 8 126.455 126.455 130.300 -3.845 18509 8812 1 18 . 1 1 8 8 LEU C C 8 172.557 172.557 176.566 -4.009 18509 8813 1 18 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.946 -2.894 18509 8814 1 18 . 1 1 8 8 LEU H H 8 8.916 8.916 8.424 0.492 18509 8815 1 18 . 1 1 9 9 LYS N N 9 120.820 120.820 120.839 -0.019 18509 8816 1 18 . 1 1 9 9 LYS C C 9 172.509 172.509 176.048 -3.539 18509 8817 1 18 . 1 1 9 9 LYS CA C 9 51.897 51.897 54.575 -2.678 18509 8818 1 18 . 1 1 9 9 LYS H H 9 8.315 8.315 8.034 0.281 18509 8819 1 18 . 1 1 10 10 GLY N N 10 111.249 111.249 109.815 1.434 18509 8820 1 18 . 1 1 10 10 GLY C C 10 169.847 169.847 173.891 -4.044 18509 8821 1 18 . 1 1 10 10 GLY CA C 10 42.275 42.275 44.268 -1.993 18509 8822 1 18 . 1 1 10 10 GLY H H 10 8.968 8.968 8.285 0.683 18509 8823 1 18 . 1 1 11 11 ASP N N 11 120.904 120.904 121.811 -0.907 18509 8824 1 18 . 1 1 11 11 ASP C C 11 173.132 173.132 176.700 -3.568 18509 8825 1 18 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.944 -4.627 18509 8826 1 18 . 1 1 11 11 ASP H H 11 8.745 8.745 8.446 0.299 18509 8827 1 18 . 1 1 12 12 GLY N N 12 109.862 109.862 108.702 1.160 18509 8828 1 18 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.253 -2.053 18509 8829 1 18 . 1 1 12 12 GLY H H 12 7.985 7.985 8.280 -0.295 18509 8830 1 18 . 1 1 13 13 PRO C C 13 173.640 173.640 175.662 -2.022 18509 8831 1 18 . 1 1 14 14 VAL N N 14 120.414 120.414 118.434 1.980 18509 8832 1 18 . 1 1 14 14 VAL C C 14 172.804 172.804 174.701 -1.897 18509 8833 1 18 . 1 1 14 14 VAL CA C 14 59.884 59.884 59.812 0.071 18509 8834 1 18 . 1 1 14 14 VAL H H 14 7.476 7.476 8.005 -0.529 18509 8835 1 18 . 1 1 15 15 GLN N N 15 122.664 122.664 125.883 -3.219 18509 8836 1 18 . 1 1 15 15 GLN C C 15 171.168 171.168 174.813 -3.645 18509 8837 1 18 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.580 -3.901 18509 8838 1 18 . 1 1 15 15 GLN H H 15 7.938 7.938 8.764 -0.826 18509 8839 1 18 . 1 1 16 16 GLY N N 16 107.018 107.018 109.556 -2.538 18509 8840 1 18 . 1 1 16 16 GLY C C 16 167.726 167.726 171.517 -3.791 18509 8841 1 18 . 1 1 16 16 GLY CA C 16 43.625 43.625 44.963 -1.338 18509 8842 1 18 . 1 1 16 16 GLY H H 16 8.288 8.288 8.571 -0.283 18509 8843 1 18 . 1 1 17 17 ILE N N 17 120.248 120.248 121.814 -1.566 18509 8844 1 18 . 1 1 17 17 ILE C C 17 171.194 171.194 173.670 -2.476 18509 8845 1 18 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.976 -1.479 18509 8846 1 18 . 1 1 17 17 ILE H H 17 7.948 7.948 7.900 0.048 18509 8847 1 18 . 1 1 18 18 ILE N N 18 125.851 125.851 125.046 0.805 18509 8848 1 18 . 1 1 18 18 ILE C C 18 168.889 168.889 174.059 -5.170 18509 8849 1 18 . 1 1 18 18 ILE CA C 18 53.431 53.431 57.980 -4.548 18509 8850 1 18 . 1 1 18 18 ILE H H 18 8.725 8.725 7.940 0.785 18509 8851 1 18 . 1 1 19 19 ASN N N 19 123.256 123.256 124.009 -0.753 18509 8852 1 18 . 1 1 19 19 ASN C C 19 168.903 168.903 173.498 -4.595 18509 8853 1 18 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.718 -2.630 18509 8854 1 18 . 1 1 19 19 ASN H H 19 8.727 8.727 8.347 0.380 18509 8855 1 18 . 1 1 20 20 PHE N N 20 113.849 113.849 122.941 -9.092 18509 8856 1 18 . 1 1 20 20 PHE C C 20 173.219 173.219 174.859 -1.640 18509 8857 1 18 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.121 -5.063 18509 8858 1 18 . 1 1 20 20 PHE H H 20 8.399 8.399 8.597 -0.198 18509 8859 1 18 . 1 1 21 21 GLU N N 21 121.454 121.454 123.218 -1.764 18509 8860 1 18 . 1 1 21 21 GLU C C 21 170.280 170.280 175.541 -5.261 18509 8861 1 18 . 1 1 21 21 GLU CA C 21 53.044 53.044 55.556 -2.512 18509 8862 1 18 . 1 1 21 21 GLU H H 21 9.526 9.526 8.775 0.751 18509 8863 1 18 . 1 1 22 22 GLN N N 22 130.340 130.340 126.102 4.238 18509 8864 1 18 . 1 1 22 22 GLN CA C 22 51.180 51.180 55.645 -4.465 18509 8865 1 18 . 1 1 22 22 GLN H H 22 9.305 9.305 9.094 0.211 18509 8866 1 18 . 1 1 23 23 LYS N N 23 128.657 128.657 124.350 4.307 18509 8867 1 18 . 1 1 23 23 LYS CA C 23 57.241 57.241 55.124 2.117 18509 8868 1 18 . 1 1 23 23 LYS H H 23 9.088 9.088 8.176 0.912 18509 8869 1 18 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.366 -6.974 18509 8870 1 18 . 1 1 25 25 SER CA C 25 58.078 58.078 58.842 -0.764 18509 8871 1 18 . 1 1 27 27 GLY N N 27 108.125 108.125 110.878 -2.753 18509 8872 1 18 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.791 -1.866 18509 8873 1 18 . 1 1 27 27 GLY H H 27 8.032 8.032 8.273 -0.241 18509 8874 1 18 . 1 1 28 28 PRO C C 28 173.128 173.128 176.164 -3.036 18509 8875 1 18 . 1 1 29 29 VAL N N 29 121.267 121.267 125.695 -4.428 18509 8876 1 18 . 1 1 29 29 VAL C C 29 172.198 172.198 175.352 -3.154 18509 8877 1 18 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.852 -4.132 18509 8878 1 18 . 1 1 29 29 VAL H H 29 9.089 9.089 8.477 0.612 18509 8879 1 18 . 1 1 30 30 LYS N N 30 127.589 127.589 130.318 -2.729 18509 8880 1 18 . 1 1 30 30 LYS C C 30 172.098 172.098 175.043 -2.945 18509 8881 1 18 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.286 -2.644 18509 8882 1 18 . 1 1 30 30 LYS H H 30 9.200 9.200 9.218 -0.018 18509 8883 1 18 . 1 1 31 31 VAL N N 31 126.037 126.037 117.954 8.083 18509 8884 1 18 . 1 1 31 31 VAL C C 31 172.244 172.244 174.332 -2.088 18509 8885 1 18 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.283 -2.144 18509 8886 1 18 . 1 1 31 31 VAL H H 31 9.282 9.282 7.115 2.167 18509 8887 1 18 . 1 1 32 32 TRP N N 32 125.414 125.414 125.123 0.291 18509 8888 1 18 . 1 1 32 32 TRP C C 32 170.156 170.156 174.682 -4.526 18509 8889 1 18 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.530 -3.393 18509 8890 1 18 . 1 1 32 32 TRP H H 32 8.983 8.983 8.049 0.934 18509 8891 1 18 . 1 1 33 33 GLY N N 33 107.848 107.848 108.836 -0.988 18509 8892 1 18 . 1 1 33 33 GLY C C 33 168.400 168.400 172.069 -3.669 18509 8893 1 18 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.164 -3.597 18509 8894 1 18 . 1 1 33 33 GLY H H 33 8.360 8.360 8.336 0.024 18509 8895 1 18 . 1 1 34 34 SER N N 34 114.377 114.377 117.685 -3.308 18509 8896 1 18 . 1 1 34 34 SER C C 34 169.618 169.618 173.858 -4.240 18509 8897 1 18 . 1 1 34 34 SER CA C 34 53.875 53.875 56.459 -2.584 18509 8898 1 18 . 1 1 34 34 SER H H 34 7.838 7.838 8.212 -0.374 18509 8899 1 18 . 1 1 35 35 ILE N N 35 123.149 123.149 124.339 -1.190 18509 8900 1 18 . 1 1 35 35 ILE C C 35 169.713 169.713 174.838 -5.125 18509 8901 1 18 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.801 -3.032 18509 8902 1 18 . 1 1 35 35 ILE H H 35 8.496 8.496 8.010 0.486 18509 8903 1 18 . 1 1 36 36 LYS N N 36 123.803 123.803 124.173 -0.370 18509 8904 1 18 . 1 1 36 36 LYS C C 36 172.260 172.260 175.204 -2.944 18509 8905 1 18 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.282 -3.132 18509 8906 1 18 . 1 1 36 36 LYS H H 36 9.091 9.091 8.914 0.177 18509 8907 1 18 . 1 1 37 37 GLY N N 37 105.495 105.495 109.198 -3.703 18509 8908 1 18 . 1 1 37 37 GLY C C 37 171.641 171.641 172.889 -1.248 18509 8909 1 18 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.689 -2.328 18509 8910 1 18 . 1 1 37 37 GLY H H 37 8.237 8.237 8.055 0.182 18509 8911 1 18 . 1 1 38 38 LEU N N 38 120.966 120.966 119.984 0.982 18509 8912 1 18 . 1 1 38 38 LEU C C 38 174.112 174.112 176.900 -2.788 18509 8913 1 18 . 1 1 38 38 LEU CA C 38 50.471 50.471 55.096 -4.625 18509 8914 1 18 . 1 1 38 38 LEU H H 38 8.156 8.156 8.505 -0.349 18509 8915 1 18 . 1 1 39 39 THR N N 39 110.363 110.363 112.553 -2.190 18509 8916 1 18 . 1 1 39 39 THR C C 39 173.102 173.102 174.238 -1.136 18509 8917 1 18 . 1 1 39 39 THR CA C 39 58.194 58.194 61.379 -3.185 18509 8918 1 18 . 1 1 39 39 THR H H 39 8.660 8.660 8.211 0.449 18509 8919 1 18 . 1 1 40 40 GLU N N 40 125.818 125.818 125.519 0.299 18509 8920 1 18 . 1 1 40 40 GLU C C 40 173.134 173.134 174.537 -1.403 18509 8921 1 18 . 1 1 40 40 GLU CA C 40 54.356 54.356 56.504 -2.147 18509 8922 1 18 . 1 1 40 40 GLU H H 40 8.804 8.804 8.632 0.172 18509 8923 1 18 . 1 1 41 41 GLY N N 41 113.875 113.875 109.680 4.195 18509 8924 1 18 . 1 1 41 41 GLY C C 41 170.046 170.046 172.329 -2.283 18509 8925 1 18 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.570 -5.516 18509 8926 1 18 . 1 1 41 41 GLY H H 41 8.763 8.763 8.251 0.512 18509 8927 1 18 . 1 1 42 42 LEU N N 42 120.137 120.137 122.607 -2.470 18509 8928 1 18 . 1 1 42 42 LEU C C 42 174.218 174.218 175.511 -1.293 18509 8929 1 18 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.782 -2.627 18509 8930 1 18 . 1 1 42 42 LEU H H 42 8.313 8.313 7.922 0.391 18509 8931 1 18 . 1 1 43 43 HIS N N 43 114.385 114.385 117.996 -3.611 18509 8932 1 18 . 1 1 43 43 HIS C C 43 171.504 171.504 174.471 -2.967 18509 8933 1 18 . 1 1 43 43 HIS CA C 43 50.985 50.985 54.445 -3.460 18509 8934 1 18 . 1 1 43 43 HIS H H 43 8.712 8.712 7.913 0.799 18509 8935 1 18 . 1 1 44 44 GLY N N 44 108.872 108.872 110.635 -1.763 18509 8936 1 18 . 1 1 44 44 GLY C C 44 168.656 168.656 173.638 -4.982 18509 8937 1 18 . 1 1 44 44 GLY CA C 44 44.195 44.195 44.008 0.187 18509 8938 1 18 . 1 1 44 44 GLY H H 44 8.875 8.875 8.686 0.189 18509 8939 1 18 . 1 1 45 45 PHE N N 45 126.439 126.439 122.338 4.101 18509 8940 1 18 . 1 1 45 45 PHE CA C 45 53.098 53.098 54.481 -1.383 18509 8941 1 18 . 1 1 45 45 PHE H H 45 8.111 8.111 6.829 1.282 18509 8942 1 18 . 1 1 46 46 HIS N N 46 115.353 115.353 119.628 -4.275 18509 8943 1 18 . 1 1 46 46 HIS C C 46 172.415 172.415 174.328 -1.913 18509 8944 1 18 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.532 -5.326 18509 8945 1 18 . 1 1 46 46 HIS H H 46 8.107 8.107 7.871 0.236 18509 8946 1 18 . 1 1 47 47 VAL N N 47 120.548 120.548 124.897 -4.349 18509 8947 1 18 . 1 1 47 47 VAL C C 47 173.900 173.900 174.019 -0.119 18509 8948 1 18 . 1 1 47 47 VAL CA C 47 58.792 58.792 62.394 -3.602 18509 8949 1 18 . 1 1 47 47 VAL H H 47 9.366 9.366 9.235 0.131 18509 8950 1 18 . 1 1 48 48 HIS N N 48 129.236 129.236 123.896 5.340 18509 8951 1 18 . 1 1 48 48 HIS C C 48 171.084 171.084 173.648 -2.564 18509 8952 1 18 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.487 -1.731 18509 8953 1 18 . 1 1 48 48 HIS H H 48 10.210 10.210 8.123 2.087 18509 8954 1 18 . 1 1 49 49 GLU N N 49 118.119 118.119 118.171 -0.052 18509 8955 1 18 . 1 1 49 49 GLU C C 49 171.635 171.635 174.279 -2.644 18509 8956 1 18 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.749 2.010 18509 8957 1 18 . 1 1 49 49 GLU H H 49 8.492 8.492 8.580 -0.088 18509 8958 1 18 . 1 1 50 50 PHE N N 50 110.329 110.329 119.444 -9.115 18509 8959 1 18 . 1 1 50 50 PHE C C 50 175.252 175.252 173.791 1.461 18509 8960 1 18 . 1 1 50 50 PHE CA C 50 52.900 52.900 58.876 -5.976 18509 8961 1 18 . 1 1 50 50 PHE H H 50 8.580 8.580 8.608 -0.028 18509 8962 1 18 . 1 1 51 51 GLY N N 51 119.251 119.251 106.924 12.327 18509 8963 1 18 . 1 1 51 51 GLY C C 51 168.248 168.248 172.432 -4.184 18509 8964 1 18 . 1 1 51 51 GLY H H 51 10.208 10.208 8.010 2.198 18509 8965 1 18 . 1 1 52 52 ASP N N 52 114.958 114.958 120.246 -5.288 18509 8966 1 18 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.646 -5.755 18509 8967 1 18 . 1 1 52 52 ASP H H 52 5.834 5.834 8.096 -2.262 18509 8968 1 18 . 1 1 53 53 ASN N N 53 128.224 128.224 119.498 8.726 18509 8969 1 18 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.226 -3.993 18509 8970 1 18 . 1 1 53 53 ASN H H 53 9.360 9.360 8.333 1.027 18509 8971 1 18 . 1 1 54 54 THR C C 54 168.656 168.656 174.608 -5.952 18509 8972 1 18 . 1 1 55 55 ALA N N 55 126.661 126.661 121.815 4.846 18509 8973 1 18 . 1 1 55 55 ALA C C 55 174.185 174.185 176.841 -2.656 18509 8974 1 18 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.863 -5.708 18509 8975 1 18 . 1 1 55 55 ALA H H 55 8.390 8.390 7.508 0.882 18509 8976 1 18 . 1 1 56 56 GLY N N 56 107.903 107.903 106.278 1.625 18509 8977 1 18 . 1 1 56 56 GLY C C 56 171.578 171.578 173.097 -1.519 18509 8978 1 18 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.469 -2.889 18509 8979 1 18 . 1 1 56 56 GLY H H 56 7.282 7.282 7.382 -0.100 18509 8980 1 18 . 1 1 57 57 CYS N N 57 117.952 117.952 124.710 -6.758 18509 8981 1 18 . 1 1 57 57 CYS C C 57 175.209 175.209 175.462 -0.253 18509 8982 1 18 . 1 1 57 57 CYS CA C 57 49.088 49.088 58.375 -9.287 18509 8983 1 18 . 1 1 57 57 CYS H H 57 8.900 8.900 8.655 0.245 18509 8984 1 18 . 1 1 58 58 THR N N 58 119.852 119.852 120.358 -0.506 18509 8985 1 18 . 1 1 58 58 THR CA C 58 58.239 58.239 65.730 -7.491 18509 8986 1 18 . 1 1 58 58 THR H H 58 8.505 8.505 8.045 0.460 18509 8987 1 18 . 1 1 59 59 SER C C 59 170.763 170.763 175.382 -4.619 18509 8988 1 18 . 1 1 59 59 SER CA C 59 55.609 55.609 61.244 -5.635 18509 8989 1 18 . 1 1 60 60 ALA N N 60 119.753 119.753 122.023 -2.270 18509 8990 1 18 . 1 1 60 60 ALA CA C 60 49.940 49.940 51.736 -1.796 18509 8991 1 18 . 1 1 60 60 ALA H H 60 6.898 6.898 8.274 -1.376 18509 8992 1 18 . 1 1 61 61 GLY N N 61 101.351 101.351 108.253 -6.902 18509 8993 1 18 . 1 1 61 61 GLY CA C 61 42.805 42.805 45.872 -3.067 18509 8994 1 18 . 1 1 61 61 GLY H H 61 7.730 7.730 7.261 0.469 18509 8995 1 18 . 1 1 62 62 PRO C C 62 172.276 172.276 175.662 -3.386 18509 8996 1 18 . 1 1 63 63 HIS N N 63 115.023 115.023 120.996 -5.973 18509 8997 1 18 . 1 1 63 63 HIS CA C 63 52.119 52.119 54.599 -2.479 18509 8998 1 18 . 1 1 63 63 HIS H H 63 7.474 7.474 8.568 -1.094 18509 8999 1 18 . 1 1 64 64 PHE C C 64 171.731 171.731 174.444 -2.713 18509 9000 1 18 . 1 1 65 65 ASN N N 65 126.978 126.978 122.219 4.759 18509 9001 1 18 . 1 1 65 65 ASN CA C 65 47.753 47.753 51.040 -3.287 18509 9002 1 18 . 1 1 65 65 ASN H H 65 9.426 9.426 8.725 0.701 18509 9003 1 18 . 1 1 67 67 LEU N N 67 117.937 117.937 118.720 -0.783 18509 9004 1 18 . 1 1 67 67 LEU C C 67 172.580 172.580 177.126 -4.546 18509 9005 1 18 . 1 1 67 67 LEU CA C 67 50.911 50.911 55.443 -4.532 18509 9006 1 18 . 1 1 67 67 LEU H H 67 7.720 7.720 7.999 -0.279 18509 9007 1 18 . 1 1 68 68 SER N N 68 110.842 110.842 115.649 -4.807 18509 9008 1 18 . 1 1 68 68 SER CA C 68 55.953 55.953 58.438 -2.485 18509 9009 1 18 . 1 1 68 68 SER H H 68 7.428 7.428 7.997 -0.569 18509 9010 1 18 . 1 1 69 69 ARG N N 69 120.782 120.782 119.807 0.975 18509 9011 1 18 . 