data_17569 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17569 _Entry.PDB_ID 2LBM 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 17569 _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 ALA HA H 156 4.387 4.387 5.094 -0.707 17569 2 1 1 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.909 -0.464 17569 3 1 1 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.433 -0.177 17569 4 1 1 . 1 1 3 3 MET HA H 157 4.476 4.476 4.868 -0.392 17569 5 1 1 . 1 1 3 3 MET CA C 157 55.401 55.401 54.410 0.991 17569 6 1 1 . 1 1 4 4 ALA N N 158 124.828 124.828 124.032 0.796 17569 7 1 1 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.589 -0.275 17569 8 1 1 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.918 0.593 17569 9 1 1 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.090 -1.089 17569 10 1 1 . 1 1 4 4 ALA H H 158 8.382 8.382 8.285 0.097 17569 11 1 1 . 1 1 5 5 ASP N N 159 119.418 119.418 124.373 -4.955 17569 12 1 1 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.761 -0.171 17569 13 1 1 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.159 -0.023 17569 14 1 1 . 1 1 5 5 ASP CB C 159 41.015 41.015 40.846 0.169 17569 15 1 1 . 1 1 5 5 ASP H H 159 8.312 8.312 8.514 -0.202 17569 16 1 1 . 1 1 6 6 LYS N N 160 121.604 121.604 120.649 0.955 17569 17 1 1 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.698 -0.355 17569 18 1 1 . 1 1 6 6 LYS H H 160 8.274 8.274 8.409 -0.135 17569 19 1 1 . 1 1 7 7 ARG N N 161 121.611 121.611 122.119 -0.508 17569 20 1 1 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.563 -0.236 17569 21 1 1 . 1 1 7 7 ARG H H 161 8.430 8.430 8.752 -0.322 17569 22 1 1 . 1 1 8 8 GLY N N 162 109.606 109.606 109.334 0.272 17569 23 1 1 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.596 0.451 17569 24 1 1 . 1 1 8 8 GLY H H 162 8.473 8.473 7.947 0.526 17569 25 1 1 . 1 1 9 9 ASP N N 163 120.187 120.187 119.799 0.388 17569 26 1 1 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.869 -0.220 17569 27 1 1 . 1 1 9 9 ASP CA C 163 54.151 54.151 54.454 -0.303 17569 28 1 1 . 1 1 9 9 ASP H H 163 8.296 8.296 8.272 0.024 17569 29 1 1 . 1 1 10 10 GLY N N 164 108.816 108.816 108.660 0.156 17569 30 1 1 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.121 0.246 17569 31 1 1 . 1 1 10 10 GLY H H 164 8.458 8.458 8.085 0.373 17569 32 1 1 . 1 1 11 11 LEU N N 165 121.195 121.195 122.068 -0.873 17569 33 1 1 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.696 -0.380 17569 34 1 1 . 1 1 11 11 LEU CA C 165 55.000 55.000 55.573 -0.573 17569 35 1 1 . 1 1 11 11 LEU CB C 165 41.932 41.932 43.033 -1.101 17569 36 1 1 . 1 1 11 11 LEU H H 165 8.137 8.137 7.800 0.337 17569 37 1 1 . 1 1 12 12 HIS N N 166 119.387 119.387 121.393 -2.006 17569 38 1 1 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.977 -0.322 17569 39 1 1 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.305 0.964 17569 40 1 1 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.837 -1.140 17569 41 1 1 . 1 1 12 12 HIS H H 166 8.270 8.270 8.211 0.059 17569 42 1 1 . 1 1 13 13 GLY N N 167 109.899 109.899 109.602 0.297 17569 43 1 1 . 1 1 13 13 GLY CA C 167 45.105 45.105 45.216 -0.111 17569 44 1 1 . 1 1 13 13 GLY H H 167 8.276 8.276 8.491 -0.215 17569 45 1 1 . 1 1 14 14 ILE N N 168 119.597 119.597 121.477 -1.880 17569 46 1 1 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.225 0.098 17569 47 1 1 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.630 -0.030 17569 48 1 1 . 1 1 14 14 ILE CB C 168 38.950 38.950 40.762 -1.812 17569 49 1 1 . 1 1 14 14 ILE H H 168 7.962 7.962 8.040 -0.078 17569 50 1 1 . 1 1 15 15 VAL N N 169 127.578 127.578 129.016 -1.438 17569 51 1 1 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.107 0.173 17569 52 1 1 . 1 1 15 15 VAL CA C 169 61.317 61.317 61.894 -0.577 17569 53 1 1 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.303 2.099 17569 54 1 1 . 1 1 15 15 VAL H H 169 9.011 9.011 8.469 0.542 17569 55 1 1 . 1 1 16 16 SER N N 170 118.596 118.596 121.293 -2.697 17569 56 1 1 . 1 1 16 16 SER HA H 170 5.140 5.140 4.910 0.230 17569 57 1 1 . 1 1 16 16 SER CA C 170 55.985 55.985 56.529 -0.543 17569 58 1 1 . 1 1 16 16 SER CB C 170 65.261 65.261 65.111 0.150 17569 59 1 1 . 1 1 16 16 SER H H 170 8.242 8.242 7.884 0.358 17569 60 1 1 . 1 1 17 17 CYS N N 171 123.783 123.783 124.104 -0.321 17569 61 1 1 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.216 -0.035 17569 62 1 1 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.620 -0.776 17569 63 1 1 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.788 2.584 17569 64 1 1 . 1 1 17 17 CYS H H 171 8.894 8.894 8.468 0.426 17569 65 1 1 . 1 1 18 18 THR N N 172 121.703 121.703 117.594 4.109 17569 66 1 1 . 1 1 18 18 THR HA H 172 4.386 4.386 4.121 0.265 17569 67 1 1 . 1 1 18 18 THR CA C 172 64.667 64.667 64.063 0.604 17569 68 1 1 . 1 1 18 18 THR CB C 172 69.498 69.498 68.663 0.835 17569 69 1 1 . 1 1 18 18 THR H H 172 8.788 8.788 8.312 0.476 17569 70 1 1 . 1 1 19 19 ALA N N 173 131.364 131.364 121.029 10.335 17569 71 1 1 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.107 0.389 17569 72 1 1 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.573 0.452 17569 73 1 1 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.742 3.440 17569 74 1 1 . 1 1 19 19 ALA H H 173 9.680 9.680 8.108 1.572 17569 75 1 1 . 1 1 20 20 CYS N N 174 115.498 115.498 114.543 0.955 17569 76 1 1 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.686 0.282 17569 77 1 1 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.118 -1.024 17569 78 1 1 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.981 4.263 17569 79 1 1 . 1 1 20 20 CYS H H 174 8.470 8.470 7.758 0.712 17569 80 1 1 . 1 1 21 21 GLY N N 175 112.464 112.464 109.156 3.308 17569 81 1 1 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.018 0.688 17569 82 1 1 . 1 1 21 21 GLY H H 175 7.884 7.884 8.062 -0.178 17569 83 1 1 . 1 1 22 22 GLN N N 176 121.784 121.784 117.796 3.988 17569 84 1 1 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.506 -0.130 17569 85 1 1 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.415 1.876 17569 86 1 1 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.261 -2.920 17569 87 1 1 . 1 1 22 22 GLN H H 176 8.723 8.723 7.886 0.837 17569 88 1 1 . 1 1 23 23 GLN N N 177 122.900 122.900 121.655 1.245 17569 89 1 1 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.201 0.329 17569 90 1 1 . 1 1 23 23 GLN CA C 177 56.550 56.550 57.202 -0.652 17569 91 1 1 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.273 -0.813 17569 92 1 1 . 1 1 23 23 GLN H H 177 8.721 8.721 8.574 0.147 17569 93 1 1 . 1 1 24 24 VAL N N 178 121.000 121.000 122.739 -1.739 17569 94 1 1 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.095 0.429 17569 95 1 1 . 1 1 24 24 VAL CA C 178 59.877 59.877 60.562 -0.685 17569 96 1 1 . 1 1 24 24 VAL H H 178 8.689 8.689 8.241 0.448 17569 97 1 1 . 1 1 25 25 ASN N N 179 121.392 121.392 122.824 -1.432 17569 98 1 1 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.333 0.543 17569 99 1 1 . 1 1 25 25 ASN CA C 179 52.149 52.149 53.958 -1.809 17569 100 1 1 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.258 -0.280 17569 101 1 1 . 1 1 25 25 ASN H H 179 8.635 8.635 8.181 0.454 17569 102 1 1 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.282 0.178 17569 103 1 1 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.541 -1.542 17569 104 1 1 . 1 1 27 27 PHE CB C 181 38.393 38.393 37.815 0.578 17569 105 1 1 . 1 1 28 28 GLN N N 182 119.300 119.300 125.957 -6.657 17569 106 1 1 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.635 -0.117 17569 107 1 1 . 1 1 28 28 GLN CA C 182 54.342 54.342 54.964 -0.622 17569 108 1 1 . 1 1 28 28 GLN CB C 182 30.350 30.350 31.352 -1.002 17569 109 1 1 . 1 1 28 28 GLN H H 182 7.494 7.494 7.943 -0.449 17569 110 1 1 . 1 1 29 29 LYS N N 183 124.516 124.516 127.007 -2.491 17569 111 1 1 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.481 -0.559 17569 112 1 1 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.415 1.897 17569 113 1 1 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.406 -0.120 17569 114 1 1 . 1 1 29 29 LYS H H 183 8.779 8.779 8.813 -0.034 17569 115 1 1 . 1 1 30 30 ASP N N 184 116.500 116.500 118.338 -1.838 17569 116 1 1 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.717 -0.258 17569 117 1 1 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.800 -0.265 17569 118 1 1 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.017 -1.046 17569 119 1 1 . 1 1 30 30 ASP H H 184 8.556 8.556 8.201 0.355 17569 120 1 1 . 1 1 31 31 SER N N 185 111.505 111.505 113.643 -2.138 17569 121 1 1 . 1 1 31 31 SER HA H 185 4.695 4.695 4.688 0.007 17569 122 1 1 . 1 1 31 31 SER CA C 185 59.747 59.747 58.964 0.783 17569 123 1 1 . 1 1 31 31 SER CB C 185 65.198 65.198 63.622 1.576 17569 124 1 1 . 1 1 31 31 SER H H 185 7.933 7.933 8.382 -0.449 17569 125 1 1 . 1 1 32 32 ILE N N 186 113.394 113.394 116.205 -2.811 17569 126 1 1 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.942 -0.056 17569 127 1 1 . 1 1 32 32 ILE CA C 186 59.579 59.579 59.179 0.400 17569 128 1 1 . 1 1 32 32 ILE CB C 186 41.812 41.812 42.008 -0.196 17569 129 1 1 . 1 1 32 32 ILE H H 186 7.105 7.105 7.190 -0.085 17569 130 1 1 . 1 1 33 33 TYR N N 187 119.098 119.098 123.112 -4.014 17569 131 1 1 . 1 1 33 33 TYR HA H 187 4.523 4.523 4.755 -0.232 17569 132 1 1 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.739 0.521 17569 133 1 1 . 1 1 33 33 TYR CB C 187 43.440 43.440 42.546 0.894 17569 134 1 1 . 1 1 33 33 TYR H H 187 8.954 8.954 8.254 0.700 17569 135 1 1 . 1 1 34 34 ARG N N 188 118.502 118.502 124.827 -6.325 17569 136 1 1 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.970 -0.333 17569 137 1 1 . 1 1 34 34 ARG CA C 188 54.752 54.752 55.849 -1.097 17569 138 1 1 . 1 1 34 34 ARG CB C 188 31.251 31.251 29.813 1.438 17569 139 1 1 . 1 1 34 34 ARG H H 188 8.412 8.412 8.660 -0.248 17569 140 1 1 . 1 1 35 35 HIS N N 189 126.596 126.596 127.536 -0.940 17569 141 1 1 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.889 -0.297 17569 142 1 1 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.029 -0.308 17569 143 1 1 . 1 1 35 35 HIS CB C 189 32.472 32.472 30.963 1.509 17569 144 1 1 . 1 1 35 35 HIS H H 189 9.813 9.813 8.969 0.844 17569 145 1 1 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.540 -0.242 17569 146 1 1 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.498 0.778 17569 147 1 1 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.175 0.676 17569 148 1 1 . 1 1 37 37 SER N N 191 110.003 110.003 113.480 -3.477 17569 149 1 1 . 1 1 37 37 SER HA H 191 4.918 4.918 4.260 0.658 17569 150 1 1 . 1 1 37 37 SER CA C 191 59.031 59.031 60.579 -1.548 17569 151 1 1 . 1 1 37 37 SER CB C 191 65.104 65.104 63.341 1.763 17569 152 1 1 . 1 1 37 37 SER H H 191 8.934 8.934 8.229 0.705 17569 153 1 1 . 1 1 38 38 LEU N N 192 120.959 120.959 113.978 6.981 17569 154 1 1 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.918 -0.789 17569 155 1 1 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.322 1.825 17569 156 1 1 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.500 1.496 17569 157 1 1 . 1 1 38 38 LEU H H 192 8.649 8.649 6.999 1.650 17569 158 1 1 . 1 1 39 39 GLN N N 193 108.600 108.600 119.118 -10.518 17569 159 1 1 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.077 -0.172 17569 160 1 1 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.644 0.170 17569 161 1 1 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.916 -1.883 17569 162 1 1 . 1 1 39 39 GLN H H 193 8.465 8.465 7.920 0.545 17569 163 1 1 . 1 1 40 40 VAL N N 194 105.325 105.325 117.857 -12.532 17569 164 1 1 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.559 -0.009 17569 165 1 1 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.690 -1.049 17569 166 1 1 . 1 1 40 40 VAL H H 194 6.256 6.256 7.949 -1.693 17569 167 1 1 . 1 1 41 41 LEU N N 195 123.100 123.100 121.254 1.846 17569 168 1 1 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.981 -0.165 17569 169 1 1 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.471 3.711 17569 170 1 1 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.498 0.072 17569 171 1 1 . 1 1 41 41 LEU H H 195 9.154 9.154 8.571 0.583 17569 172 1 1 . 1 1 42 42 ILE N N 196 124.396 124.396 116.680 7.716 17569 173 1 1 . 1 1 42 42 ILE HA H 196 6.352 6.352 5.025 1.327 17569 174 1 1 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.731 0.499 17569 175 1 1 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.847 1.423 17569 176 1 1 . 1 1 42 42 ILE H H 196 9.766 9.766 8.427 1.339 17569 177 1 1 . 1 1 43 43 CYS N N 197 121.500 121.500 115.574 5.926 17569 178 1 1 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.370 -0.108 17569 179 1 1 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.296 0.407 17569 180 1 1 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.017 2.283 17569 181 1 1 . 