1 1 69 69 ARG C C 69 173.381 173.381 176.287 -2.906 18509 9012 1 18 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.637 -5.094 18509 9013 1 18 . 1 1 69 69 ARG H H 69 8.508 8.508 7.891 0.617 18509 9014 1 18 . 1 1 70 70 LYS N N 70 118.055 118.055 117.898 0.157 18509 9015 1 18 . 1 1 70 70 LYS C C 70 169.994 169.994 176.564 -6.570 18509 9016 1 18 . 1 1 70 70 LYS CA C 70 52.596 52.596 55.002 -2.406 18509 9017 1 18 . 1 1 70 70 LYS H H 70 8.745 8.745 7.663 1.082 18509 9018 1 18 . 1 1 71 71 HIS N N 71 111.871 111.871 117.168 -5.297 18509 9019 1 18 . 1 1 71 71 HIS C C 71 171.534 171.534 174.638 -3.104 18509 9020 1 18 . 1 1 71 71 HIS CA C 71 52.549 52.549 59.530 -6.981 18509 9021 1 18 . 1 1 71 71 HIS H H 71 7.152 7.152 8.516 -1.364 18509 9022 1 18 . 1 1 72 72 GLY N N 72 112.910 112.910 104.529 8.381 18509 9023 1 18 . 1 1 72 72 GLY C C 72 168.634 168.634 171.524 -2.890 18509 9024 1 18 . 1 1 72 72 GLY CA C 72 41.274 41.274 44.951 -3.677 18509 9025 1 18 . 1 1 72 72 GLY H H 72 7.209 7.209 7.893 -0.684 18509 9026 1 18 . 1 1 73 73 GLY N N 73 105.207 105.207 105.370 -0.163 18509 9027 1 18 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.723 -2.502 18509 9028 1 18 . 1 1 73 73 GLY H H 73 8.789 8.789 8.025 0.764 18509 9029 1 18 . 1 1 74 74 PRO C C 74 175.753 175.753 176.955 -1.202 18509 9030 1 18 . 1 1 75 75 LYS N N 75 114.868 114.868 113.770 1.098 18509 9031 1 18 . 1 1 75 75 LYS C C 75 173.640 173.640 174.903 -1.263 18509 9032 1 18 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.700 -5.597 18509 9033 1 18 . 1 1 75 75 LYS H H 75 8.651 8.651 7.813 0.838 18509 9034 1 18 . 1 1 76 76 ASP N N 76 120.414 120.414 116.145 4.269 18509 9035 1 18 . 1 1 76 76 ASP C C 76 172.557 172.557 174.217 -1.660 18509 9036 1 18 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.053 -2.744 18509 9037 1 18 . 1 1 76 76 ASP H H 76 7.461 7.461 7.779 -0.318 18509 9038 1 18 . 1 1 77 77 GLU N N 77 120.820 120.820 122.271 -1.451 18509 9039 1 18 . 1 1 77 77 GLU C C 77 174.101 174.101 175.210 -1.109 18509 9040 1 18 . 1 1 77 77 GLU CA C 77 55.513 55.513 56.846 -1.333 18509 9041 1 18 . 1 1 77 77 GLU H H 77 8.315 8.315 8.553 -0.238 18509 9042 1 18 . 1 1 78 78 GLU N N 78 119.251 119.251 119.476 -0.225 18509 9043 1 18 . 1 1 78 78 GLU C C 78 168.285 168.285 176.970 -8.685 18509 9044 1 18 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.255 -5.177 18509 9045 1 18 . 1 1 78 78 GLU H H 78 8.109 8.109 8.289 -0.180 18509 9046 1 18 . 1 1 79 79 ARG N N 79 118.991 118.991 121.418 -2.427 18509 9047 1 18 . 1 1 79 79 ARG C C 79 172.123 172.123 177.473 -5.350 18509 9048 1 18 . 1 1 79 79 ARG CA C 79 51.074 51.074 58.501 -7.427 18509 9049 1 18 . 1 1 79 79 ARG H H 79 6.999 6.999 8.421 -1.422 18509 9050 1 18 . 1 1 80 80 HIS N N 80 118.000 118.000 114.718 3.282 18509 9051 1 18 . 1 1 80 80 HIS CA C 80 49.953 49.953 57.558 -7.605 18509 9052 1 18 . 1 1 80 80 HIS H H 80 8.355 8.355 8.312 0.043 18509 9053 1 18 . 1 1 81 81 VAL C C 81 173.460 173.460 176.554 -3.094 18509 9054 1 18 . 1 1 82 82 GLY N N 82 97.322 97.322 110.257 -12.935 18509 9055 1 18 . 1 1 82 82 GLY C C 82 170.370 170.370 174.362 -3.992 18509 9056 1 18 . 1 1 82 82 GLY CA C 82 42.688 42.688 46.788 -4.100 18509 9057 1 18 . 1 1 82 82 GLY H H 82 8.487 8.487 8.509 -0.022 18509 9058 1 18 . 1 1 83 83 ASP N N 83 120.890 120.890 123.717 -2.827 18509 9059 1 18 . 1 1 83 83 ASP C C 83 168.737 168.737 175.976 -7.239 18509 9060 1 18 . 1 1 83 83 ASP CA C 83 52.918 52.918 54.202 -1.284 18509 9061 1 18 . 1 1 83 83 ASP H H 83 7.127 7.127 8.068 -0.941 18509 9062 1 18 . 1 1 84 84 LEU N N 84 120.154 120.154 119.856 0.298 18509 9063 1 18 . 1 1 84 84 LEU C C 84 173.212 173.212 174.487 -1.275 18509 9064 1 18 . 1 1 84 84 LEU CA C 84 50.433 50.433 53.540 -3.107 18509 9065 1 18 . 1 1 84 84 LEU H H 84 7.128 7.128 8.131 -1.003 18509 9066 1 18 . 1 1 85 85 GLY N N 85 106.867 106.867 109.588 -2.721 18509 9067 1 18 . 1 1 85 85 GLY C C 85 167.654 167.654 171.188 -3.534 18509 9068 1 18 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.081 -2.070 18509 9069 1 18 . 1 1 85 85 GLY H H 85 8.260 8.260 6.673 1.587 18509 9070 1 18 . 1 1 86 86 ASN N N 86 117.454 117.454 116.332 1.122 18509 9071 1 18 . 1 1 86 86 ASN C C 86 173.942 173.942 172.931 1.011 18509 9072 1 18 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.414 -3.148 18509 9073 1 18 . 1 1 86 86 ASN H H 86 8.041 8.041 8.276 -0.235 18509 9074 1 18 . 1 1 87 87 VAL N N 87 113.370 113.370 120.459 -7.089 18509 9075 1 18 . 1 1 87 87 VAL C C 87 171.526 171.526 173.973 -2.447 18509 9076 1 18 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.731 -5.023 18509 9077 1 18 . 1 1 87 87 VAL H H 87 8.960 8.960 8.301 0.659 18509 9078 1 18 . 1 1 88 88 THR N N 88 117.939 117.939 123.698 -5.759 18509 9079 1 18 . 1 1 88 88 THR C C 88 170.367 170.367 172.401 -2.034 18509 9080 1 18 . 1 1 88 88 THR CA C 88 58.694 58.694 62.077 -3.383 18509 9081 1 18 . 1 1 88 88 THR H H 88 8.681 8.681 8.368 0.313 18509 9082 1 18 . 1 1 89 89 ALA N N 89 128.674 128.674 129.560 -0.886 18509 9083 1 18 . 1 1 89 89 ALA C C 89 174.480 174.480 175.603 -1.123 18509 9084 1 18 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.886 -4.517 18509 9085 1 18 . 1 1 89 89 ALA H H 89 9.377 9.377 8.311 1.066 18509 9086 1 18 . 1 1 90 90 ASP N N 90 124.235 124.235 123.919 0.316 18509 9087 1 18 . 1 1 90 90 ASP C C 90 173.825 173.825 176.614 -2.789 18509 9088 1 18 . 1 1 90 90 ASP CA C 90 49.347 49.347 54.405 -5.058 18509 9089 1 18 . 1 1 90 90 ASP H H 90 8.455 8.455 8.860 -0.405 18509 9090 1 18 . 1 1 91 91 LYS N N 91 114.942 114.942 119.971 -5.029 18509 9091 1 18 . 1 1 91 91 LYS C C 91 174.101 174.101 176.440 -2.339 18509 9092 1 18 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.456 -3.177 18509 9093 1 18 . 1 1 91 91 LYS H H 91 8.231 8.231 8.517 -0.286 18509 9094 1 18 . 1 1 92 92 ASP N N 92 119.251 119.251 113.296 5.955 18509 9095 1 18 . 1 1 92 92 ASP C C 92 173.020 173.020 174.936 -1.916 18509 9096 1 18 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.915 -2.788 18509 9097 1 18 . 1 1 92 92 ASP H H 92 8.109 8.109 8.040 0.069 18509 9098 1 18 . 1 1 93 93 GLY N N 93 110.868 110.868 107.693 3.175 18509 9099 1 18 . 1 1 93 93 GLY C C 93 169.706 169.706 172.932 -3.226 18509 9100 1 18 . 1 1 93 93 GLY CA C 93 43.763 43.763 44.827 -1.064 18509 9101 1 18 . 1 1 93 93 GLY H H 93 8.405 8.405 7.675 0.730 18509 9102 1 18 . 1 1 94 94 VAL N N 94 118.755 118.755 114.373 4.382 18509 9103 1 18 . 1 1 94 94 VAL C C 94 173.510 173.510 173.955 -0.445 18509 9104 1 18 . 1 1 94 94 VAL CA C 94 58.185 58.185 60.288 -2.103 18509 9105 1 18 . 1 1 94 94 VAL H H 94 7.814 7.814 7.543 0.271 18509 9106 1 18 . 1 1 95 95 ALA N N 95 131.313 131.313 129.041 2.272 18509 9107 1 18 . 1 1 95 95 ALA C C 95 171.635 171.635 175.919 -4.284 18509 9108 1 18 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.064 -3.150 18509 9109 1 18 . 1 1 95 95 ALA H H 95 9.763 9.763 8.846 0.917 18509 9110 1 18 . 1 1 96 96 ASP N N 96 125.170 125.170 123.821 1.349 18509 9111 1 18 . 1 1 96 96 ASP C C 96 172.336 172.336 175.654 -3.318 18509 9112 1 18 . 1 1 96 96 ASP H H 96 8.515 8.515 8.125 0.390 18509 9113 1 18 . 1 1 97 97 VAL N N 97 125.879 125.879 125.337 0.542 18509 9114 1 18 . 1 1 97 97 VAL C C 97 173.488 173.488 175.891 -2.403 18509 9115 1 18 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.226 -2.983 18509 9116 1 18 . 1 1 97 97 VAL H H 97 8.703 8.703 8.499 0.204 18509 9117 1 18 . 1 1 98 98 SER N N 98 123.017 123.017 125.366 -2.349 18509 9118 1 18 . 1 1 98 98 SER C C 98 169.715 169.715 173.531 -3.816 18509 9119 1 18 . 1 1 98 98 SER CA C 98 55.068 55.068 58.393 -3.325 18509 9120 1 18 . 1 1 98 98 SER H H 98 8.784 8.784 9.100 -0.316 18509 9121 1 18 . 1 1 99 99 ILE N N 99 125.807 125.807 126.537 -0.730 18509 9122 1 18 . 1 1 99 99 ILE C C 99 171.321 171.321 174.488 -3.167 18509 9123 1 18 . 1 1 99 99 ILE CA C 99 57.155 57.155 60.870 -3.716 18509 9124 1 18 . 1 1 99 99 ILE H H 99 9.411 9.411 7.890 1.521 18509 9125 1 18 . 1 1 100 100 GLU N N 100 124.068 124.068 128.319 -4.251 18509 9126 1 18 . 1 1 100 100 GLU C C 100 172.098 172.098 174.695 -2.597 18509 9127 1 18 . 1 1 100 100 GLU CA C 100 52.290 52.290 53.933 -1.643 18509 9128 1 18 . 1 1 100 100 GLU H H 100 8.652 8.652 8.410 0.242 18509 9129 1 18 . 1 1 101 101 ASP N N 101 126.109 126.109 121.257 4.852 18509 9130 1 18 . 1 1 101 101 ASP C C 101 171.144 171.144 175.258 -4.114 18509 9131 1 18 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.937 -2.518 18509 9132 1 18 . 1 1 101 101 ASP H H 101 9.317 9.317 8.559 0.758 18509 9133 1 18 . 1 1 102 102 SER N N 102 118.470 118.470 120.628 -2.158 18509 9134 1 18 . 1 1 102 102 SER C C 102 171.596 171.596 175.129 -3.533 18509 9135 1 18 . 1 1 102 102 SER CA C 102 55.245 55.245 56.916 -1.671 18509 9136 1 18 . 1 1 102 102 SER H H 102 8.933 8.933 7.976 0.957 18509 9137 1 18 . 1 1 103 103 VAL N N 103 123.179 123.179 127.038 -3.859 18509 9138 1 18 . 1 1 103 103 VAL CA C 103 61.450 61.450 65.562 -4.112 18509 9139 1 18 . 1 1 103 103 VAL H H 103 8.148 8.148 8.750 -0.602 18509 9140 1 18 . 1 1 104 104 ILE C C 104 169.576 169.576 175.180 -5.604 18509 9141 1 18 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.154 0.040 18509 9142 1 18 . 1 1 105 105 SER N N 105 107.618 107.618 119.117 -11.499 18509 9143 1 18 . 1 1 105 105 SER C C 105 170.046 170.046 173.488 -3.442 18509 9144 1 18 . 1 1 105 105 SER CA C 105 52.550 52.550 58.443 -5.893 18509 9145 1 18 . 1 1 105 105 SER H H 105 6.988 6.988 7.863 -0.875 18509 9146 1 18 . 1 1 106 106 LEU N N 106 120.137 120.137 126.808 -6.671 18509 9147 1 18 . 1 1 106 106 LEU H H 106 8.313 8.313 8.058 0.255 18509 9148 1 18 . 1 1 107 107 SER C C 107 170.701 170.701 174.251 -3.550 18509 9149 1 18 . 1 1 107 107 SER CA C 107 54.540 54.540 59.615 -5.075 18509 9150 1 18 . 1 1 108 108 GLY N N 108 107.603 107.603 111.912 -4.309 18509 9151 1 18 . 1 1 108 108 GLY C C 108 173.128 173.128 173.287 -0.159 18509 9152 1 18 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.078 -2.791 18509 9153 1 18 . 1 1 108 108 GLY H H 108 8.717 8.717 8.196 0.521 18509 9154 1 18 . 1 1 109 109 ASP N N 109 120.664 120.664 124.539 -3.875 18509 9155 1 18 . 1 1 109 109 ASP C C 109 171.904 171.904 176.776 -4.872 18509 9156 1 18 . 1 1 109 109 ASP H H 109 9.019 9.019 8.800 0.219 18509 9157 1 18 . 1 1 110 110 HIS N N 110 116.324 116.324 119.132 -2.808 18509 9158 1 18 . 1 1 110 110 HIS H H 110 9.283 9.283 8.453 0.830 18509 9159 1 18 . 1 1 111 111 SER N N 111 110.225 110.225 111.466 -1.241 18509 9160 1 18 . 1 1 111 111 SER CA C 111 54.681 54.681 59.168 -4.487 18509 9161 1 18 . 1 1 111 111 SER H H 111 7.156 7.156 7.926 -0.770 18509 9162 1 18 . 1 1 112 112 ILE N N 112 117.053 117.053 119.970 -2.917 18509 9163 1 18 . 1 1 112 112 ILE C C 112 171.419 171.419 176.612 -5.193 18509 9164 1 18 . 1 1 112 112 ILE CA C 112 57.239 57.239 62.893 -5.654 18509 9165 1 18 . 1 1 112 112 ILE H H 112 7.837 7.837 7.755 0.082 18509 9166 1 18 . 1 1 113 113 ILE N N 113 121.032 121.032 118.735 2.297 18509 9167 1 18 . 1 1 113 113 ILE C C 113 173.604 173.604 175.693 -2.089 18509 9168 1 18 . 1 1 113 113 ILE CA C 113 58.318 58.318 61.097 -2.779 18509 9169 1 18 . 1 1 113 113 ILE H H 113 7.592 7.592 7.697 -0.105 18509 9170 1 18 . 1 1 114 114 GLY N N 114 112.661 112.661 107.257 5.404 18509 9171 1 18 . 1 1 114 114 GLY C C 114 169.739 169.739 173.341 -3.602 18509 9172 1 18 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.740 -2.830 18509 9173 1 18 . 1 1 114 114 GLY H H 114 9.575 9.575 8.625 0.950 18509 9174 1 18 . 1 1 115 115 ARG N N 115 118.398 118.398 117.676 0.722 18509 9175 1 18 . 1 1 115 115 ARG C C 115 171.079 171.079 173.685 -2.606 18509 9176 1 18 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.508 -2.845 18509 9177 1 18 . 1 1 115 115 ARG H H 115 7.464 7.464 7.672 -0.208 18509 9178 1 18 . 1 1 116 116 THR N N 116 112.218 112.218 115.872 -3.654 18509 9179 1 18 . 1 1 116 116 THR C C 116 169.821 169.821 175.421 -5.600 18509 9180 1 18 . 1 1 116 116 THR CA C 116 59.633 59.633 60.728 -1.095 18509 9181 1 18 . 1 1 116 116 THR H H 116 6.677 6.677 8.331 -1.654 18509 9182 1 18 . 1 1 117 117 LEU N N 117 129.477 129.477 122.424 7.053 18509 9183 1 18 . 1 1 117 117 LEU C C 117 171.126 171.126 175.337 -4.211 18509 9184 1 18 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.197 -3.782 18509 9185 1 18 . 1 1 117 117 LEU H H 117 8.799 8.799 8.652 0.147 18509 9186 1 18 . 1 1 118 118 VAL N N 118 125.091 125.091 122.981 2.110 18509 9187 1 18 . 1 1 118 118 VAL C C 118 170.267 170.267 174.738 -4.471 18509 9188 1 18 . 1 1 118 118 VAL CA C 118 58.139 58.139 60.214 -2.075 18509 9189 1 18 . 1 1 118 118 VAL H H 118 8.906 8.906 9.171 -0.265 18509 9190 1 18 . 1 1 119 119 VAL N N 119 120.716 120.716 125.514 -4.798 18509 9191 1 18 . 1 1 119 119 VAL C C 119 171.175 171.175 174.224 -3.049 18509 9192 1 18 . 1 1 119 119 VAL CA C 119 55.271 55.271 60.786 -5.515 18509 9193 1 18 . 1 1 119 119 VAL H H 119 7.982 7.982 8.011 -0.029 18509 9194 1 18 . 1 1 120 120 HIS N N 120 125.052 125.052 124.362 0.690 18509 9195 1 18 . 1 1 120 120 HIS C C 120 172.599 172.599 173.930 -1.331 18509 9196 1 18 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.300 -0.906 18509 9197 1 18 . 1 1 120 120 HIS H H 120 8.935 8.935 8.462 0.473 18509 9198 1 18 . 1 1 121 121 GLU N N 121 121.453 121.453 120.796 0.657 18509 9199 1 18 . 1 1 121 121 GLU C C 121 172.304 172.304 175.694 -3.390 18509 9200 1 18 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.898 -0.808 18509 9201 1 18 . 1 1 121 121 GLU H H 121 9.178 9.178 7.670 1.508 18509 9202 1 18 . 1 1 122 122 LYS N N 122 115.248 115.248 122.125 -6.877 18509 9203 1 18 . 1 1 122 122 LYS C C 122 171.523 171.523 174.097 -2.574 18509 9204 1 18 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.491 -4.872 18509 9205 1 18 . 1 1 122 122 LYS H H 122 8.478 8.478 7.942 0.535 18509 9206 1 18 . 1 1 123 123 ALA N N 123 120.866 120.866 124.300 -3.434 18509 9207 1 18 . 1 1 123 123 ALA C C 123 173.219 173.219 175.588 -2.369 18509 9208 1 18 . 1 1 123 123 ALA CA C 123 48.850 48.850 51.570 -2.720 18509 9209 1 18 . 1 1 123 123 ALA H H 123 7.796 7.796 8.747 -0.951 18509 9210 1 18 . 1 1 124 124 ASP N N 124 121.799 121.799 123.556 -1.757 18509 9211 1 18 . 1 1 124 124 ASP C C 124 174.458 174.458 174.849 -0.391 18509 9212 1 18 . 1 1 124 124 ASP CA C 124 49.408 49.408 54.311 -4.903 18509 9213 1 18 . 1 1 124 124 ASP H H 124 10.165 10.165 9.127 1.038 18509 9214 1 18 . 1 1 125 125 ASP N N 125 129.369 129.369 114.960 14.409 18509 9215 1 18 . 1 1 125 125 ASP C C 125 175.231 175.231 175.332 -0.101 18509 9216 1 18 . 1 1 125 125 ASP CA C 125 50.939 50.939 54.287 -3.348 18509 9217 1 18 . 1 1 125 125 ASP H H 125 10.055 10.055 8.328 1.727 18509 9218 1 18 . 1 1 126 126 LEU N N 126 117.190 117.190 117.123 0.067 18509 9219 1 18 . 1 1 126 126 LEU C C 126 173.964 173.964 176.567 -2.603 18509 9220 1 18 . 1 1 126 126 LEU H H 126 10.483 10.483 8.111 2.372 18509 9221 1 18 . 1 1 127 127 GLY N N 127 103.809 103.809 105.491 -1.682 18509 9222 1 18 . 1 1 127 127 GLY CA C 127 42.878 42.878 45.184 -2.306 18509 9223 1 18 . 1 1 127 127 GLY H H 127 8.637 8.637 8.502 0.135 18509 9224 1 18 . 1 1 128 128 LYS N N 128 118.290 118.290 121.187 -2.897 18509 9225 1 18 . 1 1 128 128 LYS CA C 128 51.740 51.740 54.158 -2.418 18509 9226 1 18 . 1 1 128 128 LYS H H 128 7.158 7.158 8.570 -1.412 18509 9227 1 18 . 1 1 129 129 GLY N N 129 108.507 108.507 109.036 -0.529 18509 9228 1 18 . 1 1 129 129 GLY C C 129 171.524 171.524 174.343 -2.819 18509 9229 1 18 . 1 1 129 129 GLY CA C 129 42.113 42.113 45.353 -3.240 18509 9230 1 18 . 1 1 129 129 GLY H H 129 8.913 8.913 8.415 0.498 18509 9231 1 18 . 1 1 130 130 GLY N N 130 108.537 108.537 114.958 -6.421 18509 9232 1 18 . 1 1 130 130 GLY C C 130 169.994 169.994 173.420 -3.426 18509 9233 1 18 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.689 -2.270 18509 9234 1 18 . 1 1 130 130 GLY H H 130 8.723 8.723 8.159 0.564 18509 9235 1 18 . 1 1 131 131 ASN N N 131 111.951 111.951 120.200 -8.249 18509 9236 1 18 . 1 1 131 131 ASN C C 131 172.236 172.236 176.085 -3.849 18509 9237 1 18 . 1 1 131 131 ASN H H 131 7.152 7.152 7.886 -0.734 18509 9238 1 18 . 1 1 132 132 GLU N N 132 120.461 120.461 120.617 -0.156 18509 9239 1 18 . 1 1 132 132 GLU C C 132 171.084 171.084 178.492 -7.408 18509 9240 1 18 . 1 1 132 132 GLU H H 132 8.935 8.935 8.818 0.117 18509 9241 1 18 . 1 1 133 133 GLU N N 133 120.137 120.137 118.860 1.277 18509 9242 1 18 . 1 1 133 133 GLU C C 133 176.239 176.239 178.486 -2.247 18509 9243 1 18 . 1 1 133 133 GLU H H 133 8.775 8.775 8.838 -0.063 18509 9244 1 18 . 1 1 134 134 SER N N 134 114.981 114.981 116.480 -1.499 18509 9245 1 18 . 1 1 134 134 SER CA C 134 59.046 59.046 61.687 -2.641 18509 9246 1 18 . 1 1 134 134 SER H H 134 8.117 8.117 8.241 -0.124 18509 9247 1 18 . 1 1 135 135 THR N N 135 102.263 102.263 114.099 -11.836 18509 9248 1 18 . 1 1 135 135 THR C C 135 172.804 172.804 176.193 -3.389 18509 9249 1 18 . 1 1 135 135 THR CA C 135 60.029 60.029 65.603 -5.574 18509 9250 1 18 . 1 1 135 135 THR H H 135 7.206 7.206 8.264 -1.058 18509 9251 1 18 . 1 1 136 136 LYS N N 136 122.108 122.108 120.381 1.727 18509 9252 1 18 . 1 1 136 136 LYS H H 136 7.884 7.884 7.425 0.460 18509 9253 1 18 . 1 1 137 137 THR N N 137 105.718 105.718 112.913 -7.195 18509 9254 1 18 . 1 1 137 137 THR H H 137 8.630 8.630 7.324 1.306 18509 9255 1 18 . 1 1 138 138 GLY N N 138 111.372 111.372 110.128 1.244 18509 9256 1 18 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.293 -2.810 18509 9257 1 18 . 1 1 138 138 GLY H H 138 7.426 7.426 7.514 -0.088 18509 9258 1 18 . 1 1 139 139 ASN N N 139 107.496 107.496 118.907 -11.411 18509 9259 1 18 . 1 1 139 139 ASN H H 139 7.545 7.545 7.913 -0.368 18509 9260 1 18 . 1 1 140 140 ALA N N 140 114.542 114.542 126.682 -12.140 18509 9261 1 18 . 1 1 140 140 ALA C C 140 173.571 173.571 175.504 -1.933 18509 9262 1 18 . 1 1 140 140 ALA H H 140 6.368 6.368 7.692 -1.324 18509 9263 1 18 . 1 1 141 141 GLY N N 141 105.287 105.287 106.523 -1.236 18509 9264 1 18 . 1 1 141 141 GLY C C 141 173.542 173.542 175.997 -2.455 18509 9265 1 18 . 1 1 141 141 GLY H H 141 8.271 8.271 8.532 -0.261 18509 9266 1 18 . 1 1 142 142 SER N N 142 118.771 118.771 119.968 -1.197 18509 9267 1 18 . 1 1 142 142 SER C C 142 170.188 170.188 175.395 -5.207 18509 9268 1 18 . 1 1 142 142 SER H H 142 9.196 9.196 8.812 0.384 18509 9269 1 18 . 1 1 143 143 ARG N N 143 120.189 120.189 116.394 3.795 18509 9270 1 18 . 1 1 143 143 ARG C C 143 171.596 171.596 176.261 -4.665 18509 9271 1 18 . 1 1 143 143 ARG H H 143 8.943 8.943 8.289 0.654 18509 9272 1 18 . 1 1 144 144 LEU N N 144 122.907 122.907 121.415 1.492 18509 9273 1 18 . 1 1 144 144 LEU C C 144 174.393 174.393 175.768 -1.375 18509 9274 1 18 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.560 -3.185 18509 9275 1 18 . 1 1 144 144 LEU H H 144 8.395 8.395 7.744 0.651 18509 9276 1 18 . 1 1 145 145 ALA N N 145 114.159 114.159 117.921 -3.762 18509 9277 1 18 . 1 1 145 145 ALA C C 145 171.752 171.752 175.284 -3.532 18509 9278 1 18 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.378 -3.249 18509 9279 1 18 . 1 1 145 145 ALA H H 145 7.356 7.356 7.433 -0.077 18509 9280 1 18 . 1 1 146 146 CYS N N 146 110.738 110.738 120.421 -9.683 18509 9281 1 18 . 1 1 146 146 CYS C C 146 170.087 170.087 173.956 -3.869 18509 9282 1 18 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.392 -6.315 18509 9283 1 18 . 1 1 146 146 CYS H H 146 9.008 9.008 8.230 0.778 18509 9284 1 18 . 1 1 147 147 GLY N N 147 106.461 106.461 108.458 -1.997 18509 9285 1 18 . 1 1 147 147 GLY C C 147 167.909 167.909 172.270 -4.361 18509 9286 1 18 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.353 -2.679 18509 9287 1 18 . 1 1 147 147 GLY H H 147 8.018 8.018 8.238 -0.220 18509 9288 1 18 . 1 1 148 148 VAL N N 148 124.054 124.054 124.037 0.017 18509 9289 1 18 . 1 1 148 148 VAL C C 148 172.084 172.084 175.293 -3.209 18509 9290 1 18 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.889 -3.254 18509 9291 1 18 . 1 1 148 148 VAL H H 148 8.434 8.434 8.695 -0.261 18509 9292 1 18 . 1 1 149 149 ILE N N 149 126.918 126.918 129.597 -2.679 18509 9293 1 18 . 1 1 149 149 ILE C C 149 171.804 171.804 174.244 -2.440 18509 9294 1 18 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.562 -0.378 18509 9295 1 18 . 1 1 149 149 ILE H H 149 8.613 8.613 8.490 0.123 18509 9296 1 18 . 1 1 150 150 GLY N N 150 116.493 116.493 115.556 0.937 18509 9297 1 18 . 1 1 150 150 GLY C C 150 170.188 170.188 172.376 -2.188 18509 9298 1 18 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.463 -4.343 18509 9299 1 18 . 1 1 150 150 GLY H H 150 9.283 9.283 7.511 1.772 18509 9300 1 18 . 1 1 151 151 ILE N N 151 120.189 120.189 120.198 -0.009 18509 9301 1 18 . 1 1 151 151 ILE C C 151 172.231 172.231 175.187 -2.956 18509 9302 1 18 . 1 1 151 151 ILE CA C 151 60.372 60.372 62.840 -2.468 18509 9303 1 18 . 1 1 151 151 ILE H H 151 8.943 8.943 8.355 0.588 18509 9304 1 18 . 1 1 152 152 ALA N N 152 129.719 129.719 130.642 -0.923 18509 9305 1 18 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.857 -5.085 18509 9306 1 18 . 1 1 152 152 ALA H H 152 8.170 8.170 8.292 -0.122 18509 9307 1 19 . 1 1 2 2 THR C C 2 170.139 170.139 174.333 -4.194 18509 9308 1 19 . 1 1 3 3 LYS N N 3 123.998 123.998 116.491 7.507 18509 9309 1 19 . 1 1 3 3 LYS C C 3 171.607 171.607 173.987 -2.380 18509 9310 1 19 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.895 -3.717 18509 9311 1 19 . 1 1 3 3 LYS H H 3 8.666 8.666 7.477 1.189 18509 9312 1 19 . 1 1 4 4 ALA N N 4 123.295 123.295 121.076 2.219 18509 9313 1 19 . 1 1 4 4 ALA C C 4 172.145 172.145 175.427 -3.282 18509 9314 1 19 . 1 1 4 4 ALA CA C 4 47.504 47.504 51.357 -3.853 18509 9315 1 19 . 1 1 4 4 ALA H H 4 9.116 9.116 8.134 0.982 18509 9316 1 19 . 1 1 5 5 VAL N N 5 121.466 121.466 119.251 2.215 18509 9317 1 19 . 1 1 5 5 VAL C C 5 167.836 167.836 173.989 -6.153 18509 9318 1 19 . 1 1 5 5 VAL CA C 5 56.875 56.875 61.606 -4.731 18509 9319 1 19 . 1 1 5 5 VAL H H 5 9.545 9.545 8.840 0.705 18509 9320 1 19 . 1 1 6 6 ALA N N 6 125.984 125.984 130.520 -4.536 18509 9321 1 19 . 1 1 6 6 ALA C C 6 171.607 171.607 174.850 -3.243 18509 9322 1 19 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.119 -2.648 18509 9323 1 19 . 1 1 6 6 ALA H H 6 9.177 9.177 8.093 1.084 18509 9324 1 19 . 1 1 7 7 VAL N N 7 123.600 123.600 122.928 0.672 18509 9325 1 19 . 1 1 7 7 VAL C C 7 172.244 172.244 173.883 -1.639 18509 9326 1 19 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.561 -2.085 18509 9327 1 19 . 1 1 7 7 VAL H H 7 9.116 9.116 7.729 1.387 18509 9328 1 19 . 1 1 8 8 LEU N N 8 126.455 126.455 124.364 2.091 18509 9329 1 19 . 1 1 8 8 LEU C C 8 172.557 172.557 174.742 -2.185 18509 9330 1 19 . 1 1 8 8 LEU CA C 8 51.052 51.052 52.936 -1.884 18509 9331 1 19 . 1 1 8 8 LEU H H 8 8.916 8.916 8.356 0.560 18509 9332 1 19 . 1 1 9 9 LYS N N 9 120.820 120.820 121.302 -0.482 18509 9333 1 19 . 1 1 9 9 LYS C C 9 172.509 172.509 175.075 -2.566 18509 9334 1 19 . 1 1 9 9 LYS CA C 9 51.897 51.897 56.181 -4.285 18509 9335 1 19 . 1 1 9 9 LYS H H 9 8.315 8.315 8.622 -0.307 18509 9336 1 19 . 1 1 10 10 GLY N N 10 111.249 111.249 112.004 -0.755 18509 9337 1 19 . 1 1 10 10 GLY C C 10 169.847 169.847 173.218 -3.371 18509 9338 1 19 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.252 -2.977 18509 9339 1 19 . 1 1 10 10 GLY H H 10 8.968 8.968 8.039 0.929 18509 9340 1 19 . 1 1 11 11 ASP N N 11 120.904 120.904 121.035 -0.131 18509 9341 1 19 . 1 1 11 11 ASP C C 11 173.132 173.132 177.304 -4.172 18509 9342 1 19 . 1 1 11 11 ASP CA C 11 51.317 51.317 56.087 -4.770 18509 9343 1 19 . 1 1 11 11 ASP H H 11 8.745 8.745 8.682 0.063 18509 9344 1 19 . 1 1 12 12 GLY N N 12 109.862 109.862 107.363 2.499 18509 9345 1 19 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.280 -2.080 18509 9346 1 19 . 1 1 12 12 GLY H H 12 7.985 7.985 8.176 -0.191 18509 9347 1 19 . 1 1 13 13 PRO C C 13 173.640 173.640 175.589 -1.949 18509 9348 1 19 . 1 1 14 14 VAL N N 14 120.414 120.414 117.395 3.019 18509 9349 1 19 . 1 1 14 14 VAL C C 14 172.804 172.804 174.531 -1.727 18509 9350 1 19 . 1 1 14 14 VAL CA C 14 59.884 59.884 59.461 0.423 18509 9351 1 19 . 1 1 14 14 VAL H H 14 7.476 7.476 8.151 -0.675 18509 9352 1 19 . 1 1 15 15 GLN N N 15 122.664 122.664 125.133 -2.469 18509 9353 1 19 . 1 1 15 15 GLN C C 15 171.168 171.168 174.166 -2.998 18509 9354 1 19 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.821 -4.142 18509 9355 1 19 . 1 1 15 15 GLN H H 15 7.938 7.938 8.550 -0.612 18509 9356 1 19 . 1 1 16 16 GLY N N 16 107.018 107.018 111.428 -4.410 18509 9357 1 19 . 1 1 16 16 GLY C C 16 167.726 167.726 171.239 -3.513 18509 9358 1 19 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.376 -1.751 18509 9359 1 19 . 1 1 16 16 GLY H H 16 8.288 8.288 8.506 -0.218 18509 9360 1 19 . 1 1 17 17 ILE N N 17 120.248 120.248 121.493 -1.245 18509 9361 1 19 . 1 1 17 17 ILE C C 17 171.194 171.194 173.642 -2.448 18509 9362 1 19 . 1 1 17 17 ILE CA C 17 58.497 58.497 58.600 -0.103 18509 9363 1 19 . 1 1 17 17 ILE H H 17 7.948 7.948 7.866 0.082 18509 9364 1 19 . 1 1 18 18 ILE N N 18 125.851 125.851 125.128 0.723 18509 9365 1 19 . 1 1 18 18 ILE C C 18 168.889 168.889 174.161 -5.272 18509 9366 1 19 . 1 1 18 18 ILE CA C 18 53.431 53.431 57.885 -4.454 18509 9367 1 19 . 1 1 18 18 ILE H H 18 8.725 8.725 8.109 0.616 18509 9368 1 19 . 1 1 19 19 ASN N N 19 123.256 123.256 123.376 -0.120 18509 9369 1 19 . 1 1 19 19 ASN C C 19 168.903 168.903 173.539 -4.636 18509 9370 1 19 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.912 -2.824 18509 9371 1 19 . 1 1 19 19 ASN H H 19 8.727 8.727 7.878 0.849 18509 9372 1 19 . 1 1 20 20 PHE N N 20 113.849 113.849 121.195 -7.346 18509 9373 1 19 . 1 1 20 20 PHE C C 20 173.219 173.219 173.664 -0.445 18509 9374 1 19 . 1 1 20 20 PHE CA C 20 52.058 52.058 57.160 -5.102 18509 9375 1 19 . 1 1 20 20 PHE H H 20 8.399 8.399 8.610 -0.211 18509 9376 1 19 . 1 1 21 21 GLU N N 21 121.454 121.454 125.972 -4.518 18509 9377 1 19 . 1 1 21 21 GLU C C 21 170.280 170.280 174.136 -3.856 18509 9378 1 19 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.655 -1.611 18509 9379 1 19 . 1 1 21 21 GLU H H 21 9.526 9.526 7.985 1.541 18509 9380 1 19 . 1 1 22 22 GLN N N 22 130.340 130.340 122.244 8.096 18509 9381 1 19 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.158 -2.978 18509 9382 1 19 . 1 1 22 22 GLN H H 22 9.305 9.305 8.278 1.027 18509 9383 1 19 . 1 1 23 23 LYS N N 23 128.657 128.657 120.784 7.873 18509 9384 1 19 . 1 1 23 23 LYS CA C 23 57.241 57.241 59.377 -2.136 18509 9385 1 19 . 1 1 23 23 LYS H H 23 9.088 9.088 8.946 0.142 18509 9386 1 19 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.619 -7.227 18509 9387 1 19 . 1 1 25 25 SER CA C 25 58.078 58.078 59.986 -1.908 18509 9388 1 19 . 1 1 27 27 GLY N N 27 108.125 108.125 112.896 -4.771 18509 9389 1 19 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.944 -2.019 18509 9390 1 19 . 1 1 27 27 GLY H H 27 8.032 8.032 8.116 -0.084 18509 9391 1 19 . 1 1 28 28 PRO C C 28 173.128 173.128 175.921 -2.793 18509 9392 1 19 . 1 1 29 29 VAL N N 29 121.267 121.267 124.402 -3.135 18509 9393 1 19 . 1 1 29 29 VAL C C 29 172.198 172.198 175.289 -3.091 18509 9394 1 19 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.241 -3.521 18509 9395 1 19 . 1 1 29 29 VAL H H 29 9.089 9.089 8.126 0.963 18509 9396 1 19 . 1 1 30 30 LYS N N 30 127.589 127.589 129.696 -2.107 18509 9397 1 19 . 1 1 30 30 LYS C C 30 172.098 172.098 175.172 -3.074 18509 9398 1 19 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.990 -3.349 18509 9399 1 19 . 1 1 30 30 LYS H H 30 9.200 9.200 8.469 0.731 18509 9400 1 19 . 1 1 31 31 VAL N N 31 126.037 126.037 118.838 7.199 18509 9401 1 19 . 1 1 31 31 VAL C C 31 172.244 172.244 174.519 -2.275 18509 9402 1 19 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.484 -2.345 18509 9403 1 19 . 1 1 31 31 VAL H H 31 9.282 9.282 7.985 1.297 18509 9404 1 19 . 1 1 32 32 TRP N N 32 125.414 125.414 123.501 1.913 18509 9405 1 19 . 1 1 32 32 TRP C C 32 170.156 170.156 174.061 -3.905 18509 9406 1 19 . 