1 1 43 43 CYS H H 197 9.882 9.882 8.514 1.368 17569 182 1 1 . 1 1 44 44 LYS N N 198 117.995 117.995 122.702 -4.707 17569 183 1 1 . 1 1 44 44 LYS HA H 198 3.989 3.989 3.743 0.246 17569 184 1 1 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.204 -0.544 17569 185 1 1 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.543 0.157 17569 186 1 1 . 1 1 44 44 LYS H H 198 8.089 8.089 8.318 -0.229 17569 187 1 1 . 1 1 45 45 ASN N N 199 119.200 119.200 117.195 2.005 17569 188 1 1 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.482 0.032 17569 189 1 1 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.411 0.309 17569 190 1 1 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.210 -0.043 17569 191 1 1 . 1 1 45 45 ASN H H 199 8.356 8.356 8.567 -0.211 17569 192 1 1 . 1 1 46 46 CYS N N 200 126.600 126.600 118.526 8.074 17569 193 1 1 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.928 0.253 17569 194 1 1 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.501 1.994 17569 195 1 1 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.138 2.044 17569 196 1 1 . 1 1 46 46 CYS H H 200 9.189 9.189 7.948 1.241 17569 197 1 1 . 1 1 47 47 PHE N N 201 121.962 121.962 120.237 1.725 17569 198 1 1 . 1 1 47 47 PHE HA H 201 3.870 3.870 3.986 -0.116 17569 199 1 1 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.635 1.634 17569 200 1 1 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.215 0.952 17569 201 1 1 . 1 1 47 47 PHE H H 201 8.826 8.826 7.318 1.508 17569 202 1 1 . 1 1 48 48 LYS N N 202 117.400 117.400 119.675 -2.275 17569 203 1 1 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.891 -0.193 17569 204 1 1 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.571 -0.619 17569 205 1 1 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.416 -0.874 17569 206 1 1 . 1 1 48 48 LYS H H 202 8.512 8.512 8.231 0.281 17569 207 1 1 . 1 1 49 49 TYR N N 203 120.400 120.400 120.955 -0.555 17569 208 1 1 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.163 0.251 17569 209 1 1 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.550 -0.778 17569 210 1 1 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.602 -0.156 17569 211 1 1 . 1 1 49 49 TYR H H 203 8.133 8.133 7.813 0.320 17569 212 1 1 . 1 1 50 50 TYR N N 204 121.783 121.783 117.451 4.332 17569 213 1 1 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.576 -1.081 17569 214 1 1 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.135 2.815 17569 215 1 1 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.510 0.982 17569 216 1 1 . 1 1 50 50 TYR H H 204 8.765 8.765 7.531 1.234 17569 217 1 1 . 1 1 51 51 MET N N 205 110.800 110.800 115.710 -4.910 17569 218 1 1 . 1 1 51 51 MET HA H 205 4.349 4.349 4.155 0.194 17569 219 1 1 . 1 1 51 51 MET CA C 205 53.505 53.505 58.176 -4.671 17569 220 1 1 . 1 1 51 51 MET CB C 205 30.384 30.384 33.249 -2.865 17569 221 1 1 . 1 1 51 51 MET H H 205 7.771 7.771 7.682 0.089 17569 222 1 1 . 1 1 52 52 SER N N 206 116.800 116.800 113.071 3.729 17569 223 1 1 . 1 1 52 52 SER HA H 206 3.919 3.919 4.432 -0.513 17569 224 1 1 . 1 1 52 52 SER CA C 206 61.621 61.621 59.993 1.628 17569 225 1 1 . 1 1 52 52 SER CB C 206 62.611 62.611 64.510 -1.899 17569 226 1 1 . 1 1 52 52 SER H H 206 7.581 7.581 8.011 -0.430 17569 227 1 1 . 1 1 53 53 ASP N N 207 117.400 117.400 121.721 -4.321 17569 228 1 1 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.742 -0.171 17569 229 1 1 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.411 -0.312 17569 230 1 1 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.942 0.246 17569 231 1 1 . 1 1 53 53 ASP H H 207 7.085 7.085 7.962 -0.877 17569 232 1 1 . 1 1 54 54 ASP N N 208 119.405 119.405 122.285 -2.880 17569 233 1 1 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.907 -0.518 17569 234 1 1 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.533 0.367 17569 235 1 1 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.627 -1.278 17569 236 1 1 . 1 1 54 54 ASP H H 208 8.439 8.439 8.325 0.114 17569 237 1 1 . 1 1 55 55 ILE N N 209 124.698 124.698 120.987 3.711 17569 238 1 1 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.328 -0.328 17569 239 1 1 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.947 1.331 17569 240 1 1 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.575 0.716 17569 241 1 1 . 1 1 55 55 ILE H H 209 8.128 8.128 8.416 -0.288 17569 242 1 1 . 1 1 56 56 SER N N 210 126.703 126.703 117.857 8.846 17569 243 1 1 . 1 1 56 56 SER HA H 210 4.365 4.365 4.692 -0.327 17569 244 1 1 . 1 1 56 56 SER CA C 210 57.769 57.769 57.449 0.320 17569 245 1 1 . 1 1 56 56 SER CB C 210 64.991 64.991 64.224 0.767 17569 246 1 1 . 1 1 56 56 SER H H 210 8.815 8.815 8.284 0.531 17569 247 1 1 . 1 1 57 57 ARG N N 211 116.885 116.885 119.828 -2.943 17569 248 1 1 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.506 0.536 17569 249 1 1 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.439 -1.039 17569 250 1 1 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.493 2.791 17569 251 1 1 . 1 1 57 57 ARG H H 211 8.365 8.365 8.431 -0.066 17569 252 1 1 . 1 1 58 58 ASP N N 212 121.982 121.982 124.696 -2.714 17569 253 1 1 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.528 0.087 17569 254 1 1 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.236 -2.014 17569 255 1 1 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.257 -0.755 17569 256 1 1 . 1 1 58 58 ASP H H 212 8.706 8.706 8.865 -0.159 17569 257 1 1 . 1 1 59 59 SER N N 213 114.164 114.164 116.563 -2.399 17569 258 1 1 . 1 1 59 59 SER HA H 213 4.212 4.212 4.206 0.006 17569 259 1 1 . 1 1 59 59 SER CA C 213 60.840 60.840 61.105 -0.265 17569 260 1 1 . 1 1 59 59 SER CB C 213 62.714 62.714 63.172 -0.458 17569 261 1 1 . 1 1 59 59 SER H H 213 8.687 8.687 8.811 -0.124 17569 262 1 1 . 1 1 60 60 ASP N N 214 120.899 120.899 119.491 1.408 17569 263 1 1 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.714 0.111 17569 264 1 1 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.715 0.496 17569 265 1 1 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.100 1.458 17569 266 1 1 . 1 1 60 60 ASP H H 214 8.193 8.193 7.838 0.355 17569 267 1 1 . 1 1 61 61 GLY N N 215 108.300 108.300 108.254 0.046 17569 268 1 1 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.992 -0.596 17569 269 1 1 . 1 1 61 61 GLY H H 215 8.234 8.234 8.137 0.097 17569 270 1 1 . 1 1 62 62 MET N N 216 120.002 120.002 119.384 0.618 17569 271 1 1 . 1 1 62 62 MET HA H 216 4.972 4.972 4.615 0.357 17569 272 1 1 . 1 1 62 62 MET CA C 216 53.151 53.151 54.499 -1.349 17569 273 1 1 . 1 1 62 62 MET CB C 216 32.311 32.311 34.872 -2.561 17569 274 1 1 . 1 1 62 62 MET H H 216 8.376 8.376 7.434 0.942 17569 275 1 1 . 1 1 63 63 ASP N N 217 127.300 127.300 125.592 1.708 17569 276 1 1 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.511 0.455 17569 277 1 1 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.694 -0.125 17569 278 1 1 . 1 1 63 63 ASP H H 217 9.368 9.368 8.811 0.557 17569 279 1 1 . 1 1 64 64 GLU N N 218 114.400 114.400 120.707 -6.307 17569 280 1 1 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.340 -0.184 17569 281 1 1 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.668 0.182 17569 282 1 1 . 1 1 64 64 GLU H H 218 8.583 8.583 8.444 0.139 17569 283 1 1 . 1 1 65 65 GLN N N 219 115.500 115.500 117.773 -2.273 17569 284 1 1 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.511 -0.200 17569 285 1 1 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.149 0.197 17569 286 1 1 . 1 1 65 65 GLN H H 219 7.158 7.158 7.612 -0.454 17569 287 1 1 . 1 1 66 66 CYS N N 220 122.600 122.600 117.916 4.684 17569 288 1 1 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.283 -1.206 17569 289 1 1 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.374 1.155 17569 290 1 1 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.246 1.726 17569 291 1 1 . 1 1 66 66 CYS H H 220 8.248 8.248 8.352 -0.104 17569 292 1 1 . 1 1 67 67 ARG N N 221 130.363 130.363 124.364 5.999 17569 293 1 1 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.428 -0.361 17569 294 1 1 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.211 -3.195 17569 295 1 1 . 1 1 67 67 ARG H H 221 9.145 9.145 8.573 0.572 17569 296 1 1 . 1 1 68 68 TRP N N 222 124.200 124.200 120.757 3.443 17569 297 1 1 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.747 -0.311 17569 298 1 1 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.265 0.815 17569 299 1 1 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.682 0.512 17569 300 1 1 . 1 1 68 68 TRP H H 222 9.689 9.689 8.223 1.466 17569 301 1 1 . 1 1 69 69 CYS N N 223 116.297 116.297 111.146 5.151 17569 302 1 1 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.111 -0.020 17569 303 1 1 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.182 2.920 17569 304 1 1 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.642 4.696 17569 305 1 1 . 1 1 69 69 CYS H H 223 8.822 8.822 7.715 1.107 17569 306 1 1 . 1 1 70 70 ALA N N 224 123.112 123.112 123.620 -0.508 17569 307 1 1 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.371 0.035 17569 308 1 1 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.553 -0.702 17569 309 1 1 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.788 -0.068 17569 310 1 1 . 1 1 70 70 ALA H H 224 8.787 8.787 8.332 0.455 17569 311 1 1 . 1 1 71 71 GLU N N 225 118.300 118.300 120.637 -2.337 17569 312 1 1 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.494 0.814 17569 313 1 1 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.698 -2.399 17569 314 1 1 . 1 1 71 71 GLU H H 225 8.541 8.541 8.243 0.298 17569 315 1 1 . 1 1 72 72 GLY N N 226 111.995 111.995 109.391 2.604 17569 316 1 1 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.924 -0.521 17569 317 1 1 . 1 1 72 72 GLY H H 226 9.837 9.837 8.490 1.347 17569 318 1 1 . 1 1 73 73 GLY N N 227 106.600 106.600 107.033 -0.433 17569 319 1 1 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.022 0.949 17569 320 1 1 . 1 1 73 73 GLY H H 227 7.772 7.772 8.408 -0.636 17569 321 1 1 . 1 1 74 74 ASN N N 228 124.277 124.277 119.982 4.295 17569 322 1 1 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.406 0.675 17569 323 1 1 . 1 1 74 74 ASN CA C 228 53.100 53.100 54.209 -1.109 17569 324 1 1 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.460 -0.376 17569 325 1 1 . 1 1 74 74 ASN H H 228 8.876 8.876 8.555 0.321 17569 326 1 1 . 1 1 75 75 LEU N N 229 123.050 123.050 123.302 -0.252 17569 327 1 1 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.925 -0.325 17569 328 1 1 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.271 1.091 17569 329 1 1 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.442 -0.942 17569 330 1 1 . 1 1 75 75 LEU H H 229 8.901 8.901 8.187 0.714 17569 331 1 1 . 1 1 76 76 ILE N N 230 123.552 123.552 124.368 -0.816 17569 332 1 1 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.064 0.421 17569 333 1 1 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.701 -1.001 17569 334 1 1 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.889 -0.490 17569 335 1 1 . 1 1 76 76 ILE H H 230 9.406 9.406 9.273 0.133 17569 336 1 1 . 1 1 77 77 CYS N N 231 124.637 124.637 126.511 -1.874 17569 337 1 1 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.426 -0.551 17569 338 1 1 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.818 0.541 17569 339 1 1 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.328 1.106 17569 340 1 1 . 1 1 77 77 CYS H H 231 8.809 8.809 8.554 0.255 17569 341 1 1 . 1 1 78 78 CYS N N 232 125.697 125.697 122.514 3.183 17569 342 1 1 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.816 -0.532 17569 343 1 1 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.590 4.294 17569 344 1 1 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.974 1.196 17569 345 1 1 . 1 1 78 78 CYS H H 232 8.579 8.579 8.831 -0.252 17569 346 1 1 . 1 1 79 79 ASP N N 233 123.600 123.600 125.471 -1.871 17569 347 1 1 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.780 -0.023 17569 348 1 1 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.485 2.504 17569 349 1 1 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.008 1.621 17569 350 1 1 . 1 1 79 79 ASP H H 233 8.577 8.577 8.214 0.363 17569 351 1 1 . 1 1 80 80 PHE N N 234 122.100 122.100 117.935 4.165 17569 352 1 1 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.646 -0.120 17569 353 1 1 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.636 1.273 17569 354 1 1 . 1 1 80 80 PHE CB C 234 41.849 41.849 39.681 2.168 17569 355 1 1 . 1 1 80 80 PHE H H 234 10.432 10.432 7.635 2.797 17569 356 1 1 . 