1 1 32 32 TRP CA C 32 53.137 53.137 55.629 -2.492 18509 9407 1 19 . 1 1 32 32 TRP H H 32 8.983 8.983 7.829 1.154 18509 9408 1 19 . 1 1 33 33 GLY N N 33 107.848 107.848 110.813 -2.965 18509 9409 1 19 . 1 1 33 33 GLY C C 33 168.400 168.400 172.510 -4.110 18509 9410 1 19 . 1 1 33 33 GLY CA C 33 41.567 41.567 45.161 -3.594 18509 9411 1 19 . 1 1 33 33 GLY H H 33 8.360 8.360 8.416 -0.057 18509 9412 1 19 . 1 1 34 34 SER N N 34 114.377 114.377 117.023 -2.646 18509 9413 1 19 . 1 1 34 34 SER C C 34 169.618 169.618 172.898 -3.280 18509 9414 1 19 . 1 1 34 34 SER CA C 34 53.875 53.875 57.164 -3.289 18509 9415 1 19 . 1 1 34 34 SER H H 34 7.838 7.838 8.414 -0.576 18509 9416 1 19 . 1 1 35 35 ILE N N 35 123.149 123.149 125.480 -2.331 18509 9417 1 19 . 1 1 35 35 ILE C C 35 169.713 169.713 173.956 -4.243 18509 9418 1 19 . 1 1 35 35 ILE CA C 35 56.769 56.769 58.962 -2.193 18509 9419 1 19 . 1 1 35 35 ILE H H 35 8.496 8.496 8.303 0.193 18509 9420 1 19 . 1 1 36 36 LYS N N 36 123.803 123.803 127.069 -3.266 18509 9421 1 19 . 1 1 36 36 LYS C C 36 172.260 172.260 174.989 -2.729 18509 9422 1 19 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.785 -3.635 18509 9423 1 19 . 1 1 36 36 LYS H H 36 9.091 9.091 8.965 0.126 18509 9424 1 19 . 1 1 37 37 GLY N N 37 105.495 105.495 109.810 -4.315 18509 9425 1 19 . 1 1 37 37 GLY C C 37 171.641 171.641 172.302 -0.661 18509 9426 1 19 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.732 -2.371 18509 9427 1 19 . 1 1 37 37 GLY H H 37 8.237 8.237 8.135 0.102 18509 9428 1 19 . 1 1 38 38 LEU N N 38 120.966 120.966 119.356 1.610 18509 9429 1 19 . 1 1 38 38 LEU C C 38 174.112 174.112 177.188 -3.076 18509 9430 1 19 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.740 -4.269 18509 9431 1 19 . 1 1 38 38 LEU H H 38 8.156 8.156 8.285 -0.129 18509 9432 1 19 . 1 1 39 39 THR N N 39 110.363 110.363 117.113 -6.750 18509 9433 1 19 . 1 1 39 39 THR C C 39 173.102 173.102 174.159 -1.057 18509 9434 1 19 . 1 1 39 39 THR CA C 39 58.194 58.194 64.075 -5.880 18509 9435 1 19 . 1 1 39 39 THR H H 39 8.660 8.660 8.371 0.289 18509 9436 1 19 . 1 1 40 40 GLU N N 40 125.818 125.818 127.504 -1.686 18509 9437 1 19 . 1 1 40 40 GLU C C 40 173.134 173.134 175.719 -2.585 18509 9438 1 19 . 1 1 40 40 GLU CA C 40 54.356 54.356 54.992 -0.636 18509 9439 1 19 . 1 1 40 40 GLU H H 40 8.804 8.804 8.007 0.797 18509 9440 1 19 . 1 1 41 41 GLY N N 41 113.875 113.875 107.366 6.509 18509 9441 1 19 . 1 1 41 41 GLY C C 41 170.046 170.046 172.705 -2.659 18509 9442 1 19 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.238 -5.184 18509 9443 1 19 . 1 1 41 41 GLY H H 41 8.763 8.763 8.582 0.181 18509 9444 1 19 . 1 1 42 42 LEU N N 42 120.137 120.137 115.511 4.626 18509 9445 1 19 . 1 1 42 42 LEU C C 42 174.218 174.218 175.335 -1.117 18509 9446 1 19 . 1 1 42 42 LEU CA C 42 52.155 52.155 52.196 -0.041 18509 9447 1 19 . 1 1 42 42 LEU H H 42 8.313 8.313 7.740 0.573 18509 9448 1 19 . 1 1 43 43 HIS N N 43 114.385 114.385 115.828 -1.443 18509 9449 1 19 . 1 1 43 43 HIS C C 43 171.504 171.504 174.779 -3.275 18509 9450 1 19 . 1 1 43 43 HIS CA C 43 50.985 50.985 53.710 -2.725 18509 9451 1 19 . 1 1 43 43 HIS H H 43 8.712 8.712 7.905 0.807 18509 9452 1 19 . 1 1 44 44 GLY N N 44 108.872 108.872 110.624 -1.752 18509 9453 1 19 . 1 1 44 44 GLY C C 44 168.656 168.656 173.135 -4.479 18509 9454 1 19 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.937 -1.742 18509 9455 1 19 . 1 1 44 44 GLY H H 44 8.875 8.875 8.776 0.099 18509 9456 1 19 . 1 1 45 45 PHE N N 45 126.439 126.439 115.712 10.727 18509 9457 1 19 . 1 1 45 45 PHE CA C 45 53.098 53.098 57.733 -4.636 18509 9458 1 19 . 1 1 45 45 PHE H H 45 8.111 8.111 8.181 -0.070 18509 9459 1 19 . 1 1 46 46 HIS N N 46 115.353 115.353 122.092 -6.739 18509 9460 1 19 . 1 1 46 46 HIS C C 46 172.415 172.415 173.232 -0.817 18509 9461 1 19 . 1 1 46 46 HIS CA C 46 49.206 49.206 55.997 -6.791 18509 9462 1 19 . 1 1 46 46 HIS H H 46 8.107 8.107 8.473 -0.366 18509 9463 1 19 . 1 1 47 47 VAL N N 47 120.548 120.548 124.060 -3.512 18509 9464 1 19 . 1 1 47 47 VAL C C 47 173.900 173.900 174.004 -0.104 18509 9465 1 19 . 1 1 47 47 VAL CA C 47 58.792 58.792 62.873 -4.081 18509 9466 1 19 . 1 1 47 47 VAL H H 47 9.366 9.366 8.394 0.972 18509 9467 1 19 . 1 1 48 48 HIS N N 48 129.236 129.236 120.549 8.687 18509 9468 1 19 . 1 1 48 48 HIS C C 48 171.084 171.084 173.154 -2.070 18509 9469 1 19 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.805 -2.049 18509 9470 1 19 . 1 1 48 48 HIS H H 48 10.210 10.210 7.878 2.332 18509 9471 1 19 . 1 1 49 49 GLU N N 49 118.119 118.119 121.573 -3.454 18509 9472 1 19 . 1 1 49 49 GLU C C 49 171.635 171.635 174.122 -2.487 18509 9473 1 19 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.328 2.431 18509 9474 1 19 . 1 1 49 49 GLU H H 49 8.492 8.492 8.376 0.116 18509 9475 1 19 . 1 1 50 50 PHE N N 50 110.329 110.329 117.792 -7.463 18509 9476 1 19 . 1 1 50 50 PHE C C 50 175.252 175.252 175.127 0.125 18509 9477 1 19 . 1 1 50 50 PHE CA C 50 52.900 52.900 55.995 -3.095 18509 9478 1 19 . 1 1 50 50 PHE H H 50 8.580 8.580 8.736 -0.156 18509 9479 1 19 . 1 1 51 51 GLY N N 51 119.251 119.251 109.170 10.081 18509 9480 1 19 . 1 1 51 51 GLY C C 51 168.248 168.248 173.209 -4.961 18509 9481 1 19 . 1 1 51 51 GLY H H 51 10.208 10.208 7.432 2.776 18509 9482 1 19 . 1 1 52 52 ASP N N 52 114.958 114.958 123.224 -8.266 18509 9483 1 19 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.585 -5.694 18509 9484 1 19 . 1 1 52 52 ASP H H 52 5.834 5.834 8.059 -2.225 18509 9485 1 19 . 1 1 53 53 ASN N N 53 128.224 128.224 115.209 13.015 18509 9486 1 19 . 1 1 53 53 ASN CA C 53 48.233 48.233 53.134 -4.901 18509 9487 1 19 . 1 1 53 53 ASN H H 53 9.360 9.360 7.886 1.474 18509 9488 1 19 . 1 1 54 54 THR C C 54 168.656 168.656 175.331 -6.675 18509 9489 1 19 . 1 1 55 55 ALA N N 55 126.661 126.661 122.208 4.453 18509 9490 1 19 . 1 1 55 55 ALA C C 55 174.185 174.185 176.873 -2.688 18509 9491 1 19 . 1 1 55 55 ALA CA C 55 46.155 46.155 52.111 -5.957 18509 9492 1 19 . 1 1 55 55 ALA H H 55 8.390 8.390 8.271 0.119 18509 9493 1 19 . 1 1 56 56 GLY N N 56 107.903 107.903 106.639 1.264 18509 9494 1 19 . 1 1 56 56 GLY C C 56 171.578 171.578 173.361 -1.783 18509 9495 1 19 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.154 -2.574 18509 9496 1 19 . 1 1 56 56 GLY H H 56 7.282 7.282 7.296 -0.014 18509 9497 1 19 . 1 1 57 57 CYS N N 57 117.952 117.952 123.572 -5.620 18509 9498 1 19 . 1 1 57 57 CYS C C 57 175.209 175.209 174.914 0.295 18509 9499 1 19 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.125 -7.037 18509 9500 1 19 . 1 1 57 57 CYS H H 57 8.900 8.900 8.408 0.492 18509 9501 1 19 . 1 1 58 58 THR N N 58 119.852 119.852 119.699 0.153 18509 9502 1 19 . 1 1 58 58 THR CA C 58 58.239 58.239 65.111 -6.872 18509 9503 1 19 . 1 1 58 58 THR H H 58 8.505 8.505 9.402 -0.897 18509 9504 1 19 . 1 1 59 59 SER C C 59 170.763 170.763 174.631 -3.868 18509 9505 1 19 . 1 1 59 59 SER CA C 59 55.609 55.609 60.193 -4.584 18509 9506 1 19 . 1 1 60 60 ALA N N 60 119.753 119.753 121.608 -1.855 18509 9507 1 19 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.543 -2.603 18509 9508 1 19 . 1 1 60 60 ALA H H 60 6.898 6.898 7.901 -1.003 18509 9509 1 19 . 1 1 61 61 GLY N N 61 101.351 101.351 106.603 -5.252 18509 9510 1 19 . 1 1 61 61 GLY CA C 61 42.805 42.805 44.147 -1.342 18509 9511 1 19 . 1 1 61 61 GLY H H 61 7.730 7.730 7.614 0.116 18509 9512 1 19 . 1 1 62 62 PRO C C 62 172.276 172.276 176.906 -4.630 18509 9513 1 19 . 1 1 63 63 HIS N N 63 115.023 115.023 114.149 0.874 18509 9514 1 19 . 1 1 63 63 HIS CA C 63 52.119 52.119 58.372 -6.253 18509 9515 1 19 . 1 1 63 63 HIS H H 63 7.474 7.474 7.761 -0.287 18509 9516 1 19 . 1 1 64 64 PHE C C 64 171.731 171.731 174.663 -2.932 18509 9517 1 19 . 1 1 65 65 ASN N N 65 126.978 126.978 126.957 0.021 18509 9518 1 19 . 1 1 65 65 ASN CA C 65 47.753 47.753 51.558 -3.805 18509 9519 1 19 . 1 1 65 65 ASN H H 65 9.426 9.426 8.250 1.176 18509 9520 1 19 . 1 1 67 67 LEU N N 67 117.937 117.937 116.690 1.247 18509 9521 1 19 . 1 1 67 67 LEU C C 67 172.580 172.580 178.115 -5.535 18509 9522 1 19 . 1 1 67 67 LEU CA C 67 50.911 50.911 54.654 -3.743 18509 9523 1 19 . 1 1 67 67 LEU H H 67 7.720 7.720 8.026 -0.306 18509 9524 1 19 . 1 1 68 68 SER N N 68 110.842 110.842 116.780 -5.938 18509 9525 1 19 . 1 1 68 68 SER CA C 68 55.953 55.953 58.948 -2.995 18509 9526 1 19 . 1 1 68 68 SER H H 68 7.428 7.428 7.574 -0.146 18509 9527 1 19 . 1 1 69 69 ARG N N 69 120.782 120.782 120.073 0.709 18509 9528 1 19 . 1 1 69 69 ARG C C 69 173.381 173.381 177.110 -3.729 18509 9529 1 19 . 1 1 69 69 ARG CA C 69 50.543 50.543 56.601 -6.058 18509 9530 1 19 . 1 1 69 69 ARG H H 69 8.508 8.508 8.237 0.271 18509 9531 1 19 . 1 1 70 70 LYS N N 70 118.055 118.055 119.590 -1.535 18509 9532 1 19 . 1 1 70 70 LYS C C 70 169.994 169.994 175.117 -5.123 18509 9533 1 19 . 1 1 70 70 LYS CA C 70 52.596 52.596 55.446 -2.850 18509 9534 1 19 . 1 1 70 70 LYS H H 70 8.745 8.745 7.769 0.976 18509 9535 1 19 . 1 1 71 71 HIS N N 71 111.871 111.871 117.767 -5.896 18509 9536 1 19 . 1 1 71 71 HIS C C 71 171.534 171.534 174.752 -3.218 18509 9537 1 19 . 1 1 71 71 HIS CA C 71 52.549 52.549 56.031 -3.482 18509 9538 1 19 . 1 1 71 71 HIS H H 71 7.152 7.152 7.726 -0.574 18509 9539 1 19 . 1 1 72 72 GLY N N 72 112.910 112.910 111.984 0.926 18509 9540 1 19 . 1 1 72 72 GLY C C 72 168.634 168.634 172.663 -4.029 18509 9541 1 19 . 1 1 72 72 GLY CA C 72 41.274 41.274 46.037 -4.763 18509 9542 1 19 . 1 1 72 72 GLY H H 72 7.209 7.209 8.015 -0.806 18509 9543 1 19 . 1 1 73 73 GLY N N 73 105.207 105.207 110.164 -4.957 18509 9544 1 19 . 1 1 73 73 GLY CA C 73 41.221 41.221 44.782 -3.561 18509 9545 1 19 . 1 1 73 73 GLY H H 73 8.789 8.789 7.705 1.085 18509 9546 1 19 . 1 1 74 74 PRO C C 74 175.753 175.753 178.298 -2.545 18509 9547 1 19 . 1 1 75 75 LYS N N 75 114.868 114.868 115.822 -0.954 18509 9548 1 19 . 1 1 75 75 LYS C C 75 173.640 173.640 175.469 -1.829 18509 9549 1 19 . 1 1 75 75 LYS CA C 75 51.103 51.103 57.380 -6.277 18509 9550 1 19 . 1 1 75 75 LYS H H 75 8.651 8.651 8.292 0.359 18509 9551 1 19 . 1 1 76 76 ASP N N 76 120.414 120.414 118.257 2.157 18509 9552 1 19 . 1 1 76 76 ASP C C 76 172.557 172.557 173.792 -1.235 18509 9553 1 19 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.285 -2.976 18509 9554 1 19 . 1 1 76 76 ASP H H 76 7.461 7.461 7.900 -0.439 18509 9555 1 19 . 1 1 77 77 GLU N N 77 120.820 120.820 122.294 -1.474 18509 9556 1 19 . 1 1 77 77 GLU C C 77 174.101 174.101 175.585 -1.484 18509 9557 1 19 . 1 1 77 77 GLU CA C 77 55.513 55.513 55.389 0.124 18509 9558 1 19 . 1 1 77 77 GLU H H 77 8.315 8.315 8.671 -0.356 18509 9559 1 19 . 1 1 78 78 GLU N N 78 119.251 119.251 123.500 -4.249 18509 9560 1 19 . 1 1 78 78 GLU C C 78 168.285 168.285 176.909 -8.624 18509 9561 1 19 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.650 -5.572 18509 9562 1 19 . 1 1 78 78 GLU H H 78 8.109 8.109 8.763 -0.654 18509 9563 1 19 . 1 1 79 79 ARG N N 79 118.991 118.991 118.673 0.318 18509 9564 1 19 . 1 1 79 79 ARG C C 79 172.123 172.123 175.643 -3.520 18509 9565 1 19 . 1 1 79 79 ARG CA C 79 51.074 51.074 55.177 -4.103 18509 9566 1 19 . 1 1 79 79 ARG H H 79 6.999 6.999 8.257 -1.258 18509 9567 1 19 . 1 1 80 80 HIS N N 80 118.000 118.000 111.753 6.247 18509 9568 1 19 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.845 -6.892 18509 9569 1 19 . 1 1 80 80 HIS H H 80 8.355 8.355 8.403 -0.048 18509 9570 1 19 . 1 1 81 81 VAL C C 81 173.460 173.460 174.593 -1.133 18509 9571 1 19 . 1 1 82 82 GLY N N 82 97.322 97.322 112.652 -15.330 18509 9572 1 19 . 1 1 82 82 GLY C C 82 170.370 170.370 172.939 -2.569 18509 9573 1 19 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.017 -2.329 18509 9574 1 19 . 1 1 82 82 GLY H H 82 8.487 8.487 8.269 0.218 18509 9575 1 19 . 1 1 83 83 ASP N N 83 120.890 120.890 122.582 -1.692 18509 9576 1 19 . 1 1 83 83 ASP C C 83 168.737 168.737 175.022 -6.285 18509 9577 1 19 . 1 1 83 83 ASP CA C 83 52.918 52.918 52.818 0.100 18509 9578 1 19 . 1 1 83 83 ASP H H 83 7.127 7.127 8.470 -1.343 18509 9579 1 19 . 1 1 84 84 LEU N N 84 120.154 120.154 115.798 4.356 18509 9580 1 19 . 1 1 84 84 LEU C C 84 173.212 173.212 175.565 -2.353 18509 9581 1 19 . 1 1 84 84 LEU CA C 84 50.433 50.433 54.144 -3.711 18509 9582 1 19 . 1 1 84 84 LEU H H 84 7.128 7.128 8.819 -1.691 18509 9583 1 19 . 1 1 85 85 GLY N N 85 106.867 106.867 110.326 -3.459 18509 9584 1 19 . 1 1 85 85 GLY C C 85 167.654 167.654 173.055 -5.401 18509 9585 1 19 . 1 1 85 85 GLY CA C 85 43.011 43.011 45.362 -2.351 18509 9586 1 19 . 1 1 85 85 GLY H H 85 8.260 8.260 8.155 0.105 18509 9587 1 19 . 1 1 86 86 ASN N N 86 117.454 117.454 123.055 -5.601 18509 9588 1 19 . 1 1 86 86 ASN C C 86 173.942 173.942 174.747 -0.805 18509 9589 1 19 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.288 -3.022 18509 9590 1 19 . 1 1 86 86 ASN H H 86 8.041 8.041 8.134 -0.093 18509 9591 1 19 . 1 1 87 87 VAL N N 87 113.370 113.370 119.519 -6.149 18509 9592 1 19 . 1 1 87 87 VAL C C 87 171.526 171.526 174.847 -3.321 18509 9593 1 19 . 1 1 87 87 VAL CA C 87 55.708 55.708 59.668 -3.960 18509 9594 1 19 . 1 1 87 87 VAL H H 87 8.960 8.960 7.517 1.443 18509 9595 1 19 . 1 1 88 88 THR N N 88 117.939 117.939 116.533 1.406 18509 9596 1 19 . 1 1 88 88 THR C C 88 170.367 170.367 173.966 -3.599 18509 9597 1 19 . 1 1 88 88 THR CA C 88 58.694 58.694 60.634 -1.940 18509 9598 1 19 . 1 1 88 88 THR H H 88 8.681 8.681 8.558 0.123 18509 9599 1 19 . 1 1 89 89 ALA N N 89 128.674 128.674 129.050 -0.376 18509 9600 1 19 . 1 1 89 89 ALA C C 89 174.480 174.480 175.639 -1.159 18509 9601 1 19 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.311 -3.942 18509 9602 1 19 . 1 1 89 89 ALA H H 89 9.377 9.377 8.547 0.830 18509 9603 1 19 . 1 1 90 90 ASP N N 90 124.235 124.235 123.894 0.341 18509 9604 1 19 . 1 1 90 90 ASP C C 90 173.825 173.825 177.976 -4.151 18509 9605 1 19 . 1 1 90 90 ASP CA C 90 49.347 49.347 52.447 -3.100 18509 9606 1 19 . 1 1 90 90 ASP H H 90 8.455 8.455 8.446 0.009 18509 9607 1 19 . 1 1 91 91 LYS N N 91 114.942 114.942 118.397 -3.455 18509 9608 1 19 . 1 1 91 91 LYS C C 91 174.101 174.101 177.604 -3.503 18509 9609 1 19 . 1 1 91 91 LYS CA C 91 55.279 55.279 59.294 -4.015 18509 9610 1 19 . 1 1 91 91 LYS H H 91 8.231 8.231 8.596 -0.365 18509 9611 1 19 . 1 1 92 92 ASP N N 92 119.251 119.251 118.123 1.128 18509 9612 1 19 . 1 1 92 92 ASP C C 92 173.020 173.020 176.384 -3.364 18509 9613 1 19 . 1 1 92 92 ASP CA C 92 51.127 51.127 54.292 -3.165 18509 9614 1 19 . 1 1 92 92 ASP H H 92 8.109 8.109 8.053 0.056 18509 9615 1 19 . 1 1 93 93 GLY N N 93 110.868 110.868 108.585 2.283 18509 9616 1 19 . 1 1 93 93 GLY C C 93 169.706 169.706 173.322 -3.616 18509 9617 1 19 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.102 -1.339 18509 9618 1 19 . 1 1 93 93 GLY H H 93 8.405 8.405 7.845 0.560 18509 9619 1 19 . 1 1 94 94 VAL N N 94 118.755 118.755 119.788 -1.033 18509 9620 1 19 . 1 1 94 94 VAL C C 94 173.510 173.510 173.855 -0.345 18509 9621 1 19 . 1 1 94 94 VAL CA C 94 58.185 58.185 61.832 -3.647 18509 9622 1 19 . 1 1 94 94 VAL H H 94 7.814 7.814 7.847 -0.033 18509 9623 1 19 . 1 1 95 95 ALA N N 95 131.313 131.313 129.259 2.054 18509 9624 1 19 . 1 1 95 95 ALA C C 95 171.635 171.635 176.567 -4.932 18509 9625 1 19 . 1 1 95 95 ALA CA C 95 46.914 46.914 49.870 -2.956 18509 9626 1 19 . 1 1 95 95 ALA H H 95 9.763 9.763 7.969 1.794 18509 9627 1 19 . 1 1 96 96 ASP N N 96 125.170 125.170 123.901 1.269 18509 9628 1 19 . 1 1 96 96 ASP C C 96 172.336 172.336 175.472 -3.136 18509 9629 1 19 . 1 1 96 96 ASP H H 96 8.515 8.515 8.109 0.406 18509 9630 1 19 . 1 1 97 97 VAL N N 97 125.879 125.879 123.820 2.059 18509 9631 1 19 . 1 1 97 97 VAL C C 97 173.488 173.488 176.406 -2.918 18509 9632 1 19 . 1 1 97 97 VAL CA C 97 58.243 58.243 62.190 -3.947 18509 9633 1 19 . 1 1 97 97 VAL H H 97 8.703 8.703 8.641 0.062 18509 9634 1 19 . 1 1 98 98 SER N N 98 123.017 123.017 123.903 -0.886 18509 9635 1 19 . 1 1 98 98 SER C C 98 169.715 169.715 173.278 -3.563 18509 9636 1 19 . 1 1 98 98 SER CA C 98 55.068 55.068 58.087 -3.019 18509 9637 1 19 . 1 1 98 98 SER H H 98 8.784 8.784 8.757 0.027 18509 9638 1 19 . 1 1 99 99 ILE N N 99 125.807 125.807 126.238 -0.431 18509 9639 1 19 . 1 1 99 99 ILE C C 99 171.321 171.321 175.097 -3.776 18509 9640 1 19 . 1 1 99 99 ILE CA C 99 57.155 57.155 61.357 -4.202 18509 9641 1 19 . 1 1 99 99 ILE H H 99 9.411 9.411 8.003 1.408 18509 9642 1 19 . 1 1 100 100 GLU N N 100 124.068 124.068 127.414 -3.346 18509 9643 1 19 . 1 1 100 100 GLU C C 100 172.098 172.098 174.383 -2.285 18509 9644 1 19 . 1 1 100 100 GLU CA C 100 52.290 52.290 54.434 -2.144 18509 9645 1 19 . 1 1 100 100 GLU H H 100 8.652 8.652 8.429 0.223 18509 9646 1 19 . 1 1 101 101 ASP N N 101 126.109 126.109 123.281 2.828 18509 9647 1 19 . 1 1 101 101 ASP C C 101 171.144 171.144 175.689 -4.545 18509 9648 1 19 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.819 -2.400 18509 9649 1 19 . 1 1 101 101 ASP H H 101 9.317 9.317 8.466 0.851 18509 9650 1 19 . 1 1 102 102 SER N N 102 118.470 118.470 119.694 -1.224 18509 9651 1 19 . 1 1 102 102 SER C C 102 171.596 171.596 173.997 -2.401 18509 9652 1 19 . 1 1 102 102 SER CA C 102 55.245 55.245 56.979 -1.734 18509 9653 1 19 . 1 1 102 102 SER H H 102 8.933 8.933 7.881 1.052 18509 9654 1 19 . 1 1 103 103 VAL N N 103 123.179 123.179 114.385 8.794 18509 9655 1 19 . 1 1 103 103 VAL CA C 103 61.450 61.450 63.675 -2.225 18509 9656 1 19 . 1 1 103 103 VAL H H 103 8.148 8.148 9.066 -0.918 18509 9657 1 19 . 1 1 104 104 ILE C C 104 169.576 169.576 174.521 -4.945 18509 9658 1 19 . 1 1 104 104 ILE CA C 104 60.194 60.194 59.664 0.530 18509 9659 1 19 . 1 1 105 105 SER N N 105 107.618 107.618 119.300 -11.682 18509 9660 1 19 . 1 1 105 105 SER C C 105 170.046 170.046 173.627 -3.581 18509 9661 1 19 . 1 1 105 105 SER CA C 105 52.550 52.550 57.949 -5.399 18509 9662 1 19 . 1 1 105 105 SER H H 105 6.988 6.988 8.369 -1.381 18509 9663 1 19 . 1 1 106 106 LEU N N 106 120.137 120.137 127.118 -6.981 18509 9664 1 19 . 1 1 106 106 LEU H H 106 8.313 8.313 7.848 0.466 18509 9665 1 19 . 1 1 107 107 SER C C 107 170.701 170.701 174.595 -3.894 18509 9666 1 19 . 1 1 107 107 SER CA C 107 54.540 54.540 58.295 -3.756 18509 9667 1 19 . 1 1 108 108 GLY N N 108 107.603 107.603 113.801 -6.198 18509 9668 1 19 . 1 1 108 108 GLY C C 108 173.128 173.128 173.352 -0.224 18509 9669 1 19 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.871 -3.584 18509 9670 1 19 . 1 1 108 108 GLY H H 108 8.717 8.717 8.504 0.213 18509 9671 1 19 . 1 1 109 109 ASP N N 109 120.664 120.664 122.058 -1.394 18509 9672 1 19 . 1 1 109 109 ASP C C 109 171.904 171.904 177.364 -5.460 18509 9673 1 19 . 1 1 109 109 ASP H H 109 9.019 9.019 8.611 0.408 18509 9674 1 19 . 1 1 110 110 HIS N N 110 116.324 116.324 117.476 -1.152 18509 9675 1 19 . 1 1 110 110 HIS H H 110 9.283 9.283 8.638 0.645 18509 9676 1 19 . 1 1 111 111 SER N N 111 110.225 110.225 107.379 2.846 18509 9677 1 19 . 1 1 111 111 SER CA C 111 54.681 54.681 57.764 -3.083 18509 9678 1 19 . 1 1 111 111 SER H H 111 7.156 7.156 7.691 -0.535 18509 9679 1 19 . 1 1 112 112 ILE N N 112 117.053 117.053 121.282 -4.229 18509 9680 1 19 . 1 1 112 112 ILE C C 112 171.419 171.419 176.357 -4.938 18509 9681 1 19 . 1 1 112 112 ILE CA C 112 57.239 57.239 62.568 -5.329 18509 9682 1 19 . 1 1 112 112 ILE H H 112 7.837 7.837 8.396 -0.559 18509 9683 1 19 . 1 1 113 113 ILE N N 113 121.032 121.032 119.592 1.440 18509 9684 1 19 . 1 1 113 113 ILE C C 113 173.604 173.604 176.226 -2.622 18509 9685 1 19 . 1 1 113 113 ILE CA C 113 58.318 58.318 62.710 -4.392 18509 9686 1 19 . 1 1 113 113 ILE H H 113 7.592 7.592 7.696 -0.104 18509 9687 1 19 . 1 1 114 114 GLY N N 114 112.661 112.661 115.939 -3.278 18509 9688 1 19 . 1 1 114 114 GLY C C 114 169.739 169.739 174.277 -4.538 18509 9689 1 19 . 1 1 114 114 GLY CA C 114 41.910 41.910 44.874 -2.964 18509 9690 1 19 . 1 1 114 114 GLY H H 114 9.575 9.575 8.992 0.583 18509 9691 1 19 . 1 1 115 115 ARG N N 115 118.398 118.398 122.850 -4.452 18509 9692 1 19 . 1 1 115 115 ARG C C 115 171.079 171.079 175.651 -4.572 18509 9693 1 19 . 1 1 115 115 ARG CA C 115 51.663 51.663 53.770 -2.107 18509 9694 1 19 . 1 1 115 115 ARG H H 115 7.464 7.464 8.135 -0.671 18509 9695 1 19 . 1 1 116 116 THR N N 116 112.218 112.218 120.203 -7.985 18509 9696 1 19 . 1 1 116 116 THR C C 116 169.821 169.821 174.998 -5.177 18509 9697 1 19 . 1 1 116 116 THR CA C 116 59.633 59.633 64.103 -4.470 18509 9698 1 19 . 1 1 116 116 THR H H 116 6.677 6.677 8.424 -1.747 18509 9699 1 19 . 1 1 117 117 LEU N N 117 129.477 129.477 126.801 2.676 18509 9700 1 19 . 1 1 117 117 LEU C C 117 171.126 171.126 175.635 -4.509 18509 9701 1 19 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.373 -3.958 18509 9702 1 19 . 1 1 117 117 LEU H H 117 8.799 8.799 8.692 0.107 18509 9703 1 19 . 1 1 118 118 VAL N N 118 125.091 125.091 126.252 -1.161 18509 9704 1 19 . 1 1 118 118 VAL C C 118 170.267 170.267 175.013 -4.746 18509 9705 1 19 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.330 -3.191 18509 9706 1 19 . 1 1 118 118 VAL H H 118 8.906 8.906 7.726 1.180 18509 9707 1 19 . 1 1 119 119 VAL N N 119 120.716 120.716 119.202 1.514 18509 9708 1 19 . 1 1 119 119 VAL C C 119 171.175 171.175 174.301 -3.126 18509 9709 1 19 . 1 1 119 119 VAL CA C 119 55.271 55.271 58.543 -3.272 18509 9710 1 19 . 1 1 119 119 VAL H H 119 7.982 7.982 7.618 0.364 18509 9711 1 19 . 1 1 120 120 HIS N N 120 125.052 125.052 119.823 5.229 18509 9712 1 19 . 1 1 120 120 HIS C C 120 172.599 172.599 174.331 -1.732 18509 9713 1 19 . 1 1 120 120 HIS CA C 120 53.394 53.394 55.274 -1.880 18509 9714 1 19 . 1 1 120 120 HIS H H 120 8.935 8.935 8.566 0.369 18509 9715 1 19 . 1 1 121 121 GLU N N 121 121.453 121.453 122.204 -0.751 18509 9716 1 19 . 1 1 121 121 GLU C C 121 172.304 172.304 175.656 -3.352 18509 9717 1 19 . 1 1 121 121 GLU CA C 121 56.090 56.090 57.007 -0.917 18509 9718 1 19 . 1 1 121 121 GLU H H 121 9.178 9.178 8.070 1.108 18509 9719 1 19 . 1 1 122 122 LYS N N 122 115.248 115.248 122.285 -7.037 18509 9720 1 19 . 1 1 122 122 LYS C C 122 171.523 171.523 174.351 -2.828 18509 9721 1 19 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.822 -5.203 18509 9722 1 19 . 1 1 122 122 LYS H H 122 8.478 8.478 8.394 0.084 18509 9723 1 19 . 1 1 123 123 ALA N N 123 120.866 120.866 124.938 -4.072 18509 9724 1 19 . 1 1 123 123 ALA C C 123 173.219 173.219 176.531 -3.312 18509 9725 1 19 . 1 1 123 123 ALA CA C 123 48.850 48.850 53.204 -4.354 18509 9726 1 19 . 1 1 123 123 ALA H H 123 7.796 7.796 8.513 -0.717 18509 9727 1 19 . 1 1 124 124 ASP N N 124 121.799 121.799 124.237 -2.438 18509 9728 1 19 . 1 1 124 124 ASP C C 124 174.458 174.458 174.614 -0.156 18509 9729 1 19 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.306 -3.898 18509 9730 1 19 . 1 1 124 124 ASP H H 124 10.165 10.165 8.436 1.729 18509 9731 1 19 . 1 1 125 125 ASP N N 125 129.369 129.369 125.321 4.048 18509 9732 1 19 . 1 1 125 125 ASP C C 125 175.231 175.231 175.293 -0.062 18509 9733 1 19 . 1 1 125 125 ASP CA C 125 50.939 50.939 53.035 -2.096 18509 9734 1 19 . 1 1 125 125 ASP H H 125 10.055 10.055 8.508 1.547 18509 9735 1 19 . 1 1 126 126 LEU N N 126 117.190 117.190 125.474 -8.284 18509 9736 1 19 . 1 1 126 126 LEU C C 126 173.964 173.964 178.296 -4.332 18509 9737 1 19 . 1 1 126 126 LEU H H 126 10.483 10.483 8.391 2.092 18509 9738 1 19 . 1 1 127 127 GLY N N 127 103.809 103.809 108.676 -4.867 18509 9739 1 19 . 1 1 127 127 GLY CA C 127 42.878 42.878 46.541 -3.663 18509 9740 1 19 . 1 1 127 127 GLY H H 127 8.637 8.637 8.477 0.160 18509 9741 1 19 . 1 1 128 128 LYS N N 128 118.290 118.290 118.901 -0.611 18509 9742 1 19 . 1 1 128 128 LYS CA C 128 51.740 51.740 54.702 -2.962 18509 9743 1 19 . 1 1 128 128 LYS H H 128 7.158 7.158 8.503 -1.345 18509 9744 1 19 . 1 1 129 129 GLY N N 129 108.507 108.507 109.721 -1.214 18509 9745 1 19 . 1 1 129 129 GLY C C 129 171.524 171.524 174.449 -2.925 18509 9746 1 19 . 1 1 129 129 GLY CA C 129 42.113 42.113 45.297 -3.183 18509 9747 1 19 . 1 1 129 129 GLY H H 129 8.913 8.913 8.535 0.378 18509 9748 1 19 . 1 1 130 130 GLY N N 130 108.537 108.537 113.142 -4.605 18509 9749 1 19 . 1 1 130 130 GLY C C 130 169.994 169.994 173.667 -3.673 18509 9750 1 19 . 1 1 130 130 GLY CA C 130 42.419 42.419 45.516 -3.097 18509 9751 1 19 . 1 1 130 130 GLY H H 130 8.723 8.723 8.355 0.368 18509 9752 1 19 . 1 1 131 131 ASN N N 131 111.951 111.951 121.250 -9.299 18509 9753 1 19 . 1 1 131 131 ASN C C 131 172.236 172.236 175.989 -3.753 18509 9754 1 19 . 1 1 131 131 ASN H H 131 7.152 7.152 8.278 -1.126 18509 9755 1 19 . 1 1 132 132 GLU N N 132 120.461 120.461 120.443 0.018 18509 9756 1 19 . 1 1 132 132 GLU C C 132 171.084 171.084 178.348 -7.264 18509 9757 1 19 . 1 1 132 132 GLU H H 132 8.935 8.935 8.856 0.079 18509 9758 1 19 . 1 1 133 133 GLU N N 133 120.137 120.137 117.248 2.889 18509 9759 1 19 . 1 1 133 133 GLU C C 133 176.239 176.239 178.704 -2.465 18509 9760 1 19 . 1 1 133 133 GLU H H 133 8.775 8.775 8.748 0.027 18509 9761 1 19 . 1 1 134 134 SER N N 134 114.981 114.981 114.755 0.226 18509 9762 1 19 . 1 1 134 134 SER CA C 134 59.046 59.046 61.225 -2.179 18509 9763 1 19 . 1 1 134 134 SER H H 134 8.117 8.117 7.583 0.534 18509 9764 1 19 . 1 1 135 135 THR N N 135 102.263 102.263 117.998 -15.735 18509 9765 1 19 . 1 1 135 135 THR C C 135 172.804 172.804 175.781 -2.977 18509 9766 1 19 . 1 1 135 135 THR CA C 135 60.029 60.029 64.161 -4.132 18509 9767 1 19 . 1 1 135 135 THR H H 135 7.206 7.206 8.082 -0.876 18509 9768 1 19 . 1 1 136 136 LYS N N 136 122.108 122.108 120.001 2.107 18509 9769 1 19 . 1 1 136 136 LYS H H 136 7.884 7.884 7.507 0.377 18509 9770 1 19 . 1 1 137 137 THR N N 137 105.718 105.718 111.234 -5.516 18509 9771 1 19 . 1 1 137 137 THR H H 137 8.630 8.630 7.346 1.284 18509 9772 1 19 . 1 1 138 138 GLY N N 138 111.372 111.372 110.448 0.924 18509 9773 1 19 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.401 -2.918 18509 9774 1 19 . 1 1 138 138 GLY H H 138 7.426 7.426 7.531 -0.105 18509 9775 1 19 . 1 1 139 139 ASN N N 139 107.496 107.496 120.076 -12.580 18509 9776 1 19 . 1 1 139 139 ASN H H 139 7.545 7.545 8.031 -0.486 18509 9777 1 19 . 1 1 140 140 ALA N N 140 114.542 114.542 127.085 -12.543 18509 9778 1 19 . 1 1 140 140 ALA C C 140 173.571 173.571 175.695 -2.124 18509 9779 1 19 . 1 1 140 140 ALA H H 140 6.368 6.368 7.949 -1.581 18509 9780 1 19 . 1 1 141 141 GLY N N 141 105.287 105.287 106.004 -0.717 18509 9781 1 19 . 1 1 141 141 GLY C C 141 173.542 173.542 175.623 -2.081 18509 9782 1 19 . 1 1 141 141 GLY H H 141 8.271 8.271 8.555 -0.284 18509 9783 1 19 . 1 1 142 142 SER N N 142 118.771 118.771 119.011 -0.240 18509 9784 1 19 . 1 1 142 142 SER C C 142 170.188 170.188 174.733 -4.545 18509 9785 1 19 . 1 1 142 142 SER H H 142 9.196 9.196 8.910 0.286 18509 9786 1 19 . 1 1 143 143 ARG N N 143 120.189 120.189 115.106 5.083 18509 9787 1 19 . 1 1 143 143 ARG C C 143 171.596 171.596 176.583 -4.987 18509 9788 1 19 . 1 1 143 143 ARG H H 143 8.943 8.943 7.793 1.150 18509 9789 1 19 . 1 1 144 144 LEU N N 144 122.907 122.907 121.650 1.257 18509 9790 1 19 . 1 1 144 144 LEU C C 144 174.393 174.393 175.931 -1.538 18509 9791 1 19 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.071 -2.696 18509 9792 1 19 . 1 1 144 144 LEU H H 144 8.395 8.395 7.919 0.476 18509 9793 1 19 . 1 1 145 145 ALA N N 145 114.159 114.159 118.273 -4.114 18509 9794 1 19 . 1 1 145 145 ALA C C 145 171.752 171.752 175.348 -3.596 18509 9795 1 19 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.219 -3.090 18509 9796 1 19 . 1 1 145 145 ALA H H 145 7.356 7.356 7.658 -0.302 18509 9797 1 19 . 1 1 146 146 CYS N N 146 110.738 110.738 121.039 -10.301 18509 9798 1 19 . 1 1 146 146 CYS C C 146 170.087 170.087 174.004 -3.917 18509 9799 1 19 . 1 1 146 146 CYS CA C 146 51.077 51.077 59.129 -8.052 18509 9800 1 19 . 1 1 146 146 CYS H H 146 9.008 9.008 8.674 0.334 18509 9801 1 19 . 1 1 147 147 GLY N N 147 106.461 106.461 110.599 -4.138 18509 9802 1 19 . 1 1 147 147 GLY C C 147 167.909 167.909 172.119 -4.210 18509 9803 1 19 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.162 -2.488 18509 9804 1 19 . 