1 1 81 81 CYS N N 235 124.300 124.300 117.794 6.506 17569 357 1 1 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.742 0.414 17569 358 1 1 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.211 -0.166 17569 359 1 1 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.883 3.524 17569 360 1 1 . 1 1 81 81 CYS H H 235 8.476 8.476 8.140 0.336 17569 361 1 1 . 1 1 82 82 HIS N N 236 112.598 112.598 119.573 -6.975 17569 362 1 1 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.155 0.828 17569 363 1 1 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.749 -1.351 17569 364 1 1 . 1 1 82 82 HIS CB C 236 30.257 30.257 28.166 2.091 17569 365 1 1 . 1 1 82 82 HIS H H 236 6.699 6.699 8.489 -1.790 17569 366 1 1 . 1 1 83 83 ASN N N 237 123.600 123.600 119.252 4.348 17569 367 1 1 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.885 -0.084 17569 368 1 1 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.985 2.631 17569 369 1 1 . 1 1 83 83 ASN H H 237 9.097 9.097 7.952 1.145 17569 370 1 1 . 1 1 84 84 ALA N N 238 122.000 122.000 124.216 -2.216 17569 371 1 1 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.274 0.135 17569 372 1 1 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.249 0.115 17569 373 1 1 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.140 2.930 17569 374 1 1 . 1 1 84 84 ALA H H 238 9.885 9.885 8.470 1.415 17569 375 1 1 . 1 1 85 85 PHE N N 239 116.707 116.707 121.687 -4.980 17569 376 1 1 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.159 0.869 17569 377 1 1 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.593 -0.376 17569 378 1 1 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.760 1.904 17569 379 1 1 . 1 1 85 85 PHE H H 239 9.450 9.450 9.237 0.213 17569 380 1 1 . 1 1 86 86 CYS N N 240 126.682 126.682 124.547 2.135 17569 381 1 1 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.804 0.818 17569 382 1 1 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.871 -0.529 17569 383 1 1 . 1 1 86 86 CYS CB C 240 32.257 32.257 28.970 3.287 17569 384 1 1 . 1 1 86 86 CYS H H 240 11.309 11.309 9.492 1.817 17569 385 1 1 . 1 1 87 87 LYS N N 241 117.865 117.865 124.149 -6.284 17569 386 1 1 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.912 -0.063 17569 387 1 1 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.248 -0.178 17569 388 1 1 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.514 0.284 17569 389 1 1 . 1 1 87 87 LYS H H 241 8.230 8.230 8.837 -0.607 17569 390 1 1 . 1 1 88 88 LYS N N 242 117.949 117.949 118.254 -0.305 17569 391 1 1 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.124 -0.146 17569 392 1 1 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.910 1.460 17569 393 1 1 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.958 0.358 17569 394 1 1 . 1 1 88 88 LYS H H 242 7.945 7.945 8.452 -0.507 17569 395 1 1 . 1 1 89 89 CYS N N 243 125.305 125.305 117.719 7.586 17569 396 1 1 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.261 -0.519 17569 397 1 1 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.653 2.175 17569 398 1 1 . 1 1 89 89 CYS CB C 243 28.241 28.241 26.984 1.257 17569 399 1 1 . 1 1 89 89 CYS H H 243 9.297 9.297 7.645 1.652 17569 400 1 1 . 1 1 90 90 ILE N N 244 119.687 119.687 121.255 -1.568 17569 401 1 1 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.909 -0.302 17569 402 1 1 . 1 1 90 90 ILE CA C 244 65.950 65.950 66.020 -0.070 17569 403 1 1 . 1 1 90 90 ILE H H 244 7.997 7.997 7.658 0.339 17569 404 1 1 . 1 1 91 91 LEU N N 245 120.280 120.280 121.235 -0.955 17569 405 1 1 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.434 -0.749 17569 406 1 1 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.634 0.601 17569 407 1 1 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.904 0.054 17569 408 1 1 . 1 1 91 91 LEU H H 245 8.810 8.810 8.677 0.133 17569 409 1 1 . 1 1 92 92 ARG N N 246 116.901 116.901 117.690 -0.789 17569 410 1 1 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.161 -0.344 17569 411 1 1 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.035 0.945 17569 412 1 1 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.045 0.555 17569 413 1 1 . 1 1 92 92 ARG H H 246 8.086 8.086 7.639 0.447 17569 414 1 1 . 1 1 93 93 ASN N N 247 111.200 111.200 116.269 -5.069 17569 415 1 1 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.563 0.040 17569 416 1 1 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.565 1.243 17569 417 1 1 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.150 3.334 17569 418 1 1 . 1 1 93 93 ASN H H 247 7.136 7.136 8.313 -1.177 17569 419 1 1 . 1 1 94 94 LEU N N 248 118.807 118.807 117.399 1.408 17569 420 1 1 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.395 0.419 17569 421 1 1 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.340 -0.151 17569 422 1 1 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.713 -0.015 17569 423 1 1 . 1 1 94 94 LEU H H 248 8.515 8.515 7.984 0.531 17569 424 1 1 . 1 1 95 95 GLY N N 249 108.000 108.000 106.444 1.556 17569 425 1 1 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.620 0.008 17569 426 1 1 . 1 1 95 95 GLY H H 249 7.955 7.955 7.596 0.359 17569 427 1 1 . 1 1 96 96 ARG N N 250 117.797 117.797 120.971 -3.174 17569 428 1 1 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.340 -0.497 17569 429 1 1 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.115 0.567 17569 430 1 1 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.339 -0.479 17569 431 1 1 . 1 1 96 96 ARG H H 250 8.559 8.559 8.698 -0.139 17569 432 1 1 . 1 1 97 97 LYS N N 251 120.900 120.900 119.139 1.761 17569 433 1 1 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.028 0.128 17569 434 1 1 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.832 -0.676 17569 435 1 1 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.695 -0.335 17569 436 1 1 . 1 1 97 97 LYS H H 251 8.655 8.655 8.591 0.064 17569 437 1 1 . 1 1 98 98 GLU N N 252 122.000 122.000 118.973 3.027 17569 438 1 1 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.102 0.249 17569 439 1 1 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.428 -0.846 17569 440 1 1 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.171 -0.771 17569 441 1 1 . 1 1 98 98 GLU H H 252 7.705 7.705 8.363 -0.658 17569 442 1 1 . 1 1 99 99 LEU N N 253 117.400 117.400 120.758 -3.358 17569 443 1 1 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.818 0.099 17569 444 1 1 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.225 -0.227 17569 445 1 1 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.803 -0.321 17569 446 1 1 . 1 1 99 99 LEU H H 253 7.285 7.285 7.676 -0.391 17569 447 1 1 . 1 1 100 100 SER N N 254 112.100 112.100 114.220 -2.120 17569 448 1 1 . 1 1 100 100 SER HA H 254 4.107 4.107 4.159 -0.052 17569 449 1 1 . 1 1 100 100 SER CA C 254 61.603 61.603 61.924 -0.321 17569 450 1 1 . 1 1 100 100 SER CB C 254 62.622 62.622 63.153 -0.531 17569 451 1 1 . 1 1 100 100 SER H H 254 8.326 8.326 8.299 0.027 17569 452 1 1 . 1 1 101 101 THR N N 255 118.151 118.151 118.615 -0.464 17569 453 1 1 . 1 1 101 101 THR HA H 255 4.026 4.026 4.036 -0.010 17569 454 1 1 . 1 1 101 101 THR CA C 255 66.261 66.261 67.069 -0.807 17569 455 1 1 . 1 1 101 101 THR CB C 255 68.735 68.735 68.836 -0.101 17569 456 1 1 . 1 1 101 101 THR H H 255 7.972 7.972 7.902 0.070 17569 457 1 1 . 1 1 102 102 ILE N N 256 120.100 120.100 123.404 -3.304 17569 458 1 1 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.952 -0.489 17569 459 1 1 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.720 0.054 17569 460 1 1 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.615 0.126 17569 461 1 1 . 1 1 102 102 ILE H H 256 7.868 7.868 8.573 -0.705 17569 462 1 1 . 1 1 103 103 MET N N 257 114.876 114.876 117.008 -2.132 17569 463 1 1 . 1 1 103 103 MET HA H 257 4.211 4.211 4.054 0.157 17569 464 1 1 . 1 1 103 103 MET CA C 257 55.691 55.691 58.378 -2.687 17569 465 1 1 . 1 1 103 103 MET CB C 257 32.000 32.000 32.899 -0.899 17569 466 1 1 . 1 1 103 103 MET H H 257 7.606 7.606 7.366 0.240 17569 467 1 1 . 1 1 104 104 ASP N N 258 119.976 119.976 119.149 0.827 17569 468 1 1 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.782 -0.244 17569 469 1 1 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.597 1.315 17569 470 1 1 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.114 1.386 17569 471 1 1 . 1 1 104 104 ASP H H 258 7.444 7.444 7.613 -0.169 17569 472 1 1 . 1 1 105 105 GLU N N 259 124.388 124.388 121.914 2.474 17569 473 1 1 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.499 -0.212 17569 474 1 1 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.088 2.483 17569 475 1 1 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.661 -0.119 17569 476 1 1 . 1 1 105 105 GLU H H 259 8.559 8.559 8.167 0.392 17569 477 1 1 . 1 1 106 106 ASN N N 260 117.201 117.201 118.879 -1.678 17569 478 1 1 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.434 0.307 17569 479 1 1 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.295 -0.552 17569 480 1 1 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.445 1.473 17569 481 1 1 . 1 1 106 106 ASN H H 260 8.673 8.673 8.160 0.513 17569 482 1 1 . 1 1 107 107 ASN N N 261 117.900 117.900 111.834 6.066 17569 483 1 1 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.286 0.699 17569 484 1 1 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.642 -2.340 17569 485 1 1 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.507 3.107 17569 486 1 1 . 1 1 107 107 ASN H H 261 7.956 7.956 8.743 -0.787 17569 487 1 1 . 1 1 108 108 GLN N N 262 121.500 121.500 115.250 6.250 17569 488 1 1 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.036 0.572 17569 489 1 1 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.742 1.034 17569 490 1 1 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.815 0.743 17569 491 1 1 . 1 1 108 108 GLN H H 262 8.493 8.493 7.722 0.771 17569 492 1 1 . 1 1 109 109 TRP N N 263 128.056 128.056 123.140 4.916 17569 493 1 1 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.882 0.089 17569 494 1 1 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.538 0.559 17569 495 1 1 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.947 0.546 17569 496 1 1 . 1 1 109 109 TRP H H 263 10.497 10.497 7.964 2.533 17569 497 1 1 . 1 1 110 110 TYR N N 264 126.600 126.600 126.302 0.298 17569 498 1 1 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.398 0.004 17569 499 1 1 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.304 -2.633 17569 500 1 1 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.424 -1.416 17569 501 1 1 . 1 1 110 110 TYR H H 264 7.545 7.545 8.013 -0.468 17569 502 1 1 . 1 1 111 111 CYS N N 265 124.622 124.622 114.554 10.068 17569 503 1 1 . 1 1 111 111 CYS H H 265 8.586 8.586 8.390 0.196 17569 504 1 1 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.825 -0.633 17569 505 1 1 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.784 0.931 17569 506 1 1 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.714 1.206 17569 507 1 1 . 1 1 113 113 ILE N N 267 119.504 119.504 119.748 -0.244 17569 508 1 1 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.548 -0.598 17569 509 1 1 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.956 0.293 17569 510 1 1 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.586 -3.053 17569 511 1 1 . 1 1 113 113 ILE H H 267 9.160 9.160 7.505 1.655 17569 512 1 1 . 1 1 114 114 CYS N N 268 124.100 124.100 118.388 5.712 17569 513 1 1 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.179 -0.365 17569 514 1 1 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.689 3.611 17569 515 1 1 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.100 2.621 17569 516 1 1 . 1 1 114 114 CYS H H 268 7.818 7.818 8.255 -0.437 17569 517 1 1 . 1 1 115 115 HIS N N 269 117.127 117.127 111.422 5.705 17569 518 1 1 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.658 0.471 17569 519 1 1 . 1 1 115 115 HIS CA C 269 52.161 52.161 52.976 -0.815 17569 520 1 1 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.872 2.320 17569 521 1 1 . 1 1 115 115 HIS H H 269 8.953 8.953 7.798 1.155 17569 522 1 1 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.448 0.494 17569 523 1 1 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.445 -0.137 17569 524 1 1 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.864 0.778 17569 525 1 1 . 1 1 117 117 GLU N N 271 123.504 123.504 123.643 -0.139 17569 526 1 1 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.430 -0.410 17569 527 1 1 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.503 4.366 17569 528 1 1 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.166 -2.115 17569 529 1 1 . 