1 1 147 147 GLY H H 147 8.018 8.018 8.162 -0.144 18509 9805 1 19 . 1 1 148 148 VAL N N 148 124.054 124.054 121.928 2.126 18509 9806 1 19 . 1 1 148 148 VAL C C 148 172.084 172.084 174.489 -2.405 18509 9807 1 19 . 1 1 148 148 VAL CA C 148 59.635 59.635 61.635 -2.000 18509 9808 1 19 . 1 1 148 148 VAL H H 148 8.434 8.434 8.310 0.124 18509 9809 1 19 . 1 1 149 149 ILE N N 149 126.918 126.918 126.656 0.262 18509 9810 1 19 . 1 1 149 149 ILE C C 149 171.804 171.804 174.487 -2.683 18509 9811 1 19 . 1 1 149 149 ILE CA C 149 59.184 59.184 60.178 -0.994 18509 9812 1 19 . 1 1 149 149 ILE H H 149 8.613 8.613 8.728 -0.115 18509 9813 1 19 . 1 1 150 150 GLY N N 150 116.493 116.493 113.034 3.459 18509 9814 1 19 . 1 1 150 150 GLY C C 150 170.188 170.188 171.793 -1.605 18509 9815 1 19 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.529 -4.409 18509 9816 1 19 . 1 1 150 150 GLY H H 150 9.283 9.283 8.023 1.260 18509 9817 1 19 . 1 1 151 151 ILE N N 151 120.189 120.189 121.559 -1.370 18509 9818 1 19 . 1 1 151 151 ILE C C 151 172.231 172.231 173.889 -1.658 18509 9819 1 19 . 1 1 151 151 ILE CA C 151 60.372 60.372 60.916 -0.544 18509 9820 1 19 . 1 1 151 151 ILE H H 151 8.943 8.943 8.502 0.441 18509 9821 1 19 . 1 1 152 152 ALA N N 152 129.719 129.719 131.546 -1.827 18509 9822 1 19 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.015 -4.243 18509 9823 1 19 . 1 1 152 152 ALA H H 152 8.170 8.170 8.109 0.061 18509 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 136 5.030 0.987 4.951 18509 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18509 3 1 1 "Average Difference" C 120 3.555 3.186 1.585 18509 4 1 1 "Average Difference" CA 125 3.664 3.246 1.707 18509 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18509 6 1 1 "Average Difference" HN 136 0.817 -0.157 0.804 18509 7 1 2 "Average Difference" N 136 4.869 1.058 4.770 18509 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18509 9 1 2 "Average Difference" C 120 3.408 3.008 1.610 18509 10 1 2 "Average Difference" CA 125 3.739 3.257 1.843 18509 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18509 12 1 2 "Average Difference" HN 136 0.862 -0.233 0.833 18509 13 1 3 "Average Difference" N 136 4.610 1.008 4.515 18509 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18509 15 1 3 "Average Difference" C 120 3.635 3.231 1.673 18509 16 1 3 "Average Difference" CA 125 3.816 3.358 1.820 18509 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18509 18 1 3 "Average Difference" HN 136 0.841 -0.213 0.817 18509 19 1 4 "Average Difference" N 136 4.721 0.834 4.664 18509 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18509 21 1 4 "Average Difference" C 120 3.517 3.121 1.628 18509 22 1 4 "Average Difference" CA 125 3.753 3.395 1.607 18509 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18509 24 1 4 "Average Difference" HN 136 0.853 -0.290 0.805 18509 25 1 5 "Average Difference" N 136 4.696 0.918 4.622 18509 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18509 27 1 5 "Average Difference" C 120 3.429 3.081 1.513 18509 28 1 5 "Average Difference" CA 125 3.731 3.250 1.841 18509 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18509 30 1 5 "Average Difference" HN 136 0.844 -0.254 0.808 18509 31 1 6 "Average Difference" N 136 4.747 0.776 4.700 18509 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18509 33 1 6 "Average Difference" C 120 3.353 2.987 1.531 18509 34 1 6 "Average Difference" CA 125 3.712 3.244 1.813 18509 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18509 36 1 6 "Average Difference" HN 136 0.831 -0.182 0.814 18509 37 1 7 "Average Difference" N 136 4.634 0.723 4.594 18509 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18509 39 1 7 "Average Difference" C 120 3.499 3.102 1.626 18509 40 1 7 "Average Difference" CA 125 3.643 3.197 1.754 18509 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18509 42 1 7 "Average Difference" HN 136 0.867 -0.278 0.824 18509 43 1 8 "Average Difference" N 136 5.134 0.953 5.063 18509 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18509 45 1 8 "Average Difference" C 120 3.528 3.149 1.598 18509 46 1 8 "Average Difference" CA 125 3.742 3.306 1.759 18509 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18509 48 1 8 "Average Difference" HN 136 0.779 -0.229 0.747 18509 49 1 9 "Average Difference" N 136 4.935 0.580 4.919 18509 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18509 51 1 9 "Average Difference" C 120 3.557 3.176 1.609 18509 52 1 9 "Average Difference" CA 125 3.665 3.191 1.809 18509 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18509 54 1 9 "Average Difference" HN 136 0.843 -0.266 0.803 18509 55 1 10 "Average Difference" N 136 5.086 1.349 4.922 18509 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18509 57 1 10 "Average Difference" C 120 3.468 3.117 1.526 18509 58 1 10 "Average Difference" CA 125 3.707 3.254 1.783 18509 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18509 60 1 10 "Average Difference" HN 136 0.842 -0.231 0.813 18509 61 1 11 "Average Difference" N 136 4.793 1.224 4.651 18509 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 18509 63 1 11 "Average Difference" C 120 3.512 3.216 1.418 18509 64 1 11 "Average Difference" CA 125 3.778 3.334 1.784 18509 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18509 66 1 11 "Average Difference" HN 136 0.805 -0.202 0.782 18509 67 1 12 "Average Difference" N 136 5.082 0.818 5.034 18509 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 18509 69 1 12 "Average Difference" C 120 3.478 3.072 1.637 18509 70 1 12 "Average Difference" CA 125 3.811 3.363 1.801 18509 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18509 72 1 12 "Average Difference" HN 136 0.845 -0.232 0.816 18509 73 1 13 "Average Difference" N 136 4.676 0.721 4.637 18509 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 18509 75 1 13 "Average Difference" C 120 3.442 3.041 1.619 18509 76 1 13 "Average Difference" CA 125 3.595 3.160 1.721 18509 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18509 78 1 13 "Average Difference" HN 136 0.863 -0.185 0.846 18509 79 1 14 "Average Difference" N 136 4.504 1.161 4.368 18509 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 18509 81 1 14 "Average Difference" C 120 3.491 3.126 1.560 18509 82 1 14 "Average Difference" CA 125 3.670 3.214 1.779 18509 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18509 84 1 14 "Average Difference" HN 136 0.848 -0.222 0.822 18509 85 1 15 "Average Difference" N 136 4.704 1.317 4.533 18509 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 18509 87 1 15 "Average Difference" C 120 3.557 3.145 1.667 18509 88 1 15 "Average Difference" CA 125 3.833 3.397 1.781 18509 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18509 90 1 15 "Average Difference" HN 136 0.852 -0.256 0.815 18509 91 1 16 "Average Difference" N 136 5.149 1.117 5.044 18509 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 18509 93 1 16 "Average Difference" C 120 3.358 3.008 1.499 18509 94 1 16 "Average Difference" CA 125 3.655 3.202 1.771 18509 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18509 96 1 16 "Average Difference" HN 136 0.901 -0.262 0.866 18509 97 1 17 "Average Difference" N 136 4.875 1.130 4.760 18509 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 18509 99 1 17 "Average Difference" C 120 3.440 3.052 1.592 18509 100 1 17 "Average Difference" CA 125 3.743 3.325 1.726 18509 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18509 102 1 17 "Average Difference" HN 136 0.821 -0.180 0.804 18509 103 1 18 "Average Difference" N 136 4.644 1.086 4.532 18509 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 18509 105 1 18 "Average Difference" C 120 3.520 3.105 1.665 18509 106 1 18 "Average Difference" CA 125 3.793 3.321 1.841 18509 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18509 108 1 18 "Average Difference" HN 136 0.825 -0.221 0.798 18509 109 1 19 "Average Difference" N 136 5.036 1.116 4.929 18509 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 18509 111 1 19 "Average Difference" C 120 3.523 3.146 1.590 18509 112 1 19 "Average Difference" CA 125 3.721 3.297 1.731 18509 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18509 114 1 19 "Average Difference" HN 136 0.854 -0.213 0.831 18509 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 18509 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 THR C C 2 170.139 170.139 174.006 -3.867 18509 2 1 . 1 1 3 3 LYS N N 3 123.998 123.998 118.777 5.221 18509 3 1 . 1 1 3 3 LYS C C 3 171.607 171.607 174.133 -2.526 18509 4 1 . 1 1 3 3 LYS CA C 3 51.178 51.178 54.828 -3.650 18509 5 1 . 1 1 3 3 LYS H H 3 8.666 8.666 7.573 1.093 18509 6 1 . 1 1 4 4 ALA N N 4 123.295 123.295 122.612 0.683 18509 7 1 . 1 1 4 4 ALA C C 4 172.145 172.145 175.210 -3.065 18509 8 1 . 1 1 4 4 ALA CA C 4 47.504 47.504 50.893 -3.389 18509 9 1 . 1 1 4 4 ALA H H 4 9.116 9.116 8.351 0.765 18509 10 1 . 1 1 5 5 VAL N N 5 121.466 121.466 118.654 2.812 18509 11 1 . 1 1 5 5 VAL C C 5 167.836 167.836 174.108 -6.272 18509 12 1 . 1 1 5 5 VAL CA C 5 56.875 56.875 60.607 -3.732 18509 13 1 . 1 1 5 5 VAL H H 5 9.545 9.545 8.651 0.894 18509 14 1 . 1 1 6 6 ALA N N 6 125.984 125.984 128.928 -2.944 18509 15 1 . 1 1 6 6 ALA C C 6 171.607 171.607 175.880 -4.273 18509 16 1 . 1 1 6 6 ALA CA C 6 47.471 47.471 50.273 -2.802 18509 17 1 . 1 1 6 6 ALA H H 6 9.177 9.177 8.311 0.866 18509 18 1 . 1 1 7 7 VAL N N 7 123.600 123.600 122.374 1.226 18509 19 1 . 1 1 7 7 VAL C C 7 172.244 172.244 174.377 -2.133 18509 20 1 . 1 1 7 7 VAL CA C 7 58.476 58.476 60.950 -2.474 18509 21 1 . 1 1 7 7 VAL H H 7 9.116 9.116 8.069 1.047 18509 22 1 . 1 1 8 8 LEU N N 8 126.455 126.455 126.829 -0.374 18509 23 1 . 1 1 8 8 LEU C C 8 172.557 172.557 175.889 -3.332 18509 24 1 . 1 1 8 8 LEU CA C 8 51.052 51.052 53.706 -2.654 18509 25 1 . 1 1 8 8 LEU H H 8 8.916 8.916 8.478 0.438 18509 26 1 . 1 1 9 9 LYS N N 9 120.820 120.820 121.457 -0.637 18509 27 1 . 1 1 9 9 LYS C C 9 172.509 172.509 175.160 -2.651 18509 28 1 . 1 1 9 9 LYS CA C 9 51.897 51.897 55.602 -3.705 18509 29 1 . 1 1 9 9 LYS H H 9 8.315 8.315 8.292 0.023 18509 30 1 . 1 1 10 10 GLY N N 10 111.249 111.249 111.386 -0.137 18509 31 1 . 1 1 10 10 GLY C C 10 169.847 169.847 173.272 -3.425 18509 32 1 . 1 1 10 10 GLY CA C 10 42.275 42.275 45.037 -2.762 18509 33 1 . 1 1 10 10 GLY H H 10 8.968 8.968 8.222 0.746 18509 34 1 . 1 1 11 11 ASP N N 11 120.904 120.904 120.905 -0.001 18509 35 1 . 1 1 11 11 ASP C C 11 173.132 173.132 176.938 -3.806 18509 36 1 . 1 1 11 11 ASP CA C 11 51.317 51.317 55.390 -4.073 18509 37 1 . 1 1 11 11 ASP H H 11 8.745 8.745 8.437 0.308 18509 38 1 . 1 1 12 12 GLY N N 12 109.862 109.862 109.026 0.836 18509 39 1 . 1 1 12 12 GLY CA C 12 41.200 41.200 43.556 -2.356 18509 40 1 . 1 1 12 12 GLY H H 12 7.985 7.985 8.069 -0.084 18509 41 1 . 1 1 13 13 PRO C C 13 173.640 173.640 175.753 -2.113 18509 42 1 . 1 1 14 14 VAL N N 14 120.414 120.414 119.820 0.594 18509 43 1 . 1 1 14 14 VAL C C 14 172.804 172.804 174.598 -1.794 18509 44 1 . 1 1 14 14 VAL CA C 14 59.884 59.884 60.073 -0.189 18509 45 1 . 1 1 14 14 VAL H H 14 7.476 7.476 8.117 -0.641 18509 46 1 . 1 1 15 15 GLN N N 15 122.664 122.664 125.582 -2.918 18509 47 1 . 1 1 15 15 GLN C C 15 171.168 171.168 174.639 -3.471 18509 48 1 . 1 1 15 15 GLN CA C 15 50.679 50.679 54.602 -3.923 18509 49 1 . 1 1 15 15 GLN H H 15 7.938 7.938 8.635 -0.697 18509 50 1 . 1 1 16 16 GLY N N 16 107.018 107.018 109.988 -2.970 18509 51 1 . 1 1 16 16 GLY C C 16 167.726 167.726 171.909 -4.183 18509 52 1 . 1 1 16 16 GLY CA C 16 43.625 43.625 45.175 -1.550 18509 53 1 . 1 1 16 16 GLY H H 16 8.288 8.288 8.378 -0.090 18509 54 1 . 1 1 17 17 ILE N N 17 120.248 120.248 116.919 3.329 18509 55 1 . 1 1 17 17 ILE C C 17 171.194 171.194 173.840 -2.646 18509 56 1 . 1 1 17 17 ILE CA C 17 58.497 58.497 59.689 -1.192 18509 57 1 . 1 1 17 17 ILE H H 17 7.948 7.948 7.966 -0.018 18509 58 1 . 1 1 18 18 ILE N N 18 125.851 125.851 125.078 0.773 18509 59 1 . 1 1 18 18 ILE C C 18 168.889 168.889 174.605 -5.716 18509 60 1 . 1 1 18 18 ILE CA C 18 53.431 53.431 59.045 -5.614 18509 61 1 . 1 1 18 18 ILE H H 18 8.725 8.725 8.222 0.503 18509 62 1 . 1 1 19 19 ASN N N 19 123.256 123.256 124.091 -0.835 18509 63 1 . 1 1 19 19 ASN C C 19 168.903 168.903 173.598 -4.695 18509 64 1 . 1 1 19 19 ASN CA C 19 49.088 49.088 51.512 -2.424 18509 65 1 . 1 1 19 19 ASN H H 19 8.727 8.727 8.351 0.376 18509 66 1 . 1 1 20 20 PHE N N 20 113.849 113.849 120.241 -6.392 18509 67 1 . 1 1 20 20 PHE C C 20 173.219 173.219 174.435 -1.216 18509 68 1 . 1 1 20 20 PHE CA C 20 52.058 52.058 56.613 -4.555 18509 69 1 . 1 1 20 20 PHE H H 20 8.399 8.399 8.511 -0.112 18509 70 1 . 1 1 21 21 GLU N N 21 121.454 121.454 123.450 -1.996 18509 71 1 . 1 1 21 21 GLU C C 21 170.280 170.280 175.174 -4.894 18509 72 1 . 1 1 21 21 GLU CA C 21 53.044 53.044 54.717 -1.673 18509 73 1 . 1 1 21 21 GLU H H 21 9.526 9.526 8.491 1.035 18509 74 1 . 1 1 22 22 GLN N N 22 130.340 130.340 123.499 6.841 18509 75 1 . 1 1 22 22 GLN CA C 22 51.180 51.180 54.826 -3.646 18509 76 1 . 1 1 22 22 GLN H H 22 9.305 9.305 8.532 0.773 18509 77 1 . 1 1 23 23 LYS N N 23 128.657 128.657 124.177 4.480 18509 78 1 . 1 1 23 23 LYS CA C 23 57.241 57.241 55.721 1.520 18509 79 1 . 1 1 23 23 LYS H H 23 9.088 9.088 8.450 0.638 18509 80 1 . 1 1 24 24 GLU CA C 24 51.392 51.392 58.713 -7.321 18509 81 1 . 1 1 25 25 SER CA C 25 58.078 58.078 59.223 -1.145 18509 82 1 . 1 1 27 27 GLY N N 27 108.125 108.125 109.879 -1.754 18509 83 1 . 1 1 27 27 GLY CA C 27 42.925 42.925 44.739 -1.814 18509 84 1 . 1 1 27 27 GLY H H 27 8.032 8.032 8.165 -0.133 18509 85 1 . 1 1 28 28 PRO C C 28 173.128 173.128 176.228 -3.100 18509 86 1 . 1 1 29 29 VAL N N 29 121.267 121.267 122.705 -1.438 18509 87 1 . 1 1 29 29 VAL C C 29 172.198 172.198 175.500 -3.302 18509 88 1 . 1 1 29 29 VAL CA C 29 57.720 57.720 61.400 -3.680 18509 89 1 . 1 1 29 29 VAL H H 29 9.089 9.089 8.283 0.806 18509 90 1 . 1 1 30 30 LYS N N 30 127.589 127.589 128.665 -1.076 18509 91 1 . 1 1 30 30 LYS C C 30 172.098 172.098 175.067 -2.969 18509 92 1 . 1 1 30 30 LYS CA C 30 52.642 52.642 55.469 -2.827 18509 93 1 . 1 1 30 30 LYS H H 30 9.200 9.200 8.539 0.661 18509 94 1 . 1 1 31 31 VAL N N 31 126.037 126.037 121.031 5.006 18509 95 1 . 1 1 31 31 VAL C C 31 172.244 172.244 174.198 -1.954 18509 96 1 . 1 1 31 31 VAL CA C 31 57.139 57.139 59.751 -2.612 18509 97 1 . 1 1 31 31 VAL H H 31 9.282 9.282 7.989 1.293 18509 98 1 . 1 1 32 32 TRP N N 32 125.414 125.414 125.088 0.326 18509 99 1 . 1 1 32 32 TRP C C 32 170.156 170.156 174.322 -4.166 18509 100 1 . 1 1 32 32 TRP CA C 32 53.137 53.137 56.157 -3.020 18509 101 1 . 1 1 32 32 TRP H H 32 8.983 8.983 8.201 0.782 18509 102 1 . 1 1 33 33 GLY N N 33 107.848 107.848 110.763 -2.915 18509 103 1 . 1 1 33 33 GLY C C 33 168.400 168.400 172.027 -3.627 18509 104 1 . 1 1 33 33 GLY CA C 33 41.567 41.567 44.987 -3.420 18509 105 1 . 1 1 33 33 GLY H H 33 8.360 8.360 8.219 0.141 18509 106 1 . 1 1 34 34 SER N N 34 114.377 114.377 117.803 -3.426 18509 107 1 . 1 1 34 34 SER C C 34 169.618 169.618 173.448 -3.830 18509 108 1 . 1 1 34 34 SER CA C 34 53.875 53.875 56.470 -2.595 18509 109 1 . 1 1 34 34 SER H H 34 7.838 7.838 8.138 -0.300 18509 110 1 . 1 1 35 35 ILE N N 35 123.149 123.149 122.388 0.761 18509 111 1 . 1 1 35 35 ILE C C 35 169.713 169.713 174.313 -4.600 18509 112 1 . 1 1 35 35 ILE CA C 35 56.769 56.769 59.490 -2.721 18509 113 1 . 1 1 35 35 ILE H H 35 8.496 8.496 8.381 0.115 18509 114 1 . 1 1 36 36 LYS N N 36 123.803 123.803 125.430 -1.627 18509 115 1 . 1 1 36 36 LYS C C 36 172.260 172.260 175.468 -3.208 18509 116 1 . 1 1 36 36 LYS CA C 36 51.150 51.150 54.464 -3.314 18509 117 1 . 1 1 36 36 LYS H H 36 9.091 9.091 8.753 0.338 18509 118 1 . 1 1 37 37 GLY N N 37 105.495 105.495 109.904 -4.409 18509 119 1 . 1 1 37 37 GLY C C 37 171.641 171.641 172.719 -1.078 18509 120 1 . 1 1 37 37 GLY CA C 37 42.361 42.361 44.038 -1.677 18509 121 1 . 1 1 37 37 GLY H H 37 8.237 8.237 8.128 0.109 18509 122 1 . 1 1 38 38 LEU N N 38 120.966 120.966 119.099 1.867 18509 123 1 . 1 1 38 38 LEU C C 38 174.112 174.112 177.149 -3.037 18509 124 1 . 1 1 38 38 LEU CA C 38 50.471 50.471 54.654 -4.183 18509 125 1 . 1 1 38 38 LEU H H 38 8.156 8.156 8.407 -0.251 18509 126 1 . 1 1 39 39 THR N N 39 110.363 110.363 115.067 -4.704 18509 127 1 . 1 1 39 39 THR C C 39 173.102 173.102 174.110 -1.008 18509 128 1 . 1 1 39 39 THR CA C 39 58.194 58.194 63.097 -4.903 18509 129 1 . 1 1 39 39 THR H H 39 8.660 8.660 8.272 0.388 18509 130 1 . 1 1 40 40 GLU N N 40 125.818 125.818 126.379 -0.561 18509 131 1 . 1 1 40 40 GLU C C 40 173.134 173.134 174.635 -1.501 18509 132 1 . 1 1 40 40 GLU CA C 40 54.356 54.356 55.911 -1.555 18509 133 1 . 1 1 40 40 GLU H H 40 8.804 8.804 8.143 0.661 18509 134 1 . 1 1 41 41 GLY N N 41 113.875 113.875 108.810 5.065 18509 135 1 . 1 1 41 41 GLY C C 41 170.046 170.046 172.880 -2.834 18509 136 1 . 1 1 41 41 GLY CA C 41 40.054 40.054 45.031 -4.977 18509 137 1 . 1 1 41 41 GLY H H 41 8.763 8.763 8.333 0.430 18509 138 1 . 1 1 42 42 LEU N N 42 120.137 120.137 120.556 -0.419 18509 139 1 . 1 1 42 42 LEU C C 42 174.218 174.218 175.624 -1.406 18509 140 1 . 1 1 42 42 LEU CA C 42 52.155 52.155 54.699 -2.544 18509 141 1 . 1 1 42 42 LEU H H 42 8.313 8.313 8.225 0.088 18509 142 1 . 1 1 43 43 HIS N N 43 114.385 114.385 117.212 -2.827 18509 143 1 . 1 1 43 43 HIS C C 43 171.504 171.504 174.370 -2.866 18509 144 1 . 1 1 43 43 HIS CA C 43 50.985 50.985 55.438 -4.453 18509 145 1 . 1 1 43 43 HIS H H 43 8.712 8.712 7.914 0.798 18509 146 1 . 1 1 44 44 GLY N N 44 108.872 108.872 110.753 -1.881 18509 147 1 . 1 1 44 44 GLY C C 44 168.656 168.656 172.632 -3.976 18509 148 1 . 1 1 44 44 GLY CA C 44 44.195 44.195 45.110 -0.915 18509 149 1 . 1 1 44 44 GLY H H 44 8.875 8.875 8.504 0.371 18509 150 1 . 1 1 45 45 PHE N N 45 126.439 126.439 121.516 4.923 18509 151 1 . 1 1 45 45 PHE CA C 45 53.098 53.098 56.350 -3.252 18509 152 1 . 1 1 45 45 PHE H H 45 8.111 8.111 8.025 0.086 18509 153 1 . 1 1 46 46 HIS N N 46 115.353 115.353 122.224 -6.871 18509 154 1 . 1 1 46 46 HIS C C 46 172.415 172.415 173.788 -1.373 18509 155 1 . 1 1 46 46 HIS CA C 46 49.206 49.206 54.894 -5.688 18509 156 1 . 1 1 46 46 HIS H H 46 8.107 8.107 8.486 -0.379 18509 157 1 . 1 1 47 47 VAL N N 47 120.548 120.548 122.011 -1.463 18509 158 1 . 1 1 47 47 VAL C C 47 173.900 173.900 174.018 -0.118 18509 159 1 . 1 1 47 47 VAL CA C 47 58.792 58.792 61.562 -2.770 18509 160 1 . 1 1 47 47 VAL H H 47 9.366 9.366 8.237 1.129 18509 161 1 . 1 1 48 48 HIS N N 48 129.236 129.236 122.349 6.887 18509 162 1 . 1 1 48 48 HIS C C 48 171.084 171.084 173.636 -2.552 18509 163 1 . 1 1 48 48 HIS CA C 48 52.756 52.756 54.773 -2.017 18509 164 1 . 1 1 48 48 HIS H H 48 10.210 10.210 8.393 1.817 18509 165 1 . 1 1 49 49 GLU N N 49 118.119 118.119 123.377 -5.258 18509 166 1 . 1 1 49 49 GLU C C 49 171.635 171.635 175.043 -3.408 18509 167 1 . 1 1 49 49 GLU CA C 49 57.759 57.759 55.589 2.170 18509 168 1 . 1 1 49 49 GLU H H 49 8.492 8.492 8.435 0.057 18509 169 1 . 1 1 50 50 PHE N N 50 110.329 110.329 120.674 -10.345 18509 170 1 . 1 1 50 50 PHE C C 50 175.252 175.252 174.653 0.599 18509 171 1 . 1 1 50 50 PHE CA C 50 52.900 52.900 57.950 -5.050 18509 172 1 . 1 1 50 50 PHE H H 50 8.580 8.580 8.370 0.210 18509 173 1 . 1 1 51 51 GLY N N 51 119.251 119.251 109.737 9.514 18509 174 1 . 1 1 51 51 GLY C C 51 168.248 168.248 173.095 -4.847 18509 175 1 . 1 1 51 51 GLY H H 51 10.208 10.208 7.922 2.286 18509 176 1 . 1 1 52 52 ASP N N 52 114.958 114.958 121.802 -6.844 18509 177 1 . 1 1 52 52 ASP CA C 52 48.891 48.891 54.302 -5.411 18509 178 1 . 1 1 52 52 ASP H H 52 5.834 5.834 8.284 -2.450 18509 179 1 . 1 1 53 53 ASN N N 53 128.224 128.224 117.572 10.652 18509 180 1 . 1 1 53 53 ASN CA C 53 48.233 48.233 52.621 -4.388 18509 181 1 . 1 1 53 53 ASN H H 53 9.360 9.360 8.118 1.242 18509 182 1 . 1 1 54 54 THR C C 54 168.656 168.656 174.582 -5.926 18509 183 1 . 1 1 55 55 ALA N N 55 126.661 126.661 121.040 5.621 18509 184 1 . 1 1 55 55 ALA C C 55 174.185 174.185 176.358 -2.173 18509 185 1 . 1 1 55 55 ALA CA C 55 46.155 46.155 51.672 -5.517 18509 186 1 . 1 1 55 55 ALA H H 55 8.390 8.390 7.974 0.416 18509 187 1 . 1 1 56 56 GLY N N 56 107.903 107.903 106.195 1.708 18509 188 1 . 1 1 56 56 GLY C C 56 171.578 171.578 173.010 -1.432 18509 189 1 . 1 1 56 56 GLY CA C 56 42.580 42.580 45.336 -2.756 18509 190 1 . 1 1 56 56 GLY H H 56 7.282 7.282 7.502 -0.220 18509 191 1 . 1 1 57 57 CYS N N 57 117.952 117.952 123.762 -5.810 18509 192 1 . 1 1 57 57 CYS C C 57 175.209 175.209 175.484 -0.275 18509 193 1 . 1 1 57 57 CYS CA C 57 49.088 49.088 56.885 -7.797 18509 194 1 . 1 1 57 57 CYS H H 57 8.900 8.900 8.480 0.420 18509 195 1 . 1 1 58 58 THR N N 58 119.852 119.852 119.615 0.237 18509 196 1 . 1 1 58 58 THR CA C 58 58.239 58.239 65.340 -7.101 18509 197 1 . 1 1 58 58 THR H H 58 8.505 8.505 8.578 -0.073 18509 198 1 . 1 1 59 59 SER C C 59 170.763 170.763 175.151 -4.388 18509 199 1 . 1 1 59 59 SER CA C 59 55.609 55.609 60.919 -5.310 18509 200 1 . 1 1 60 60 ALA N N 60 119.753 119.753 121.788 -2.035 18509 201 1 . 1 1 60 60 ALA CA C 60 49.940 49.940 52.390 -2.450 18509 202 1 . 1 1 60 60 ALA H H 60 6.898 6.898 8.036 -1.138 18509 203 1 . 1 1 61 61 GLY N N 61 101.351 101.351 107.997 -6.646 18509 204 1 . 1 1 61 61 GLY CA C 61 42.805 42.805 45.855 -3.050 18509 205 1 . 1 1 61 61 GLY H H 61 7.730 7.730 7.732 -0.002 18509 206 1 . 1 1 62 62 PRO C C 62 172.276 172.276 175.801 -3.525 18509 207 1 . 1 1 63 63 HIS N N 63 115.023 115.023 118.197 -3.174 18509 208 1 . 1 1 63 63 HIS CA C 63 52.119 52.119 56.045 -3.926 18509 209 1 . 1 1 63 63 HIS H H 63 7.474 7.474 7.866 -0.392 18509 210 1 . 1 1 64 64 PHE C C 64 171.731 171.731 174.112 -2.381 18509 211 1 . 1 1 65 65 ASN N N 65 126.978 126.978 121.789 5.189 18509 212 1 . 1 1 65 65 ASN CA C 65 47.753 47.753 50.282 -2.529 18509 213 1 . 1 1 65 65 ASN H H 65 9.426 9.426 8.431 0.995 18509 214 1 . 1 1 67 67 LEU N N 67 117.937 117.937 116.841 1.096 18509 215 1 . 1 1 67 67 LEU C C 67 172.580 172.580 177.666 -5.086 18509 216 1 . 1 1 67 67 LEU CA C 67 50.911 50.911 55.645 -4.734 18509 217 1 . 1 1 67 67 LEU H H 67 7.720 7.720 8.049 -0.329 18509 218 1 . 1 1 68 68 SER N N 68 110.842 110.842 114.747 -3.905 18509 219 1 . 1 1 68 68 SER CA C 68 55.953 55.953 59.474 -3.521 18509 220 1 . 1 1 68 68 SER H H 68 7.428 7.428 7.849 -0.421 18509 221 1 . 1 1 69 69 ARG N N 69 120.782 120.782 119.909 0.873 18509 222 1 . 1 1 69 69 ARG C C 69 173.381 173.381 176.332 -2.951 18509 223 1 . 1 1 69 69 ARG CA C 69 50.543 50.543 55.926 -5.383 18509 224 1 . 1 1 69 69 ARG H H 69 8.508 8.508 8.022 0.486 18509 225 1 . 1 1 70 70 LYS N N 70 118.055 118.055 118.856 -0.801 18509 226 1 . 1 1 70 70 LYS C C 70 169.994 169.994 175.976 -5.982 18509 227 1 . 1 1 70 70 LYS CA C 70 52.596 52.596 57.587 -4.992 18509 228 1 . 1 1 70 70 LYS H H 70 8.745 8.745 7.978 0.767 18509 229 1 . 1 1 71 71 HIS N N 71 111.871 111.871 116.873 -5.002 18509 230 1 . 1 1 71 71 HIS C C 71 171.534 171.534 174.591 -3.057 18509 231 1 . 1 1 71 71 HIS CA C 71 52.549 52.549 56.813 -4.264 18509 232 1 . 1 1 71 71 HIS H H 71 7.152 7.152 8.316 -1.164 18509 233 1 . 1 1 72 72 GLY N N 72 112.910 112.910 107.827 5.083 18509 234 1 . 1 1 72 72 GLY C C 72 168.634 168.634 173.009 -4.375 18509 235 1 . 1 1 72 72 GLY CA C 72 41.274 41.274 45.155 -3.881 18509 236 1 . 1 1 72 72 GLY H H 72 7.209 7.209 8.094 -0.885 18509 237 1 . 1 1 73 73 GLY N N 73 105.207 105.207 108.195 -2.988 18509 238 1 . 1 1 73 73 GLY CA C 73 41.221 41.221 43.992 -2.771 18509 239 1 . 1 1 73 73 GLY H H 73 8.789 8.789 7.968 0.821 18509 240 1 . 1 1 74 74 PRO C C 74 175.753 175.753 176.932 -1.179 18509 241 1 . 1 1 75 75 LYS N N 75 114.868 114.868 115.687 -0.819 18509 242 1 . 1 1 75 75 LYS C C 75 173.640 173.640 175.565 -1.925 18509 243 1 . 1 1 75 75 LYS CA C 75 51.103 51.103 56.227 -5.124 18509 244 1 . 1 1 75 75 LYS H H 75 8.651 8.651 7.930 0.721 18509 245 1 . 1 1 76 76 ASP N N 76 120.414 120.414 117.573 2.841 18509 246 1 . 1 1 76 76 ASP C C 76 172.557 172.557 174.740 -2.183 18509 247 1 . 1 1 76 76 ASP CA C 76 51.309 51.309 54.594 -3.285 18509 248 1 . 1 1 76 76 ASP H H 76 7.461 7.461 7.843 -0.382 18509 249 1 . 1 1 77 77 GLU N N 77 120.820 120.820 119.655 1.165 18509 250 1 . 1 1 77 77 GLU C C 77 174.101 174.101 175.511 -1.410 18509 251 1 . 1 1 77 77 GLU CA C 77 55.513 55.513 56.714 -1.201 18509 252 1 . 1 1 77 77 GLU H H 77 8.315 8.315 8.341 -0.026 18509 253 1 . 1 1 78 78 GLU N N 78 119.251 119.251 120.613 -1.362 18509 254 1 . 1 1 78 78 GLU C C 78 168.285 168.285 175.995 -7.710 18509 255 1 . 1 1 78 78 GLU CA C 78 52.078 52.078 57.289 -5.211 18509 256 1 . 1 1 78 78 GLU H H 78 8.109 8.109 8.473 -0.364 18509 257 1 . 1 1 79 79 ARG N N 79 118.991 118.991 118.405 0.586 18509 258 1 . 1 1 79 79 ARG C C 79 172.123 172.123 175.399 -3.276 18509 259 1 . 1 1 79 79 ARG CA C 79 51.074 51.074 55.966 -4.892 18509 260 1 . 1 1 79 79 ARG H H 79 6.999 6.999 8.283 -1.284 18509 261 1 . 1 1 80 80 HIS N N 80 118.000 118.000 116.882 1.118 18509 262 1 . 1 1 80 80 HIS CA C 80 49.953 49.953 56.508 -6.555 18509 263 1 . 1 1 80 80 HIS H H 80 8.355 8.355 8.356 -0.001 18509 264 1 . 1 1 81 81 VAL C C 81 173.460 173.460 175.504 -2.044 18509 265 1 . 1 1 82 82 GLY N N 82 97.322 97.322 109.363 -12.041 18509 266 1 . 1 1 82 82 GLY C C 82 170.370 170.370 172.794 -2.424 18509 267 1 . 1 1 82 82 GLY CA C 82 42.688 42.688 45.065 -2.377 18509 268 1 . 1 1 82 82 GLY H H 82 8.487 8.487 7.951 0.536 18509 269 1 . 1 1 83 83 ASP N N 83 120.890 120.890 120.976 -0.086 18509 270 1 . 1 1 83 83 ASP C C 83 168.737 168.737 174.503 -5.766 18509 271 1 . 1 1 83 83 ASP CA C 83 52.918 52.918 53.643 -0.725 18509 272 1 . 1 1 83 83 ASP H H 83 7.127 7.127 7.969 -0.842 18509 273 1 . 1 1 84 84 LEU N N 84 120.154 120.154 121.467 -1.313 18509 274 1 . 1 1 84 84 LEU C C 84 173.212 173.212 175.137 -1.925 18509 275 1 . 1 1 84 84 LEU CA C 84 50.433 50.433 53.927 -3.494 18509 276 1 . 1 1 84 84 LEU H H 84 7.128 7.128 8.134 -1.006 18509 277 1 . 1 1 85 85 GLY N N 85 106.867 106.867 109.637 -2.770 18509 278 1 . 1 1 85 85 GLY C C 85 167.654 167.654 172.439 -4.785 18509 279 1 . 1 1 85 85 GLY CA C 85 43.011 43.011 44.867 -1.856 18509 280 1 . 1 1 85 85 GLY H H 85 8.260 8.260 7.977 0.283 18509 281 1 . 1 1 86 86 ASN N N 86 117.454 117.454 119.058 -1.604 18509 282 1 . 1 1 86 86 ASN C C 86 173.942 173.942 174.045 -0.103 18509 283 1 . 1 1 86 86 ASN CA C 86 49.266 49.266 52.406 -3.140 18509 284 1 . 1 1 86 86 ASN H H 86 8.041 8.041 8.339 -0.298 18509 285 1 . 1 1 87 87 VAL N N 87 113.370 113.370 120.121 -6.751 18509 286 1 . 1 1 87 87 VAL C C 87 171.526 171.526 174.512 -2.986 18509 287 1 . 1 1 87 87 VAL CA C 87 55.708 55.708 60.659 -4.951 18509 288 1 . 1 1 87 87 VAL H H 87 8.960 8.960 8.214 0.746 18509 289 1 . 1 1 88 88 THR N N 88 117.939 117.939 119.251 -1.312 18509 290 1 . 1 1 88 88 THR C C 88 170.367 170.367 173.027 -2.660 18509 291 1 . 1 1 88 88 THR CA C 88 58.694 58.694 61.009 -2.315 18509 292 1 . 1 1 88 88 THR H H 88 8.681 8.681 8.332 0.349 18509 293 1 . 1 1 89 89 ALA N N 89 128.674 128.674 129.101 -0.427 18509 294 1 . 1 1 89 89 ALA C C 89 174.480 174.480 175.877 -1.397 18509 295 1 . 1 1 89 89 ALA CA C 89 46.369 46.369 50.428 -4.059 18509 296 1 . 1 1 89 89 ALA H H 89 9.377 9.377 8.334 1.043 18509 297 1 . 1 1 90 90 ASP N N 90 124.235 124.235 122.257 1.978 18509 298 1 . 1 1 90 90 ASP C C 90 173.825 173.825 177.202 -3.377 18509 299 1 . 1 1 90 90 ASP CA C 90 49.347 49.347 53.738 -4.391 18509 300 1 . 1 1 90 90 ASP H H 90 8.455 8.455 8.358 0.097 18509 301 1 . 1 1 91 91 LYS N N 91 114.942 114.942 119.630 -4.688 18509 302 1 . 1 1 91 91 LYS C C 91 174.101 174.101 176.371 -2.270 18509 303 1 . 1 1 91 91 LYS CA C 91 55.279 55.279 58.498 -3.219 18509 304 1 . 1 1 91 91 LYS H H 91 8.231 8.231 8.532 -0.301 18509 305 1 . 1 1 92 92 ASP N N 92 119.251 119.251 116.766 2.485 18509 306 1 . 1 1 92 92 ASP C C 92 173.020 173.020 175.806 -2.786 18509 307 1 . 1 1 92 92 ASP CA C 92 51.127 51.127 53.813 -2.686 18509 308 1 . 1 1 92 92 ASP H H 92 8.109 8.109 7.878 0.231 18509 309 1 . 