1 1 117 117 GLU H H 271 8.402 8.402 8.261 0.141 17569 530 1 1 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.577 -0.035 17569 531 1 1 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.663 1.696 17569 532 1 1 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.347 0.795 17569 533 1 1 . 1 1 119 119 LEU N N 273 112.296 112.296 114.099 -1.803 17569 534 1 1 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.947 -0.473 17569 535 1 1 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.536 0.006 17569 536 1 1 . 1 1 119 119 LEU H H 273 8.090 8.090 7.425 0.665 17569 537 1 1 . 1 1 120 120 LEU N N 274 121.388 121.388 124.033 -2.645 17569 538 1 1 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.940 0.087 17569 539 1 1 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.866 -0.565 17569 540 1 1 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.305 0.795 17569 541 1 1 . 1 1 120 120 LEU H H 274 7.823 7.823 8.432 -0.609 17569 542 1 1 . 1 1 121 121 ASP N N 275 118.600 118.600 119.747 -1.147 17569 543 1 1 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.445 0.096 17569 544 1 1 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.164 0.539 17569 545 1 1 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.470 -1.027 17569 546 1 1 . 1 1 121 121 ASP H H 275 8.694 8.694 8.405 0.289 17569 547 1 1 . 1 1 122 122 LEU N N 276 123.192 123.192 119.864 3.328 17569 548 1 1 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.954 0.438 17569 549 1 1 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.901 0.070 17569 550 1 1 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.015 0.527 17569 551 1 1 . 1 1 122 122 LEU H H 276 8.013 8.013 7.911 0.102 17569 552 1 1 . 1 1 123 123 VAL N N 277 126.898 126.898 119.052 7.846 17569 553 1 1 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.724 0.131 17569 554 1 1 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.931 -0.268 17569 555 1 1 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.571 0.487 17569 556 1 1 . 1 1 123 123 VAL H H 277 8.781 8.781 8.059 0.722 17569 557 1 1 . 1 1 124 124 THR N N 278 117.500 117.500 116.782 0.718 17569 558 1 1 . 1 1 124 124 THR HA H 278 4.030 4.030 3.897 0.133 17569 559 1 1 . 1 1 124 124 THR CA C 278 66.589 66.589 67.387 -0.798 17569 560 1 1 . 1 1 124 124 THR CB C 278 68.410 68.410 68.535 -0.125 17569 561 1 1 . 1 1 124 124 THR H H 278 8.722 8.722 8.364 0.358 17569 562 1 1 . 1 1 125 125 ALA N N 279 124.700 124.700 123.923 0.777 17569 563 1 1 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.117 0.144 17569 564 1 1 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.008 0.288 17569 565 1 1 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.041 -0.092 17569 566 1 1 . 1 1 125 125 ALA H H 279 8.239 8.239 8.033 0.206 17569 567 1 1 . 1 1 126 126 CYS N N 280 119.276 119.276 117.720 1.556 17569 568 1 1 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.926 0.188 17569 569 1 1 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.830 -1.727 17569 570 1 1 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.970 -1.474 17569 571 1 1 . 1 1 126 126 CYS H H 280 8.128 8.128 7.783 0.345 17569 572 1 1 . 1 1 127 127 ASN N N 281 118.000 118.000 118.141 -0.141 17569 573 1 1 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.540 0.020 17569 574 1 1 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.788 -0.650 17569 575 1 1 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.091 -1.126 17569 576 1 1 . 1 1 127 127 ASN H H 281 8.725 8.725 7.992 0.733 17569 577 1 1 . 1 1 128 128 SER N N 282 116.601 116.601 116.628 -0.027 17569 578 1 1 . 1 1 128 128 SER HA H 282 4.363 4.363 4.221 0.142 17569 579 1 1 . 1 1 128 128 SER CA C 282 61.899 61.899 61.399 0.500 17569 580 1 1 . 1 1 128 128 SER CB C 282 62.630 62.630 63.084 -0.454 17569 581 1 1 . 1 1 128 128 SER H H 282 8.542 8.542 7.812 0.730 17569 582 1 1 . 1 1 129 129 VAL N N 283 123.272 123.272 122.075 1.197 17569 583 1 1 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.556 0.121 17569 584 1 1 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.554 -0.046 17569 585 1 1 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.403 -0.185 17569 586 1 1 . 1 1 129 129 VAL H H 283 7.990 7.990 8.262 -0.272 17569 587 1 1 . 1 1 130 130 PHE N N 284 118.594 118.594 119.291 -0.697 17569 588 1 1 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.267 -0.254 17569 589 1 1 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.322 2.178 17569 590 1 1 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.646 0.350 17569 591 1 1 . 1 1 130 130 PHE H H 284 8.190 8.190 8.556 -0.366 17569 592 1 1 . 1 1 131 131 GLU N N 285 120.905 120.905 120.215 0.690 17569 593 1 1 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.969 0.236 17569 594 1 1 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.115 -0.901 17569 595 1 1 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.475 0.025 17569 596 1 1 . 1 1 131 131 GLU H H 285 8.699 8.699 8.910 -0.211 17569 597 1 1 . 1 1 132 132 ASN N N 286 117.997 117.997 118.432 -0.435 17569 598 1 1 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.635 -0.040 17569 599 1 1 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.378 -0.763 17569 600 1 1 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.578 0.274 17569 601 1 1 . 1 1 132 132 ASN H H 286 8.082 8.082 8.022 0.060 17569 602 1 1 . 1 1 133 133 LEU N N 287 120.800 120.800 122.198 -1.398 17569 603 1 1 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.299 -0.182 17569 604 1 1 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.470 -0.672 17569 605 1 1 . 1 1 133 133 LEU H H 287 7.904 7.904 8.388 -0.484 17569 606 1 1 . 1 1 134 134 GLU N N 288 118.200 118.200 118.566 -0.366 17569 607 1 1 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.932 0.147 17569 608 1 1 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.281 -1.284 17569 609 1 1 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.102 0.140 17569 610 1 1 . 1 1 134 134 GLU H H 288 8.157 8.157 8.423 -0.266 17569 611 1 1 . 1 1 135 135 GLN N N 289 117.400 117.400 118.351 -0.951 17569 612 1 1 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.120 0.054 17569 613 1 1 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.221 -0.232 17569 614 1 1 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.456 -0.376 17569 615 1 1 . 1 1 135 135 GLN H H 289 7.869 7.869 7.733 0.136 17569 616 1 1 . 1 1 136 136 LEU N N 290 121.000 121.000 121.896 -0.896 17569 617 1 1 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.803 0.370 17569 618 1 1 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.788 -0.650 17569 619 1 1 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.742 0.258 17569 620 1 1 . 1 1 136 136 LEU H H 290 7.968 7.968 7.805 0.163 17569 621 1 1 . 1 1 137 137 LEU N N 291 118.900 118.900 117.395 1.505 17569 622 1 1 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.051 0.190 17569 623 1 1 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.242 -0.882 17569 624 1 1 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.148 -0.676 17569 625 1 1 . 1 1 137 137 LEU H H 291 8.154 8.154 7.636 0.518 17569 626 1 1 . 1 1 138 138 GLN N N 292 117.993 117.993 115.926 2.067 17569 627 1 1 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.480 -0.208 17569 628 1 1 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.753 1.879 17569 629 1 1 . 1 1 138 138 GLN CB C 292 28.584 28.584 28.792 -0.208 17569 630 1 1 . 1 1 138 138 GLN H H 292 7.896 7.896 7.558 0.338 17569 631 1 1 . 1 1 139 139 GLN N N 293 118.889 118.889 120.106 -1.217 17569 632 1 1 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.395 -0.126 17569 633 1 1 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.704 0.750 17569 634 1 1 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.740 -0.671 17569 635 1 1 . 1 1 139 139 GLN H H 293 8.091 8.091 7.353 0.738 17569 636 1 1 . 1 1 140 140 ASN N N 294 118.604 118.604 121.741 -3.137 17569 637 1 1 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.827 -0.068 17569 638 1 1 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.791 0.430 17569 639 1 1 . 1 1 140 140 ASN CB C 294 38.733 38.733 38.624 0.109 17569 640 1 1 . 1 1 140 140 ASN H H 294 8.273 8.273 8.607 -0.334 17569 641 1 1 . 1 1 141 141 LYS N N 295 121.685 121.685 121.339 0.346 17569 642 1 1 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.579 -0.219 17569 643 1 1 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.802 0.371 17569 644 1 1 . 1 1 141 141 LYS CB C 295 32.535 32.535 32.209 0.326 17569 645 1 1 . 1 1 141 141 LYS H H 295 8.089 8.089 7.894 0.195 17569 646 1 2 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.913 -0.526 17569 647 1 2 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.122 0.323 17569 648 1 2 . 1 1 2 2 ALA CB C 156 19.256 19.256 18.816 0.440 17569 649 1 2 . 1 1 3 3 MET HA H 157 4.476 4.476 4.842 -0.366 17569 650 1 2 . 1 1 3 3 MET CA C 157 55.401 55.401 54.976 0.425 17569 651 1 2 . 1 1 4 4 ALA N N 158 124.828 124.828 124.025 0.803 17569 652 1 2 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.750 -0.436 17569 653 1 2 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.916 0.595 17569 654 1 2 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.013 -1.012 17569 655 1 2 . 1 1 4 4 ALA H H 158 8.382 8.382 8.386 -0.004 17569 656 1 2 . 1 1 5 5 ASP N N 159 119.418 119.418 120.829 -1.411 17569 657 1 2 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.889 -0.299 17569 658 1 2 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.647 0.489 17569 659 1 2 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.486 -1.471 17569 660 1 2 . 1 1 5 5 ASP H H 159 8.312 8.312 8.226 0.086 17569 661 1 2 . 1 1 6 6 LYS N N 160 121.604 121.604 120.361 1.243 17569 662 1 2 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.658 -0.315 17569 663 1 2 . 1 1 6 6 LYS H H 160 8.274 8.274 8.332 -0.058 17569 664 1 2 . 1 1 7 7 ARG N N 161 121.611 121.611 121.541 0.070 17569 665 1 2 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.452 -0.125 17569 666 1 2 . 1 1 7 7 ARG H H 161 8.430 8.430 8.672 -0.242 17569 667 1 2 . 1 1 8 8 GLY N N 162 109.606 109.606 111.515 -1.909 17569 668 1 2 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.782 0.265 17569 669 1 2 . 1 1 8 8 GLY H H 162 8.473 8.473 8.658 -0.185 17569 670 1 2 . 1 1 9 9 ASP N N 163 120.187 120.187 120.801 -0.614 17569 671 1 2 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.814 -0.165 17569 672 1 2 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.654 0.497 17569 673 1 2 . 1 1 9 9 ASP H H 163 8.296 8.296 8.225 0.071 17569 674 1 2 . 1 1 10 10 GLY N N 164 108.816 108.816 109.580 -0.764 17569 675 1 2 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.340 0.027 17569 676 1 2 . 1 1 10 10 GLY H H 164 8.458 8.458 8.526 -0.068 17569 677 1 2 . 1 1 11 11 LEU N N 165 121.195 121.195 121.235 -0.040 17569 678 1 2 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.867 -0.551 17569 679 1 2 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.176 0.824 17569 680 1 2 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.473 -2.541 17569 681 1 2 . 1 1 11 11 LEU H H 165 8.137 8.137 7.873 0.264 17569 682 1 2 . 1 1 12 12 HIS N N 166 119.387 119.387 119.054 0.333 17569 683 1 2 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.872 -0.217 17569 684 1 2 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.784 0.485 17569 685 1 2 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.658 -0.961 17569 686 1 2 . 1 1 12 12 HIS H H 166 8.270 8.270 8.507 -0.237 17569 687 1 2 . 1 1 13 13 GLY N N 167 109.899 109.899 112.167 -2.268 17569 688 1 2 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.180 0.925 17569 689 1 2 . 1 1 13 13 GLY H H 167 8.276 8.276 8.472 -0.196 17569 690 1 2 . 1 1 14 14 ILE N N 168 119.597 119.597 121.175 -1.578 17569 691 1 2 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.132 0.191 17569 692 1 2 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.032 0.568 17569 693 1 2 . 1 1 14 14 ILE CB C 168 38.950 38.950 39.909 -0.959 17569 694 1 2 . 1 1 14 14 ILE H H 168 7.962 7.962 8.153 -0.191 17569 695 1 2 . 1 1 15 15 VAL N N 169 127.578 127.578 128.866 -1.288 17569 696 1 2 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.048 0.232 17569 697 1 2 . 1 1 15 15 VAL CA C 169 61.317 61.317 61.813 -0.496 17569 698 1 2 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.135 2.267 17569 699 1 2 . 1 1 15 15 VAL H H 169 9.011 9.011 8.487 0.524 17569 700 1 2 . 1 1 16 16 SER N N 170 118.596 118.596 120.090 -1.494 17569 701 1 2 . 1 1 16 16 SER HA H 170 5.140 5.140 4.809 0.331 17569 702 1 2 . 1 1 16 16 SER CA C 170 55.985 55.985 56.055 -0.070 17569 703 1 2 . 1 1 16 16 SER CB C 170 65.261 65.261 65.563 -0.302 17569 704 1 2 . 1 1 16 16 SER H H 170 8.242 8.242 7.850 0.392 17569 705 1 2 . 