1 1 93 93 GLY N N 93 110.868 110.868 108.897 1.971 18509 310 1 . 1 1 93 93 GLY C C 93 169.706 169.706 173.009 -3.303 18509 311 1 . 1 1 93 93 GLY CA C 93 43.763 43.763 45.306 -1.543 18509 312 1 . 1 1 93 93 GLY H H 93 8.405 8.405 8.220 0.185 18509 313 1 . 1 1 94 94 VAL N N 94 118.755 118.755 118.614 0.141 18509 314 1 . 1 1 94 94 VAL C C 94 173.510 173.510 174.042 -0.532 18509 315 1 . 1 1 94 94 VAL CA C 94 58.185 58.185 60.646 -2.461 18509 316 1 . 1 1 94 94 VAL H H 94 7.814 7.814 7.732 0.082 18509 317 1 . 1 1 95 95 ALA N N 95 131.313 131.313 129.715 1.598 18509 318 1 . 1 1 95 95 ALA C C 95 171.635 171.635 175.870 -4.235 18509 319 1 . 1 1 95 95 ALA CA C 95 46.914 46.914 50.323 -3.409 18509 320 1 . 1 1 95 95 ALA H H 95 9.763 9.763 8.526 1.237 18509 321 1 . 1 1 96 96 ASP N N 96 125.170 125.170 124.460 0.710 18509 322 1 . 1 1 96 96 ASP C C 96 172.336 172.336 175.651 -3.315 18509 323 1 . 1 1 96 96 ASP H H 96 8.515 8.515 8.447 0.068 18509 324 1 . 1 1 97 97 VAL N N 97 125.879 125.879 124.285 1.594 18509 325 1 . 1 1 97 97 VAL C C 97 173.488 173.488 174.987 -1.499 18509 326 1 . 1 1 97 97 VAL CA C 97 58.243 58.243 61.367 -3.124 18509 327 1 . 1 1 97 97 VAL H H 97 8.703 8.703 8.366 0.337 18509 328 1 . 1 1 98 98 SER N N 98 123.017 123.017 123.397 -0.380 18509 329 1 . 1 1 98 98 SER C C 98 169.715 169.715 173.468 -3.753 18509 330 1 . 1 1 98 98 SER CA C 98 55.068 55.068 57.740 -2.673 18509 331 1 . 1 1 98 98 SER H H 98 8.784 8.784 8.404 0.380 18509 332 1 . 1 1 99 99 ILE N N 99 125.807 125.807 124.000 1.807 18509 333 1 . 1 1 99 99 ILE C C 99 171.321 171.321 174.784 -3.463 18509 334 1 . 1 1 99 99 ILE CA C 99 57.155 57.155 60.339 -3.184 18509 335 1 . 1 1 99 99 ILE H H 99 9.411 9.411 8.136 1.275 18509 336 1 . 1 1 100 100 GLU N N 100 124.068 124.068 125.280 -1.212 18509 337 1 . 1 1 100 100 GLU C C 100 172.098 172.098 174.778 -2.680 18509 338 1 . 1 1 100 100 GLU CA C 100 52.290 52.290 55.046 -2.756 18509 339 1 . 1 1 100 100 GLU H H 100 8.652 8.652 8.499 0.153 18509 340 1 . 1 1 101 101 ASP N N 101 126.109 126.109 122.367 3.742 18509 341 1 . 1 1 101 101 ASP C C 101 171.144 171.144 175.266 -4.122 18509 342 1 . 1 1 101 101 ASP CA C 101 51.419 51.419 53.472 -2.053 18509 343 1 . 1 1 101 101 ASP H H 101 9.317 9.317 8.335 0.982 18509 344 1 . 1 1 102 102 SER N N 102 118.470 118.470 117.804 0.666 18509 345 1 . 1 1 102 102 SER C C 102 171.596 171.596 174.545 -2.949 18509 346 1 . 1 1 102 102 SER CA C 102 55.245 55.245 58.240 -2.995 18509 347 1 . 1 1 102 102 SER H H 102 8.933 8.933 8.393 0.540 18509 348 1 . 1 1 103 103 VAL N N 103 123.179 123.179 121.306 1.873 18509 349 1 . 1 1 103 103 VAL CA C 103 61.450 61.450 63.155 -1.705 18509 350 1 . 1 1 103 103 VAL H H 103 8.148 8.148 8.500 -0.352 18509 351 1 . 1 1 104 104 ILE C C 104 169.576 169.576 175.288 -5.712 18509 352 1 . 1 1 104 104 ILE CA C 104 60.194 60.194 60.852 -0.658 18509 353 1 . 1 1 105 105 SER N N 105 107.618 107.618 117.393 -9.775 18509 354 1 . 1 1 105 105 SER C C 105 170.046 170.046 174.038 -3.992 18509 355 1 . 1 1 105 105 SER CA C 105 52.550 52.550 57.832 -5.282 18509 356 1 . 1 1 105 105 SER H H 105 6.988 6.988 7.943 -0.955 18509 357 1 . 1 1 106 106 LEU N N 106 120.137 120.137 124.206 -4.069 18509 358 1 . 1 1 106 106 LEU H H 106 8.313 8.313 8.126 0.187 18509 359 1 . 1 1 107 107 SER C C 107 170.701 170.701 173.928 -3.227 18509 360 1 . 1 1 107 107 SER CA C 107 54.540 54.540 58.556 -4.016 18509 361 1 . 1 1 108 108 GLY N N 108 107.603 107.603 112.521 -4.918 18509 362 1 . 1 1 108 108 GLY C C 108 173.128 173.128 173.390 -0.262 18509 363 1 . 1 1 108 108 GLY CA C 108 41.287 41.287 44.562 -3.275 18509 364 1 . 1 1 108 108 GLY H H 108 8.717 8.717 7.968 0.749 18509 365 1 . 1 1 109 109 ASP N N 109 120.664 120.664 122.014 -1.350 18509 366 1 . 1 1 109 109 ASP C C 109 171.904 171.904 176.619 -4.715 18509 367 1 . 1 1 109 109 ASP H H 109 9.019 9.019 8.767 0.252 18509 368 1 . 1 1 110 110 HIS N N 110 116.324 116.324 117.468 -1.144 18509 369 1 . 1 1 110 110 HIS H H 110 9.283 9.283 8.506 0.777 18509 370 1 . 1 1 111 111 SER N N 111 110.225 110.225 112.551 -2.326 18509 371 1 . 1 1 111 111 SER CA C 111 54.681 54.681 58.408 -3.727 18509 372 1 . 1 1 111 111 SER H H 111 7.156 7.156 7.942 -0.786 18509 373 1 . 1 1 112 112 ILE N N 112 117.053 117.053 120.144 -3.091 18509 374 1 . 1 1 112 112 ILE C C 112 171.419 171.419 175.598 -4.179 18509 375 1 . 1 1 112 112 ILE CA C 112 57.239 57.239 61.684 -4.445 18509 376 1 . 1 1 112 112 ILE H H 112 7.837 7.837 8.293 -0.456 18509 377 1 . 1 1 113 113 ILE N N 113 121.032 121.032 119.107 1.925 18509 378 1 . 1 1 113 113 ILE C C 113 173.604 173.604 176.213 -2.609 18509 379 1 . 1 1 113 113 ILE CA C 113 58.318 58.318 61.127 -2.809 18509 380 1 . 1 1 113 113 ILE H H 113 7.592 7.592 7.561 0.031 18509 381 1 . 1 1 114 114 GLY N N 114 112.661 112.661 113.432 -0.771 18509 382 1 . 1 1 114 114 GLY C C 114 169.739 169.739 173.834 -4.095 18509 383 1 . 1 1 114 114 GLY CA C 114 41.910 41.910 45.068 -3.158 18509 384 1 . 1 1 114 114 GLY H H 114 9.575 9.575 8.602 0.973 18509 385 1 . 1 1 115 115 ARG N N 115 118.398 118.398 121.431 -3.033 18509 386 1 . 1 1 115 115 ARG C C 115 171.079 171.079 175.358 -4.279 18509 387 1 . 1 1 115 115 ARG CA C 115 51.663 51.663 54.314 -2.651 18509 388 1 . 1 1 115 115 ARG H H 115 7.464 7.464 7.743 -0.279 18509 389 1 . 1 1 116 116 THR N N 116 112.218 112.218 117.041 -4.823 18509 390 1 . 1 1 116 116 THR C C 116 169.821 169.821 174.355 -4.534 18509 391 1 . 1 1 116 116 THR CA C 116 59.633 59.633 61.393 -1.760 18509 392 1 . 1 1 116 116 THR H H 116 6.677 6.677 8.378 -1.701 18509 393 1 . 1 1 117 117 LEU N N 117 129.477 129.477 126.457 3.020 18509 394 1 . 1 1 117 117 LEU C C 117 171.126 171.126 175.294 -4.168 18509 395 1 . 1 1 117 117 LEU CA C 117 50.415 50.415 54.414 -4.000 18509 396 1 . 1 1 117 117 LEU H H 117 8.799 8.799 8.644 0.155 18509 397 1 . 1 1 118 118 VAL N N 118 125.091 125.091 124.769 0.322 18509 398 1 . 1 1 118 118 VAL C C 118 170.267 170.267 174.925 -4.658 18509 399 1 . 1 1 118 118 VAL CA C 118 58.139 58.139 61.315 -3.176 18509 400 1 . 1 1 118 118 VAL H H 118 8.906 8.906 8.298 0.608 18509 401 1 . 1 1 119 119 VAL N N 119 120.716 120.716 124.821 -4.105 18509 402 1 . 1 1 119 119 VAL C C 119 171.175 171.175 173.800 -2.625 18509 403 1 . 1 1 119 119 VAL CA C 119 55.271 55.271 59.741 -4.470 18509 404 1 . 1 1 119 119 VAL H H 119 7.982 7.982 7.949 0.033 18509 405 1 . 1 1 120 120 HIS N N 120 125.052 125.052 120.849 4.203 18509 406 1 . 1 1 120 120 HIS C C 120 172.599 172.599 173.777 -1.178 18509 407 1 . 1 1 120 120 HIS CA C 120 53.394 53.394 54.866 -1.472 18509 408 1 . 1 1 120 120 HIS H H 120 8.935 8.935 8.337 0.598 18509 409 1 . 1 1 121 121 GLU N N 121 121.453 121.453 122.056 -0.603 18509 410 1 . 1 1 121 121 GLU C C 121 172.304 172.304 175.595 -3.291 18509 411 1 . 1 1 121 121 GLU CA C 121 56.090 56.090 56.708 -0.618 18509 412 1 . 1 1 121 121 GLU H H 121 9.178 9.178 8.220 0.958 18509 413 1 . 1 1 122 122 LYS N N 122 115.248 115.248 121.711 -6.463 18509 414 1 . 1 1 122 122 LYS C C 122 171.523 171.523 174.479 -2.956 18509 415 1 . 1 1 122 122 LYS CA C 122 50.619 50.619 55.256 -4.637 18509 416 1 . 1 1 122 122 LYS H H 122 8.478 8.478 7.984 0.494 18509 417 1 . 1 1 123 123 ALA N N 123 120.866 120.866 124.450 -3.584 18509 418 1 . 1 1 123 123 ALA C C 123 173.219 173.219 176.631 -3.412 18509 419 1 . 1 1 123 123 ALA CA C 123 48.850 48.850 52.245 -3.395 18509 420 1 . 1 1 123 123 ALA H H 123 7.796 7.796 8.514 -0.718 18509 421 1 . 1 1 124 124 ASP N N 124 121.799 121.799 124.336 -2.537 18509 422 1 . 1 1 124 124 ASP C C 124 174.458 174.458 175.142 -0.684 18509 423 1 . 1 1 124 124 ASP CA C 124 49.408 49.408 53.589 -4.181 18509 424 1 . 1 1 124 124 ASP H H 124 10.165 10.165 8.369 1.796 18509 425 1 . 1 1 125 125 ASP N N 125 129.369 129.369 121.858 7.511 18509 426 1 . 1 1 125 125 ASP C C 125 175.231 175.231 176.012 -0.781 18509 427 1 . 1 1 125 125 ASP CA C 125 50.939 50.939 53.935 -2.996 18509 428 1 . 1 1 125 125 ASP H H 125 10.055 10.055 7.972 2.083 18509 429 1 . 1 1 126 126 LEU N N 126 117.190 117.190 123.489 -6.299 18509 430 1 . 1 1 126 126 LEU C C 126 173.964 173.964 178.111 -4.147 18509 431 1 . 1 1 126 126 LEU H H 126 10.483 10.483 8.487 1.996 18509 432 1 . 1 1 127 127 GLY N N 127 103.809 103.809 105.483 -1.674 18509 433 1 . 1 1 127 127 GLY CA C 127 42.878 42.878 45.975 -3.097 18509 434 1 . 1 1 127 127 GLY H H 127 8.637 8.637 8.328 0.309 18509 435 1 . 1 1 128 128 LYS N N 128 118.290 118.290 120.550 -2.260 18509 436 1 . 1 1 128 128 LYS CA C 128 51.740 51.740 55.723 -3.983 18509 437 1 . 1 1 128 128 LYS H H 128 7.158 7.158 8.088 -0.930 18509 438 1 . 1 1 129 129 GLY N N 129 108.507 108.507 107.829 0.678 18509 439 1 . 1 1 129 129 GLY C C 129 171.524 171.524 174.569 -3.045 18509 440 1 . 1 1 129 129 GLY CA C 129 42.113 42.113 46.052 -3.939 18509 441 1 . 1 1 129 129 GLY H H 129 8.913 8.913 8.128 0.785 18509 442 1 . 1 1 130 130 GLY N N 130 108.537 108.537 109.832 -1.295 18509 443 1 . 1 1 130 130 GLY C C 130 169.994 169.994 173.292 -3.298 18509 444 1 . 1 1 130 130 GLY CA C 130 42.419 42.419 44.968 -2.549 18509 445 1 . 1 1 130 130 GLY H H 130 8.723 8.723 8.149 0.574 18509 446 1 . 1 1 131 131 ASN N N 131 111.951 111.951 119.202 -7.251 18509 447 1 . 1 1 131 131 ASN C C 131 172.236 172.236 175.560 -3.324 18509 448 1 . 1 1 131 131 ASN H H 131 7.152 7.152 8.025 -0.873 18509 449 1 . 1 1 132 132 GLU N N 132 120.461 120.461 120.893 -0.432 18509 450 1 . 1 1 132 132 GLU C C 132 171.084 171.084 177.802 -6.718 18509 451 1 . 1 1 132 132 GLU H H 132 8.935 8.935 8.855 0.080 18509 452 1 . 1 1 133 133 GLU N N 133 120.137 120.137 118.341 1.796 18509 453 1 . 1 1 133 133 GLU C C 133 176.239 176.239 178.651 -2.412 18509 454 1 . 1 1 133 133 GLU H H 133 8.775 8.775 8.572 0.203 18509 455 1 . 1 1 134 134 SER N N 134 114.981 114.981 115.210 -0.229 18509 456 1 . 1 1 134 134 SER CA C 134 59.046 59.046 61.391 -2.345 18509 457 1 . 1 1 134 134 SER H H 134 8.117 8.117 8.148 -0.031 18509 458 1 . 1 1 135 135 THR N N 135 102.263 102.263 116.696 -14.433 18509 459 1 . 1 1 135 135 THR C C 135 172.804 172.804 175.513 -2.709 18509 460 1 . 1 1 135 135 THR CA C 135 60.029 60.029 64.889 -4.860 18509 461 1 . 1 1 135 135 THR H H 135 7.206 7.206 8.182 -0.976 18509 462 1 . 1 1 136 136 LYS N N 136 122.108 122.108 120.030 2.078 18509 463 1 . 1 1 136 136 LYS H H 136 7.884 7.884 7.609 0.275 18509 464 1 . 1 1 137 137 THR N N 137 105.718 105.718 111.541 -5.823 18509 465 1 . 1 1 137 137 THR H H 137 8.630 8.630 7.775 0.855 18509 466 1 . 1 1 138 138 GLY N N 138 111.372 111.372 110.663 0.709 18509 467 1 . 1 1 138 138 GLY CA C 138 42.483 42.483 45.158 -2.675 18509 468 1 . 1 1 138 138 GLY H H 138 7.426 7.426 7.781 -0.355 18509 469 1 . 1 1 139 139 ASN N N 139 107.496 107.496 120.126 -12.630 18509 470 1 . 1 1 139 139 ASN H H 139 7.545 7.545 7.962 -0.417 18509 471 1 . 1 1 140 140 ALA N N 140 114.542 114.542 126.753 -12.211 18509 472 1 . 1 1 140 140 ALA C C 140 173.571 173.571 176.570 -2.999 18509 473 1 . 1 1 140 140 ALA H H 140 6.368 6.368 8.079 -1.711 18509 474 1 . 1 1 141 141 GLY N N 141 105.287 105.287 108.101 -2.814 18509 475 1 . 1 1 141 141 GLY C C 141 173.542 173.542 175.213 -1.671 18509 476 1 . 1 1 141 141 GLY H H 141 8.271 8.271 8.555 -0.284 18509 477 1 . 1 1 142 142 SER N N 142 118.771 118.771 119.231 -0.460 18509 478 1 . 1 1 142 142 SER C C 142 170.188 170.188 175.187 -4.999 18509 479 1 . 1 1 142 142 SER H H 142 9.196 9.196 8.394 0.802 18509 480 1 . 1 1 143 143 ARG N N 143 120.189 120.189 116.426 3.763 18509 481 1 . 1 1 143 143 ARG C C 143 171.596 171.596 176.862 -5.266 18509 482 1 . 1 1 143 143 ARG H H 143 8.943 8.943 8.002 0.941 18509 483 1 . 1 1 144 144 LEU N N 144 122.907 122.907 121.142 1.765 18509 484 1 . 1 1 144 144 LEU C C 144 174.393 174.393 176.017 -1.624 18509 485 1 . 1 1 144 144 LEU CA C 144 53.375 53.375 56.667 -3.292 18509 486 1 . 1 1 144 144 LEU H H 144 8.395 8.395 7.897 0.498 18509 487 1 . 1 1 145 145 ALA N N 145 114.159 114.159 116.937 -2.778 18509 488 1 . 1 1 145 145 ALA C C 145 171.752 171.752 175.030 -3.278 18509 489 1 . 1 1 145 145 ALA CA C 145 48.129 48.129 51.548 -3.419 18509 490 1 . 1 1 145 145 ALA H H 145 7.356 7.356 7.537 -0.181 18509 491 1 . 1 1 146 146 CYS N N 146 110.738 110.738 120.648 -9.910 18509 492 1 . 1 1 146 146 CYS C C 146 170.087 170.087 173.960 -3.873 18509 493 1 . 1 1 146 146 CYS CA C 146 51.077 51.077 57.627 -6.550 18509 494 1 . 1 1 146 146 CYS H H 146 9.008 9.008 8.230 0.778 18509 495 1 . 1 1 147 147 GLY N N 147 106.461 106.461 110.007 -3.546 18509 496 1 . 1 1 147 147 GLY C C 147 167.909 167.909 172.245 -4.336 18509 497 1 . 1 1 147 147 GLY CA C 147 42.674 42.674 45.208 -2.534 18509 498 1 . 1 1 147 147 GLY H H 147 8.018 8.018 8.171 -0.153 18509 499 1 . 1 1 148 148 VAL N N 148 124.054 124.054 122.858 1.196 18509 500 1 . 1 1 148 148 VAL C C 148 172.084 172.084 174.995 -2.911 18509 501 1 . 1 1 148 148 VAL CA C 148 59.635 59.635 62.642 -3.007 18509 502 1 . 1 1 148 148 VAL H H 148 8.434 8.434 8.284 0.150 18509 503 1 . 1 1 149 149 ILE N N 149 126.918 126.918 127.912 -0.994 18509 504 1 . 1 1 149 149 ILE C C 149 171.804 171.804 174.579 -2.775 18509 505 1 . 1 1 149 149 ILE CA C 149 59.184 59.184 59.426 -0.242 18509 506 1 . 1 1 149 149 ILE H H 149 8.613 8.613 8.601 0.012 18509 507 1 . 1 1 150 150 GLY N N 150 116.493 116.493 114.094 2.399 18509 508 1 . 1 1 150 150 GLY C C 150 170.188 170.188 172.327 -2.139 18509 509 1 . 1 1 150 150 GLY CA C 150 40.120 40.120 44.682 -4.562 18509 510 1 . 1 1 150 150 GLY H H 150 9.283 9.283 8.111 1.172 18509 511 1 . 1 1 151 151 ILE N N 151 120.189 120.189 121.317 -1.128 18509 512 1 . 1 1 151 151 ILE C C 151 172.231 172.231 174.560 -2.329 18509 513 1 . 1 1 151 151 ILE CA C 151 60.372 60.372 61.738 -1.366 18509 514 1 . 1 1 151 151 ILE H H 151 8.943 8.943 8.370 0.573 18509 515 1 . 1 1 152 152 ALA N N 152 129.719 129.719 131.175 -1.456 18509 516 1 . 1 1 152 152 ALA CA C 152 46.772 46.772 51.270 -4.498 18509 517 1 . 1 1 152 152 ALA H H 152 8.170 8.170 8.072 0.098 18509 stop_ save_