1 1 17 17 CYS N N 171 123.783 123.783 123.120 0.663 17569 706 1 2 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.152 0.029 17569 707 1 2 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.860 -1.016 17569 708 1 2 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.623 2.750 17569 709 1 2 . 1 1 17 17 CYS H H 171 8.894 8.894 8.518 0.376 17569 710 1 2 . 1 1 18 18 THR N N 172 121.703 121.703 117.632 4.071 17569 711 1 2 . 1 1 18 18 THR HA H 172 4.386 4.386 4.116 0.270 17569 712 1 2 . 1 1 18 18 THR CA C 172 64.667 64.667 64.242 0.425 17569 713 1 2 . 1 1 18 18 THR CB C 172 69.498 69.498 68.859 0.639 17569 714 1 2 . 1 1 18 18 THR H H 172 8.788 8.788 8.215 0.573 17569 715 1 2 . 1 1 19 19 ALA N N 173 131.364 131.364 121.506 9.858 17569 716 1 2 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.100 0.396 17569 717 1 2 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.521 0.504 17569 718 1 2 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.629 3.553 17569 719 1 2 . 1 1 19 19 ALA H H 173 9.680 9.680 8.078 1.602 17569 720 1 2 . 1 1 20 20 CYS N N 174 115.498 115.498 114.717 0.781 17569 721 1 2 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.698 0.270 17569 722 1 2 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.071 -0.976 17569 723 1 2 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.981 4.263 17569 724 1 2 . 1 1 20 20 CYS H H 174 8.470 8.470 7.644 0.826 17569 725 1 2 . 1 1 21 21 GLY N N 175 112.464 112.464 108.834 3.630 17569 726 1 2 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.067 0.639 17569 727 1 2 . 1 1 21 21 GLY H H 175 7.884 7.884 7.985 -0.101 17569 728 1 2 . 1 1 22 22 GLN N N 176 121.784 121.784 118.055 3.729 17569 729 1 2 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.460 -0.084 17569 730 1 2 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.505 1.786 17569 731 1 2 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.984 -2.643 17569 732 1 2 . 1 1 22 22 GLN H H 176 8.723 8.723 7.813 0.910 17569 733 1 2 . 1 1 23 23 GLN N N 177 122.900 122.900 124.134 -1.234 17569 734 1 2 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.150 0.380 17569 735 1 2 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.753 -0.203 17569 736 1 2 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.370 -0.910 17569 737 1 2 . 1 1 23 23 GLN H H 177 8.721 8.721 8.635 0.086 17569 738 1 2 . 1 1 24 24 VAL N N 178 121.000 121.000 125.803 -4.803 17569 739 1 2 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.883 0.641 17569 740 1 2 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.428 -2.551 17569 741 1 2 . 1 1 24 24 VAL H H 178 8.689 8.689 8.041 0.648 17569 742 1 2 . 1 1 25 25 ASN N N 179 121.392 121.392 122.672 -1.280 17569 743 1 2 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.318 0.558 17569 744 1 2 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.118 -1.969 17569 745 1 2 . 1 1 25 25 ASN CB C 179 37.977 37.977 37.512 0.465 17569 746 1 2 . 1 1 25 25 ASN H H 179 8.635 8.635 8.203 0.432 17569 747 1 2 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.079 0.381 17569 748 1 2 . 1 1 27 27 PHE CA C 181 56.998 56.998 59.057 -2.059 17569 749 1 2 . 1 1 27 27 PHE CB C 181 38.393 38.393 38.343 0.050 17569 750 1 2 . 1 1 28 28 GLN N N 182 119.300 119.300 122.776 -3.476 17569 751 1 2 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.586 -0.068 17569 752 1 2 . 1 1 28 28 GLN CA C 182 54.342 54.342 54.824 -0.482 17569 753 1 2 . 1 1 28 28 GLN CB C 182 30.350 30.350 32.076 -1.726 17569 754 1 2 . 1 1 28 28 GLN H H 182 7.494 7.494 8.081 -0.587 17569 755 1 2 . 1 1 29 29 LYS N N 183 124.516 124.516 123.607 0.909 17569 756 1 2 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.416 -0.494 17569 757 1 2 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.330 1.982 17569 758 1 2 . 1 1 29 29 LYS CB C 183 32.286 32.286 33.198 -0.912 17569 759 1 2 . 1 1 29 29 LYS H H 183 8.779 8.779 8.643 0.136 17569 760 1 2 . 1 1 30 30 ASP N N 184 116.500 116.500 120.294 -3.794 17569 761 1 2 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.438 0.021 17569 762 1 2 . 1 1 30 30 ASP CA C 184 54.536 54.536 55.584 -1.048 17569 763 1 2 . 1 1 30 30 ASP CB C 184 39.971 39.971 39.864 0.107 17569 764 1 2 . 1 1 30 30 ASP H H 184 8.556 8.556 8.872 -0.316 17569 765 1 2 . 1 1 31 31 SER N N 185 111.505 111.505 112.508 -1.003 17569 766 1 2 . 1 1 31 31 SER HA H 185 4.695 4.695 4.712 -0.017 17569 767 1 2 . 1 1 31 31 SER CA C 185 59.747 59.747 57.549 2.198 17569 768 1 2 . 1 1 31 31 SER CB C 185 65.198 65.198 63.732 1.466 17569 769 1 2 . 1 1 31 31 SER H H 185 7.933 7.933 8.423 -0.490 17569 770 1 2 . 1 1 32 32 ILE N N 186 113.394 113.394 115.955 -2.561 17569 771 1 2 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.916 -0.030 17569 772 1 2 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.279 -0.700 17569 773 1 2 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.521 1.291 17569 774 1 2 . 1 1 32 32 ILE H H 186 7.105 7.105 7.568 -0.463 17569 775 1 2 . 1 1 33 33 TYR N N 187 119.098 119.098 120.554 -1.456 17569 776 1 2 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.214 -0.691 17569 777 1 2 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.109 1.151 17569 778 1 2 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.232 2.208 17569 779 1 2 . 1 1 33 33 TYR H H 187 8.954 8.954 7.669 1.285 17569 780 1 2 . 1 1 34 34 ARG N N 188 118.502 118.502 123.665 -5.163 17569 781 1 2 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.708 -0.071 17569 782 1 2 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.324 -1.572 17569 783 1 2 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.400 0.851 17569 784 1 2 . 1 1 34 34 ARG H H 188 8.412 8.412 8.698 -0.286 17569 785 1 2 . 1 1 35 35 HIS N N 189 126.596 126.596 128.783 -2.187 17569 786 1 2 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.889 -0.297 17569 787 1 2 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.943 -0.222 17569 788 1 2 . 1 1 35 35 HIS CB C 189 32.472 32.472 30.983 1.489 17569 789 1 2 . 1 1 35 35 HIS H H 189 9.813 9.813 9.142 0.671 17569 790 1 2 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.545 -0.247 17569 791 1 2 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.862 0.414 17569 792 1 2 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.194 0.657 17569 793 1 2 . 1 1 37 37 SER N N 191 110.003 110.003 113.438 -3.435 17569 794 1 2 . 1 1 37 37 SER HA H 191 4.918 4.918 4.322 0.596 17569 795 1 2 . 1 1 37 37 SER CA C 191 59.031 59.031 61.354 -2.323 17569 796 1 2 . 1 1 37 37 SER CB C 191 65.104 65.104 63.349 1.755 17569 797 1 2 . 1 1 37 37 SER H H 191 8.934 8.934 8.627 0.307 17569 798 1 2 . 1 1 38 38 LEU N N 192 120.959 120.959 113.685 7.274 17569 799 1 2 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.978 -0.849 17569 800 1 2 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.158 1.988 17569 801 1 2 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.422 1.574 17569 802 1 2 . 1 1 38 38 LEU H H 192 8.649 8.649 6.992 1.657 17569 803 1 2 . 1 1 39 39 GLN N N 193 108.600 108.600 119.346 -10.746 17569 804 1 2 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.100 -0.195 17569 805 1 2 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.598 0.216 17569 806 1 2 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.184 -2.150 17569 807 1 2 . 1 1 39 39 GLN H H 193 8.465 8.465 7.882 0.583 17569 808 1 2 . 1 1 40 40 VAL N N 194 105.325 105.325 118.249 -12.924 17569 809 1 2 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.491 0.059 17569 810 1 2 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.661 -1.020 17569 811 1 2 . 1 1 40 40 VAL H H 194 6.256 6.256 7.869 -1.613 17569 812 1 2 . 1 1 41 41 LEU N N 195 123.100 123.100 122.511 0.589 17569 813 1 2 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.742 0.074 17569 814 1 2 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.544 3.638 17569 815 1 2 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.168 0.402 17569 816 1 2 . 1 1 41 41 LEU H H 195 9.154 9.154 8.547 0.607 17569 817 1 2 . 1 1 42 42 ILE N N 196 124.396 124.396 117.200 7.196 17569 818 1 2 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.859 1.493 17569 819 1 2 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.197 1.033 17569 820 1 2 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.875 1.395 17569 821 1 2 . 1 1 42 42 ILE H H 196 9.766 9.766 7.820 1.946 17569 822 1 2 . 1 1 43 43 CYS N N 197 121.500 121.500 114.842 6.658 17569 823 1 2 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.162 0.100 17569 824 1 2 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.091 0.612 17569 825 1 2 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.440 1.860 17569 826 1 2 . 1 1 43 43 CYS H H 197 9.882 9.882 8.255 1.627 17569 827 1 2 . 1 1 44 44 LYS N N 198 117.995 117.995 122.257 -4.262 17569 828 1 2 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.162 -0.173 17569 829 1 2 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.119 -0.459 17569 830 1 2 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.214 0.486 17569 831 1 2 . 1 1 44 44 LYS H H 198 8.089 8.089 8.637 -0.548 17569 832 1 2 . 1 1 45 45 ASN N N 199 119.200 119.200 117.130 2.070 17569 833 1 2 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.613 -0.099 17569 834 1 2 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.999 0.721 17569 835 1 2 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.192 -0.025 17569 836 1 2 . 1 1 45 45 ASN H H 199 8.356 8.356 8.618 -0.262 17569 837 1 2 . 1 1 46 46 CYS N N 200 126.600 126.600 119.289 7.311 17569 838 1 2 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.990 0.191 17569 839 1 2 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.318 2.178 17569 840 1 2 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.117 2.065 17569 841 1 2 . 1 1 46 46 CYS H H 200 9.189 9.189 7.790 1.399 17569 842 1 2 . 1 1 47 47 PHE N N 201 121.962 121.962 120.872 1.090 17569 843 1 2 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.092 -0.222 17569 844 1 2 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.167 2.102 17569 845 1 2 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.322 0.845 17569 846 1 2 . 1 1 47 47 PHE H H 201 8.826 8.826 8.548 0.278 17569 847 1 2 . 1 1 48 48 LYS N N 202 117.400 117.400 120.658 -3.258 17569 848 1 2 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.890 -0.192 17569 849 1 2 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.009 -1.057 17569 850 1 2 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.291 -0.749 17569 851 1 2 . 1 1 48 48 LYS H H 202 8.512 8.512 7.928 0.584 17569 852 1 2 . 1 1 49 49 TYR N N 203 120.400 120.400 120.492 -0.092 17569 853 1 2 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.225 0.189 17569 854 1 2 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.342 -0.570 17569 855 1 2 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.673 -0.227 17569 856 1 2 . 1 1 49 49 TYR H H 203 8.133 8.133 7.786 0.347 17569 857 1 2 . 1 1 50 50 TYR N N 204 121.783 121.783 118.260 3.523 17569 858 1 2 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.690 -1.195 17569 859 1 2 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.913 3.037 17569 860 1 2 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.571 0.921 17569 861 1 2 . 1 1 50 50 TYR H H 204 8.765 8.765 7.589 1.176 17569 862 1 2 . 1 1 51 51 MET N N 205 110.800 110.800 116.277 -5.477 17569 863 1 2 . 1 1 51 51 MET HA H 205 4.349 4.349 4.206 0.143 17569 864 1 2 . 1 1 51 51 MET CA C 205 53.505 53.505 56.811 -3.306 17569 865 1 2 . 1 1 51 51 MET CB C 205 30.384 30.384 33.334 -2.950 17569 866 1 2 . 1 1 51 51 MET H H 205 7.771 7.771 8.437 -0.666 17569 867 1 2 . 1 1 52 52 SER N N 206 116.800 116.800 113.230 3.570 17569 868 1 2 . 1 1 52 52 SER HA H 206 3.919 3.919 4.346 -0.427 17569 869 1 2 . 1 1 52 52 SER CA C 206 61.621 61.621 59.805 1.816 17569 870 1 2 . 1 1 52 52 SER CB C 206 62.611 62.611 64.099 -1.488 17569 871 1 2 . 1 1 52 52 SER H H 206 7.581 7.581 8.162 -0.581 17569 872 1 2 . 1 1 53 53 ASP N N 207 117.400 117.400 121.268 -3.868 17569 873 1 2 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.783 -0.211 17569 874 1 2 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.703 -0.604 17569 875 1 2 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.753 0.435 17569 876 1 2 . 1 1 53 53 ASP H H 207 7.085 7.085 8.158 -1.073 17569 877 1 2 . 1 1 54 54 ASP N N 208 119.405 119.405 122.403 -2.998 17569 878 1 2 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.973 -0.584 17569 879 1 2 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.528 0.372 17569 880 1 2 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.972 -1.623 17569 881 1 2 . 1 1 54 54 ASP H H 208 8.439 8.439 8.491 -0.052 17569 882 1 2 . 1 1 55 55 ILE N N 209 124.698 124.698 120.558 4.140 17569 883 1 2 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.364 -0.364 17569 884 1 2 . 1 1 55 55 ILE CA C 209 62.278 62.278 59.714 2.564 17569 885 1 2 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.314 0.977 17569 886 1 2 . 1 1 55 55 ILE H H 209 8.128 8.128 8.417 -0.289 17569 887 1 2 . 1 1 56 56 SER N N 210 126.703 126.703 119.898 6.805 17569 888 1 2 . 1 1 56 56 SER HA H 210 4.365 4.365 4.812 -0.447 17569 889 1 2 . 1 1 56 56 SER CA C 210 57.769 57.769 57.399 0.370 17569 890 1 2 . 1 1 56 56 SER CB C 210 64.991 64.991 65.545 -0.554 17569 891 1 2 . 1 1 56 56 SER H H 210 8.815 8.815 8.431 0.384 17569 892 1 2 . 1 1 57 57 ARG N N 211 116.885 116.885 119.000 -2.115 17569 893 1 2 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.684 0.358 17569 894 1 2 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.773 -1.373 17569 895 1 2 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.941 2.343 17569 896 1 2 . 1 1 57 57 ARG H H 211 8.365 8.365 8.498 -0.133 17569 897 1 2 . 1 1 58 58 ASP N N 212 121.982 121.982 120.406 1.576 17569 898 1 2 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.848 -0.233 17569 899 1 2 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.338 -1.116 17569 900 1 2 . 1 1 58 58 ASP CB C 212 41.502 41.502 44.444 -2.942 17569 901 1 2 . 1 1 58 58 ASP H H 212 8.706 8.706 8.258 0.448 17569 902 1 2 . 1 1 59 59 SER N N 213 114.164 114.164 115.360 -1.196 17569 903 1 2 . 1 1 59 59 SER HA H 213 4.212 4.212 4.043 0.169 17569 904 1 2 . 1 1 59 59 SER CA C 213 60.840 60.840 60.639 0.201 17569 905 1 2 . 1 1 59 59 SER CB C 213 62.714 62.714 62.634 0.080 17569 906 1 2 . 1 1 59 59 SER H H 213 8.687 8.687 8.723 -0.036 17569 907 1 2 . 1 1 60 60 ASP N N 214 120.899 120.899 122.815 -1.916 17569 908 1 2 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.804 0.021 17569 909 1 2 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.665 0.546 17569 910 1 2 . 1 1 60 60 ASP CB C 214 41.558 41.558 41.159 0.399 17569 911 1 2 . 1 1 60 60 ASP H H 214 8.193 8.193 8.285 -0.092 17569 912 1 2 . 1 1 61 61 GLY N N 215 108.300 108.300 107.931 0.369 17569 913 1 2 . 1 1 61 61 GLY CA C 215 45.397 45.397 46.108 -0.711 17569 914 1 2 . 1 1 61 61 GLY H H 215 8.234 8.234 8.330 -0.096 17569 915 1 2 . 1 1 62 62 MET N N 216 120.002 120.002 118.019 1.983 17569 916 1 2 . 1 1 62 62 MET HA H 216 4.972 4.972 4.547 0.425 17569 917 1 2 . 1 1 62 62 MET CA C 216 53.151 53.151 56.559 -3.408 17569 918 1 2 . 1 1 62 62 MET CB C 216 32.311 32.311 35.472 -3.161 17569 919 1 2 . 1 1 62 62 MET H H 216 8.376 8.376 7.471 0.905 17569 920 1 2 . 1 1 63 63 ASP N N 217 127.300 127.300 117.500 9.800 17569 921 1 2 . 1 1 63 63 ASP HA H 217 4.966 4.966 5.073 -0.107 17569 922 1 2 . 1 1 63 63 ASP CA C 217 55.569 55.569 54.493 1.076 17569 923 1 2 . 1 1 63 63 ASP H H 217 9.368 9.368 8.254 1.114 17569 924 1 2 . 1 1 64 64 GLU N N 218 114.400 114.400 125.833 -11.433 17569 925 1 2 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.528 -0.372 17569 926 1 2 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.685 0.165 17569 927 1 2 . 1 1 64 64 GLU H H 218 8.583 8.583 8.494 0.089 17569 928 1 2 . 1 1 65 65 GLN N N 219 115.500 115.500 117.310 -1.810 17569 929 1 2 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.476 -0.165 17569 930 1 2 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.335 0.011 17569 931 1 2 . 1 1 65 65 GLN H H 219 7.158 7.158 7.738 -0.580 17569 932 1 2 . 1 1 66 66 CYS N N 220 122.600 122.600 117.547 5.053 17569 933 1 2 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.177 -1.100 17569 934 1 2 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.545 0.984 17569 935 1 2 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.257 1.715 17569 936 1 2 . 1 1 66 66 CYS H H 220 8.248 8.248 8.345 -0.097 17569 937 1 2 . 1 1 67 67 ARG N N 221 130.363 130.363 124.038 6.325 17569 938 1 2 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.396 -0.329 17569 939 1 2 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.783 -2.767 17569 940 1 2 . 1 1 67 67 ARG H H 221 9.145 9.145 8.460 0.685 17569 941 1 2 . 1 1 68 68 TRP N N 222 124.200 124.200 120.395 3.805 17569 942 1 2 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.719 -0.283 17569 943 1 2 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.245 0.835 17569 944 1 2 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.636 0.558 17569 945 1 2 . 1 1 68 68 TRP H H 222 9.689 9.689 8.148 1.541 17569 946 1 2 . 1 1 69 69 CYS N N 223 116.297 116.297 110.763 5.534 17569 947 1 2 . 1 1 69 69 CYS HA H 223 5.091 5.091 4.984 0.107 17569 948 1 2 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.928 3.174 17569 949 1 2 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.390 4.948 17569 950 1 2 . 1 1 69 69 CYS H H 223 8.822 8.822 7.718 1.104 17569 951 1 2 . 1 1 70 70 ALA N N 224 123.112 123.112 123.877 -0.765 17569 952 1 2 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.271 0.135 17569 953 1 2 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.021 -0.170 17569 954 1 2 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.685 0.035 17569 955 1 2 . 1 1 70 70 ALA H H 224 8.787 8.787 8.148 0.639 17569 956 1 2 . 1 1 71 71 GLU N N 225 118.300 118.300 120.133 -1.833 17569 957 1 2 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.472 0.836 17569 958 1 2 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.777 -2.478 17569 959 1 2 . 1 1 71 71 GLU H H 225 8.541 8.541 8.102 0.439 17569 960 1 2 . 1 1 72 72 GLY N N 226 111.995 111.995 109.807 2.188 17569 961 1 2 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.003 -0.600 17569 962 1 2 . 1 1 72 72 GLY H H 226 9.837 9.837 8.471 1.366 17569 963 1 2 . 1 1 73 73 GLY N N 227 106.600 106.600 107.148 -0.548 17569 964 1 2 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.969 1.002 17569 965 1 2 . 1 1 73 73 GLY H H 227 7.772 7.772 8.329 -0.557 17569 966 1 2 . 1 1 74 74 ASN N N 228 124.277 124.277 119.158 5.119 17569 967 1 2 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.461 0.620 17569 968 1 2 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.883 -0.783 17569 969 1 2 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.421 -0.337 17569 970 1 2 . 1 1 74 74 ASN H H 228 8.876 8.876 8.521 0.355 17569 971 1 2 . 1 1 75 75 LEU N N 229 123.050 123.050 122.231 0.819 17569 972 1 2 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.886 -0.286 17569 973 1 2 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.384 0.978 17569 974 1 2 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.888 -0.388 17569 975 1 2 . 1 1 75 75 LEU H H 229 8.901 8.901 8.039 0.862 17569 976 1 2 . 1 1 76 76 ILE N N 230 123.552 123.552 122.538 1.014 17569 977 1 2 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.017 0.468 17569 978 1 2 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.486 -0.785 17569 979 1 2 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.406 -1.007 17569 980 1 2 . 1 1 76 76 ILE H H 230 9.406 9.406 9.173 0.233 17569 981 1 2 . 1 1 77 77 CYS N N 231 124.637 124.637 126.851 -2.214 17569 982 1 2 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.406 -0.531 17569 983 1 2 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.398 -0.039 17569 984 1 2 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.134 0.300 17569 985 1 2 . 1 1 77 77 CYS H H 231 8.809 8.809 8.461 0.348 17569 986 1 2 . 1 1 78 78 CYS N N 232 125.697 125.697 126.028 -0.331 17569 987 1 2 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.750 -0.466 17569 988 1 2 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.182 3.702 17569 989 1 2 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.942 1.228 17569 990 1 2 . 1 1 78 78 CYS H H 232 8.579 8.579 8.883 -0.304 17569 991 1 2 . 1 1 79 79 ASP N N 233 123.600 123.600 126.972 -3.372 17569 992 1 2 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.578 0.179 17569 993 1 2 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.346 2.643 17569 994 1 2 . 1 1 79 79 ASP CB C 233 41.629 41.629 39.877 1.752 17569 995 1 2 . 1 1 79 79 ASP H H 233 8.577 8.577 8.080 0.497 17569 996 1 2 . 1 1 80 80 PHE N N 234 122.100 122.100 116.882 5.218 17569 997 1 2 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.618 -0.092 17569 998 1 2 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.301 1.608 17569 999 1 2 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.241 1.608 17569 1000 1 2 . 1 1 80 80 PHE H H 234 10.432 10.432 7.200 3.232 17569 1001 1 2 . 1 1 81 81 CYS N N 235 124.300 124.300 117.259 7.041 17569 1002 1 2 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.758 0.398 17569 1003 1 2 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.109 -0.064 17569 1004 1 2 . 1 1 81 81 CYS CB C 235 31.407 31.407 26.625 4.782 17569 1005 1 2 . 1 1 81 81 CYS H H 235 8.476 8.476 7.935 0.541 17569 1006 1 2 . 1 1 82 82 HIS N N 236 112.598 112.598 118.730 -6.132 17569 1007 1 2 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.184 0.799 17569 1008 1 2 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.359 -1.961 17569 1009 1 2 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.418 2.839 17569 1010 1 2 . 1 1 82 82 HIS H H 236 6.699 6.699 8.014 -1.315 17569 1011 1 2 . 1 1 83 83 ASN N N 237 123.600 123.600 118.496 5.104 17569 1012 1 2 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.916 -0.115 17569 1013 1 2 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.006 2.610 17569 1014 1 2 . 1 1 83 83 ASN H H 237 9.097 9.097 7.949 1.149 17569 1015 1 2 . 1 1 84 84 ALA N N 238 122.000 122.000 124.434 -2.434 17569 1016 1 2 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.372 0.037 17569 1017 1 2 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.006 0.358 17569 1018 1 2 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.307 2.763 17569 1019 1 2 . 1 1 84 84 ALA H H 238 9.885 9.885 8.474 1.411 17569 1020 1 2 . 1 1 85 85 PHE N N 239 116.707 116.707 121.059 -4.352 17569 1021 1 2 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.121 0.907 17569 1022 1 2 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.718 -0.500 17569 1023 1 2 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.048 1.615 17569 1024 1 2 . 1 1 85 85 PHE H H 239 9.450 9.450 9.252 0.198 17569 1025 1 2 . 1 1 86 86 CYS N N 240 126.682 126.682 124.875 1.807 17569 1026 1 2 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.809 0.813 17569 1027 1 2 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.832 -0.490 17569 1028 1 2 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.217 3.040 17569 1029 1 2 . 1 1 86 86 CYS H H 240 11.309 11.309 9.416 1.893 17569 1030 1 2 . 1 1 87 87 LYS N N 241 117.865 117.865 124.190 -6.325 17569 1031 1 2 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.929 -0.080 17569 1032 1 2 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.146 -0.076 17569 1033 1 2 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.480 0.319 17569 1034 1 2 . 1 1 87 87 LYS H H 241 8.230 8.230 8.771 -0.541 17569 1035 1 2 . 1 1 88 88 LYS N N 242 117.949 117.949 118.561 -0.612 17569 1036 1 2 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.110 -0.132 17569 1037 1 2 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.949 1.421 17569 1038 1 2 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.932 0.384 17569 1039 1 2 . 1 1 88 88 LYS H H 242 7.945 7.945 8.540 -0.595 17569 1040 1 2 . 1 1 89 89 CYS N N 243 125.305 125.305 117.453 7.852 17569 1041 1 2 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.263 -0.521 17569 1042 1 2 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.958 1.869 17569 1043 1 2 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.059 1.182 17569 1044 1 2 . 1 1 89 89 CYS H H 243 9.297 9.297 7.641 1.656 17569 1045 1 2 . 1 1 90 90 ILE N N 244 119.687 119.687 121.386 -1.699 17569 1046 1 2 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.895 -0.288 17569 1047 1 2 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.704 0.246 17569 1048 1 2 . 1 1 90 90 ILE H H 244 7.997 7.997 7.621 0.376 17569 1049 1 2 . 1 1 91 91 LEU N N 245 120.280 120.280 121.002 -0.722 17569 1050 1 2 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.295 -0.610 17569 1051 1 2 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.597 0.638 17569 1052 1 2 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.036 -0.078 17569 1053 1 2 . 1 1 91 91 LEU H H 245 8.810 8.810 8.792 0.018 17569 1054 1 2 . 1 1 92 92 ARG N N 246 116.901 116.901 116.692 0.209 17569 1055 1 2 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.131 -0.314 17569 1056 1 2 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.857 1.123 17569 1057 1 2 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.172 0.428 17569 1058 1 2 . 1 1 92 92 ARG H H 246 8.086 8.086 7.664 0.422 17569 1059 1 2 . 1 1 93 93 ASN N N 247 111.200 111.200 116.452 -5.252 17569 1060 1 2 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.510 0.093 17569 1061 1 2 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.696 1.112 17569 1062 1 2 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.057 3.427 17569 1063 1 2 . 1 1 93 93 ASN H H 247 7.136 7.136 8.213 -1.077 17569 1064 1 2 . 1 1 94 94 LEU N N 248 118.807 118.807 117.321 1.486 17569 1065 1 2 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.435 0.379 17569 1066 1 2 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.109 0.080 17569 1067 1 2 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.670 0.028 17569 1068 1 2 . 1 1 94 94 LEU H H 248 8.515 8.515 7.937 0.578 17569 1069 1 2 . 1 1 95 95 GLY N N 249 108.000 108.000 106.472 1.528 17569 1070 1 2 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.605 0.023 17569 1071 1 2 . 1 1 95 95 GLY H H 249 7.955 7.955 7.591 0.364 17569 1072 1 2 . 1 1 96 96 ARG N N 250 117.797 117.797 121.506 -3.709 17569 1073 1 2 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.370 -0.527 17569 1074 1 2 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.261 0.421 17569 1075 1 2 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.178 -0.318 17569 1076 1 2 . 1 1 96 96 ARG H H 250 8.559 8.559 8.645 -0.086 17569 1077 1 2 . 1 1 97 97 LYS N N 251 120.900 120.900 119.539 1.361 17569 1078 1 2 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.040 0.116 17569 1079 1 2 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.269 -0.113 17569 1080 1 2 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.438 -0.077 17569 1081 1 2 . 1 1 97 97 LYS H H 251 8.655 8.655 8.553 0.102 17569 1082 1 2 . 1 1 98 98 GLU N N 252 122.000 122.000 118.611 3.389 17569 1083 1 2 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.073 0.278 17569 1084 1 2 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.472 -0.890 17569 1085 1 2 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.281 -0.881 17569 1086 1 2 . 1 1 98 98 GLU H H 252 7.705 7.705 8.385 -0.680 17569 1087 1 2 . 1 1 99 99 LEU N N 253 117.400 117.400 120.210 -2.810 17569 1088 1 2 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.825 0.092 17569 1089 1 2 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.062 -0.064 17569 1090 1 2 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.789 -0.307 17569 1091 1 2 . 1 1 99 99 LEU H H 253 7.285 7.285 7.721 -0.436 17569 1092 1 2 . 1 1 100 100 SER N N 254 112.100 112.100 114.940 -2.840 17569 1093 1 2 . 1 1 100 100 SER HA H 254 4.107 4.107 4.133 -0.026 17569 1094 1 2 . 1 1 100 100 SER CA C 254 61.603 61.603 61.771 -0.168 17569 1095 1 2 . 1 1 100 100 SER CB C 254 62.622 62.622 62.860 -0.238 17569 1096 1 2 . 1 1 100 100 SER H H 254 8.326 8.326 8.090 0.236 17569 1097 1 2 . 1 1 101 101 THR N N 255 118.151 118.151 119.151 -1.000 17569 1098 1 2 . 1 1 101 101 THR HA H 255 4.026 4.026 4.069 -0.043 17569 1099 1 2 . 1 1 101 101 THR CA C 255 66.261 66.261 66.622 -0.361 17569 1100 1 2 . 1 1 101 101 THR CB C 255 68.735 68.735 68.648 0.087 17569 1101 1 2 . 1 1 101 101 THR H H 255 7.972 7.972 7.765 0.207 17569 1102 1 2 . 1 1 102 102 ILE N N 256 120.100 120.100 122.571 -2.471 17569 1103 1 2 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.535 -0.072 17569 1104 1 2 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.763 0.011 17569 1105 1 2 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.369 0.372 17569 1106 1 2 . 1 1 102 102 ILE H H 256 7.868 7.868 8.510 -0.642 17569 1107 1 2 . 1 1 103 103 MET N N 257 114.876 114.876 116.642 -1.766 17569 1108 1 2 . 1 1 103 103 MET HA H 257 4.211 4.211 4.044 0.167 17569 1109 1 2 . 1 1 103 103 MET CA C 257 55.691 55.691 58.382 -2.691 17569 1110 1 2 . 1 1 103 103 MET CB C 257 32.000 32.000 32.698 -0.698 17569 1111 1 2 . 1 1 103 103 MET H H 257 7.606 7.606 7.480 0.126 17569 1112 1 2 . 1 1 104 104 ASP N N 258 119.976 119.976 117.979 1.997 17569 1113 1 2 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.791 -0.253 17569 1114 1 2 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.897 1.016 17569 1115 1 2 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.015 1.485 17569 1116 1 2 . 1 1 104 104 ASP H H 258 7.444 7.444 7.601 -0.157 17569 1117 1 2 . 1 1 105 105 GLU N N 259 124.388 124.388 121.072 3.316 17569 1118 1 2 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.464 -0.177 17569 1119 1 2 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.929 2.642 17569 1120 1 2 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.093 -0.551 17569 1121 1 2 . 1 1 105 105 GLU H H 259 8.559 8.559 8.083 0.476 17569 1122 1 2 . 1 1 106 106 ASN N N 260 117.201 117.201 117.252 -0.051 17569 1123 1 2 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.394 0.348 17569 1124 1 2 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.985 -0.242 17569 1125 1 2 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.388 1.530 17569 1126 1 2 . 1 1 106 106 ASN H H 260 8.673 8.673 8.618 0.055 17569 1127 1 2 . 1 1 107 107 ASN N N 261 117.900 117.900 111.972 5.928 17569 1128 1 2 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.256 0.729 17569 1129 1 2 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.712 -2.409 17569 1130 1 2 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.745 2.869 17569 1131 1 2 . 1 1 107 107 ASN H H 261 7.956 7.956 8.731 -0.775 17569 1132 1 2 . 1 1 108 108 GLN N N 262 121.500 121.500 115.273 6.227 17569 1133 1 2 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.030 0.578 17569 1134 1 2 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.406 1.370 17569 1135 1 2 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.727 0.831 17569 1136 1 2 . 1 1 108 108 GLN H H 262 8.493 8.493 7.728 0.765 17569 1137 1 2 . 1 1 109 109 TRP N N 263 128.056 128.056 122.942 5.114 17569 1138 1 2 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.922 0.049 17569 1139 1 2 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.518 0.579 17569 1140 1 2 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.447 0.046 17569 1141 1 2 . 1 1 109 109 TRP H H 263 10.497 10.497 7.667 2.830 17569 1142 1 2 . 1 1 110 110 TYR N N 264 126.600 126.600 124.915 1.685 17569 1143 1 2 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.388 0.014 17569 1144 1 2 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.399 -1.728 17569 1145 1 2 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.616 -1.608 17569 1146 1 2 . 1 1 110 110 TYR H H 264 7.545 7.545 8.092 -0.547 17569 1147 1 2 . 1 1 111 111 CYS N N 265 124.622 124.622 114.626 9.996 17569 1148 1 2 . 1 1 111 111 CYS H H 265 8.586 8.586 8.379 0.207 17569 1149 1 2 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.791 -0.599 17569 1150 1 2 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.536 1.179 17569 1151 1 2 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.577 1.343 17569 1152 1 2 . 1 1 113 113 ILE N N 267 119.504 119.504 119.680 -0.176 17569 1153 1 2 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.693 -0.743 17569 1154 1 2 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.951 0.298 17569 1155 1 2 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.554 -3.021 17569 1156 1 2 . 1 1 113 113 ILE H H 267 9.160 9.160 7.468 1.692 17569 1157 1 2 . 1 1 114 114 CYS N N 268 124.100 124.100 118.370 5.730 17569 1158 1 2 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.176 -0.362 17569 1159 1 2 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.653 3.647 17569 1160 1 2 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.090 2.631 17569 1161 1 2 . 1 1 114 114 CYS H H 268 7.818 7.818 8.244 -0.426 17569 1162 1 2 . 1 1 115 115 HIS N N 269 117.127 117.127 111.226 5.901 17569 1163 1 2 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.655 0.474 17569 1164 1 2 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.032 -0.871 17569 1165 1 2 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.798 2.394 17569 1166 1 2 . 1 1 115 115 HIS H H 269 8.953 8.953 7.789 1.164 17569 1167 1 2 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.456 0.486 17569 1168 1 2 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.544 -0.236 17569 1169 1 2 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.517 1.125 17569 1170 1 2 . 1 1 117 117 GLU N N 271 123.504 123.504 123.183 0.321 17569 1171 1 2 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.333 -0.313 17569 1172 1 2 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.222 3.647 17569 1173 1 2 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.079 -2.028 17569 1174 1 2 . 1 1 117 117 GLU H H 271 8.402 8.402 8.083 0.319 17569 1175 1 2 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.554 -0.012 17569 1176 1 2 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.694 1.665 17569 1177 1 2 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.474 0.668 17569 1178 1 2 . 1 1 119 119 LEU N N 273 112.296 112.296 114.181 -1.885 17569 1179 1 2 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.888 -0.414 17569 1180 1 2 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.878 -0.336 17569 1181 1 2 . 1 1 119 119 LEU H H 273 8.090 8.090 7.419 0.671 17569 1182 1 2 . 1 1 120 120 LEU N N 274 121.388 121.388 123.970 -2.582 17569 1183 1 2 . 1 1 120 120 LEU HA H 274 4.027 4.027 4.001 0.026 17569 1184 1 2 . 1 1 120 120 LEU CA C 274 59.301 59.301 58.825 0.476 17569 1185 1 2 . 1 1 120 120 LEU CB C 274 42.100 42.100 40.626 1.474 17569 1186 1 2 . 1 1 120 120 LEU H H 274 7.823 7.823 8.354 -0.531 17569 1187 1 2 . 1 1 121 121 ASP N N 275 118.600 118.600 116.949 1.651 17569 1188 1 2 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.363 0.178 17569 1189 1 2 . 1 1 121 121 ASP CA C 275 57.703 57.703 56.757 0.946 17569 1190 1 2 . 1 1 121 121 ASP CB C 275 39.443 39.443 39.773 -0.330 17569 1191 1 2 . 1 1 121 121 ASP H H 275 8.694 8.694 8.557 0.137 17569 1192 1 2 . 1 1 122 122 LEU N N 276 123.192 123.192 120.874 2.318 17569 1193 1 2 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.054 0.338 17569 1194 1 2 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.669 0.302 17569 1195 1 2 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.013 0.529 17569 1196 1 2 . 1 1 122 122 LEU H H 276 8.013 8.013 7.205 0.808 17569 1197 1 2 . 1 1 123 123 VAL N N 277 126.898 126.898 118.753 8.145 17569 1198 1 2 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.545 0.310 17569 1199 1 2 . 1 1 123 123 VAL CA C 277 66.663 66.663 67.013 -0.350 17569 1200 1 2 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.550 0.508 17569 1201 1 2 . 1 1 123 123 VAL H H 277 8.781 8.781 7.828 0.953 17569 1202 1 2 . 1 1 124 124 THR N N 278 117.500 117.500 116.118 1.382 17569 1203 1 2 . 1 1 124 124 THR HA H 278 4.030 4.030 3.884 0.146 17569 1204 1 2 . 1 1 124 124 THR CA C 278 66.589 66.589 67.161 -0.572 17569 1205 1 2 . 1 1 124 124 THR CB C 278 68.410 68.410 68.223 0.187 17569 1206 1 2 . 1 1 124 124 THR H H 278 8.722 8.722 8.103 0.619 17569 1207 1 2 . 1 1 125 125 ALA N N 279 124.700 124.700 124.775 -0.075 17569 1208 1 2 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.074 0.187 17569 1209 1 2 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.840 0.456 17569 1210 1 2 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.863 0.087 17569 1211 1 2 . 1 1 125 125 ALA H H 279 8.239 8.239 7.676 0.563 17569 1212 1 2 . 1 1 126 126 CYS N N 280 119.276 119.276 117.626 1.650 17569 1213 1 2 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.924 0.190 17569 1214 1 2 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.289 -1.186 17569 1215 1 2 . 1 1 126 126 CYS CB C 280 26.496 26.496 26.758 -0.262 17569 1216 1 2 . 1 1 126 126 CYS H H 280 8.128 8.128 7.787 0.341 17569 1217 1 2 . 1 1 127 127 ASN N N 281 118.000 118.000 118.590 -0.590 17569 1218 1 2 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.584 -0.024 17569 1219 1 2 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.583 -0.444 17569 1220 1 2 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.195 -1.230 17569 1221 1 2 . 1 1 127 127 ASN H H 281 8.725 8.725 7.971 0.754 17569 1222 1 2 . 1 1 128 128 SER N N 282 116.601 116.601 117.330 -0.729 17569 1223 1 2 . 1 1 128 128 SER HA H 282 4.363 4.363 4.163 0.200 17569 1224 1 2 . 1 1 128 128 SER CA C 282 61.899 61.899 61.650 0.249 17569 1225 1 2 . 1 1 128 128 SER CB C 282 62.630 62.630 63.044 -0.414 17569 1226 1 2 . 1 1 128 128 SER H H 282 8.542 8.542 7.763 0.779 17569 1227 1 2 . 1 1 129 129 VAL N N 283 123.272 123.272 121.897 1.375 17569 1228 1 2 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.496 0.181 17569 1229 1 2 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.380 0.128 17569 1230 1 2 . 1 1 129 129 VAL CB C 283 31.218 31.218 30.945 0.273 17569 1231 1 2 . 1 1 129 129 VAL H H 283 7.990 7.990 8.084 -0.094 17569 1232 1 2 . 1 1 130 130 PHE N N 284 118.594 118.594 119.623 -1.029 17569 1233 1 2 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.272 -0.259 17569 1234 1 2 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.586 1.915 17569 1235 1 2 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.116 0.880 17569 1236 1 2 . 1 1 130 130 PHE H H 284 8.190 8.190 7.872 0.318 17569 1237 1 2 . 1 1 131 131 GLU N N 285 120.905 120.905 120.007 0.898 17569 1238 1 2 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.055 0.150 17569 1239 1 2 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.492 -0.278 17569 1240 1 2 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.345 0.155 17569 1241 1 2 . 1 1 131 131 GLU H H 285 8.699 8.699 8.669 0.030 17569 1242 1 2 . 1 1 132 132 ASN N N 286 117.997 117.997 118.104 -0.107 17569 1243 1 2 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.684 -0.089 17569 1244 1 2 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.923 -0.308 17569 1245 1 2 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.863 -0.011 17569 1246 1 2 . 1 1 132 132 ASN H H 286 8.082 8.082 8.084 -0.002 17569 1247 1 2 . 1 1 133 133 LEU N N 287 120.800 120.800 121.977 -1.177 17569 1248 1 2 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.397 -0.280 17569 1249 1 2 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.109 -0.311 17569 1250 1 2 . 1 1 133 133 LEU H H 287 7.904 7.904 8.464 -0.560 17569 1251 1 2 . 1 1 134 134 GLU N N 288 118.200 118.200 119.198 -0.998 17569 1252 1 2 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.984 0.095 17569 1253 1 2 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.057 -1.060 17569 1254 1 2 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.298 -0.056 17569 1255 1 2 . 1 1 134 134 GLU H H 288 8.157 8.157 8.535 -0.378 17569 1256 1 2 . 1 1 135 135 GLN N N 289 117.400 117.400 117.887 -0.487 17569 1257 1 2 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.105 0.069 17569 1258 1 2 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.436 -0.447 17569 1259 1 2 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.585 -0.506 17569 1260 1 2 . 1 1 135 135 GLN H H 289 7.869 7.869 7.718 0.151 17569 1261 1 2 . 1 1 136 136 LEU N N 290 121.000 121.000 122.008 -1.008 17569 1262 1 2 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.921 0.252 17569 1263 1 2 . 1 1 136 136 LEU CA C 290 57.138 57.138 58.011 -0.873 17569 1264 1 2 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.870 0.131 17569 1265 1 2 . 1 1 136 136 LEU H H 290 7.968 7.968 8.086 -0.118 17569 1266 1 2 . 1 1 137 137 LEU N N 291 118.900 118.900 117.916 0.984 17569 1267 1 2 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.083 0.158 17569 1268 1 2 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.434 -1.074 17569 1269 1 2 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.270 -0.798 17569 1270 1 2 . 1 1 137 137 LEU H H 291 8.154 8.154 7.735 0.419 17569 1271 1 2 . 1 1 138 138 GLN N N 292 117.993 117.993 116.181 1.812 17569 1272 1 2 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.469 -0.197 17569 1273 1 2 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.940 1.692 17569 1274 1 2 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.178 -0.594 17569 1275 1 2 . 1 1 138 138 GLN H H 292 7.896 7.896 7.567 0.329 17569 1276 1 2 . 1 1 139 139 GLN N N 293 118.889 118.889 120.125 -1.236 17569 1277 1 2 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.503 -0.234 17569 1278 1 2 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.523 0.931 17569 1279 1 2 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.576 -0.507 17569 1280 1 2 . 1 1 139 139 GLN H H 293 8.091 8.091 7.381 0.710 17569 1281 1 2 . 1 1 140 140 ASN N N 294 118.604 118.604 123.552 -4.948 17569 1282 1 2 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.816 -0.057 17569 1283 1 2 . 1 1 140 140 ASN CA C 294 53.221 53.221 54.192 -0.971 17569 1284 1 2 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.870 -1.137 17569 1285 1 2 . 1 1 140 140 ASN H H 294 8.273 8.273 8.615 -0.342 17569 1286 1 2 . 1 1 141 141 LYS N N 295 121.685 121.685 121.002 0.683 17569 1287 1 2 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.491 -0.131 17569 1288 1 2 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.405 -0.232 17569 1289 1 2 . 1 1 141 141 LYS CB C 295 32.535 32.535 32.827 -0.292 17569 1290 1 2 . 1 1 141 141 LYS H H 295 8.089 8.089 8.236 -0.147 17569 1291 1 3 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.842 -0.455 17569 1292 1 3 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.520 -0.075 17569 1293 1 3 . 1 1 2 2 ALA CB C 156 19.256 19.256 18.768 0.488 17569 1294 1 3 . 1 1 3 3 MET HA H 157 4.476 4.476 5.010 -0.534 17569 1295 1 3 . 1 1 3 3 MET CA C 157 55.401 55.401 55.058 0.343 17569 1296 1 3 . 1 1 4 4 ALA N N 158 124.828 124.828 123.520 1.308 17569 1297 1 3 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.642 -0.328 17569 1298 1 3 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.760 0.751 17569 1299 1 3 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.438 -1.437 17569 1300 1 3 . 1 1 4 4 ALA H H 158 8.382 8.382 8.398 -0.016 17569 1301 1 3 . 1 1 5 5 ASP N N 159 119.418 119.418 120.468 -1.050 17569 1302 1 3 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.830 -0.240 17569 1303 1 3 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.220 -0.084 17569 1304 1 3 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.081 -0.066 17569 1305 1 3 . 1 1 5 5 ASP H H 159 8.312 8.312 8.322 -0.010 17569 1306 1 3 . 1 1 6 6 LYS N N 160 121.604 121.604 122.922 -1.318 17569 1307 1 3 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.789 -0.446 17569 1308 1 3 . 1 1 6 6 LYS H H 160 8.274 8.274 8.386 -0.112 17569 1309 1 3 . 1 1 7 7 ARG N N 161 121.611 121.611 119.314 2.297 17569 1310 1 3 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.439 -0.112 17569 1311 1 3 . 1 1 7 7 ARG H H 161 8.430 8.430 8.353 0.077 17569 1312 1 3 . 1 1 8 8 GLY N N 162 109.606 109.606 109.699 -0.093 17569 1313 1 3 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.971 0.076 17569 1314 1 3 . 1 1 8 8 GLY H H 162 8.473 8.473 8.020 0.453 17569 1315 1 3 . 1 1 9 9 ASP N N 163 120.187 120.187 120.108 0.079 17569 1316 1 3 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.767 -0.118 17569 1317 1 3 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.499 0.652 17569 1318 1 3 . 1 1 9 9 ASP H H 163 8.296 8.296 7.757 0.539 17569 1319 1 3 . 1 1 10 10 GLY N N 164 108.816 108.816 108.924 -0.108 17569 1320 1 3 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.944 0.423 17569 1321 1 3 . 1 1 10 10 GLY H H 164 8.458 8.458 8.570 -0.112 17569 1322 1 3 . 1 1 11 11 LEU N N 165 121.195 121.195 122.977 -1.782 17569 1323 1 3 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.673 -0.357 17569 1324 1 3 . 1 1 11 11 LEU CA C 165 55.000 55.000 55.165 -0.165 17569 1325 1 3 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.583 -0.651 17569 1326 1 3 . 1 1 11 11 LEU H H 165 8.137 8.137 8.058 0.079 17569 1327 1 3 . 1 1 12 12 HIS N N 166 119.387 119.387 123.749 -4.362 17569 1328 1 3 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.747 -0.092 17569 1329 1 3 . 1 1 12 12 HIS CA C 166 56.269 56.269 56.253 0.016 17569 1330 1 3 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.597 -0.900 17569 1331 1 3 . 1 1 12 12 HIS H H 166 8.270 8.270 8.619 -0.349 17569 1332 1 3 . 1 1 13 13 GLY N N 167 109.899 109.899 114.465 -4.566 17569 1333 1 3 . 1 1 13 13 GLY CA C 167 45.105 45.105 45.069 0.036 17569 1334 1 3 . 1 1 13 13 GLY H H 167 8.276 8.276 8.326 -0.050 17569 1335 1 3 . 1 1 14 14 ILE N N 168 119.597 119.597 121.597 -2.000 17569 1336 1 3 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.383 -0.060 17569 1337 1 3 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.528 1.072 17569 1338 1 3 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.825 -2.875 17569 1339 1 3 . 1 1 14 14 ILE H H 168 7.962 7.962 8.165 -0.203 17569 1340 1 3 . 1 1 15 15 VAL N N 169 127.578 127.578 125.935 1.643 17569 1341 1 3 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.107 0.173 17569 1342 1 3 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.404 -1.087 17569 1343 1 3 . 1 1 15 15 VAL CB C 169 33.402 33.402 29.976 3.426 17569 1344 1 3 . 1 1 15 15 VAL H H 169 9.011 9.011 8.514 0.497 17569 1345 1 3 . 1 1 16 16 SER N N 170 118.596 118.596 120.507 -1.911 17569 1346 1 3 . 1 1 16 16 SER HA H 170 5.140 5.140 4.751 0.389 17569 1347 1 3 . 1 1 16 16 SER CA C 170 55.985 55.985 56.376 -0.391 17569 1348 1 3 . 1 1 16 16 SER CB C 170 65.261 65.261 65.621 -0.359 17569 1349 1 3 . 1 1 16 16 SER H H 170 8.242 8.242 7.801 0.441 17569 1350 1 3 . 1 1 17 17 CYS N N 171 123.783 123.783 122.507 1.276 17569 1351 1 3 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.233 -0.052 17569 1352 1 3 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.547 -0.703 17569 1353 1 3 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.355 3.018 17569 1354 1 3 . 1 1 17 17 CYS H H 171 8.894 8.894 8.471 0.423 17569 1355 1 3 . 1 1 18 18 THR N N 172 121.703 121.703 120.299 1.404 17569 1356 1 3 . 1 1 18 18 THR HA H 172 4.386 4.386 4.077 0.309 17569 1357 1 3 . 1 1 18 18 THR CA C 172 64.667 64.667 64.808 -0.141 17569 1358 1 3 . 1 1 18 18 THR CB C 172 69.498 69.498 68.655 0.843 17569 1359 1 3 . 1 1 18 18 THR H H 172 8.788 8.788 8.315 0.473 17569 1360 1 3 . 1 1 19 19 ALA N N 173 131.364 131.364 121.676 9.688 17569 1361 1 3 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.030 0.466 17569 1362 1 3 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.642 0.383 17569 1363 1 3 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.253 3.929 17569 1364 1 3 . 1 1 19 19 ALA H H 173 9.680 9.680 7.961 1.719 17569 1365 1 3 . 1 1 20 20 CYS N N 174 115.498 115.498 115.117 0.381 17569 1366 1 3 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.464 0.504 17569 1367 1 3 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.895 -1.801 17569 1368 1 3 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.543 3.701 17569 1369 1 3 . 1 1 20 20 CYS H H 174 8.470 8.470 7.648 0.822 17569 1370 1 3 . 1 1 21 21 GLY N N 175 112.464 112.464 108.489 3.975 17569 1371 1 3 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.026 0.680 17569 1372 1 3 . 1 1 21 21 GLY H H 175 7.884 7.884 7.994 -0.110 17569 1373 1 3 . 1 1 22 22 GLN N N 176 121.784 121.784 118.146 3.638 17569 1374 1 3 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.465 -0.089 17569 1375 1 3 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.630 1.661 17569 1376 1 3 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.088 -2.747 17569 1377 1 3 . 1 1 22 22 GLN H H 176 8.723 8.723 7.841 0.882 17569 1378 1 3 . 1 1 23 23 GLN N N 177 122.900 122.900 122.987 -0.087 17569 1379 1 3 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.241 0.289 17569 1380 1 3 . 1 1 23 23 GLN CA C 177 56.550 56.550 57.191 -0.641 17569 1381 1 3 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.383 -0.923 17569 1382 1 3 . 1 1 23 23 GLN H H 177 8.721 8.721 8.626 0.095 17569 1383 1 3 . 1 1 24 24 VAL N N 178 121.000 121.000 124.938 -3.938 17569 1384 1 3 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.012 0.512 17569 1385 1 3 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.999 -2.123 17569 1386 1 3 . 1 1 24 24 VAL H H 178 8.689 8.689 7.928 0.761 17569 1387 1 3 . 1 1 25 25 ASN N N 179 121.392 121.392 121.965 -0.573 17569 1388 1 3 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.290 0.586 17569 1389 1 3 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.239 -2.090 17569 1390 1 3 . 1 1 25 25 ASN CB C 179 37.977 37.977 37.967 0.010 17569 1391 1 3 . 1 1 25 25 ASN H H 179 8.635 8.635 8.207 0.428 17569 1392 1 3 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.584 -0.124 17569 1393 1 3 . 1 1 27 27 PHE CA C 181 56.998 56.998 57.004 -0.006 17569 1394 1 3 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.825 -1.432 17569 1395 1 3 . 1 1 28 28 GLN N N 182 119.300 119.300 125.725 -6.425 17569 1396 1 3 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.653 -0.135 17569 1397 1 3 . 1 1 28 28 GLN CA C 182 54.342 54.342 54.726 -0.384 17569 1398 1 3 . 1 1 28 28 GLN CB C 182 30.350 30.350 31.558 -1.208 17569 1399 1 3 . 1 1 28 28 GLN H H 182 7.494 7.494 8.438 -0.944 17569 1400 1 3 . 1 1 29 29 LYS N N 183 124.516 124.516 126.059 -1.543 17569 1401 1 3 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.298 -0.376 17569 1402 1 3 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.832 1.480 17569 1403 1 3 . 1 1 29 29 LYS CB C 183 32.286 32.286 33.145 -0.859 17569 1404 1 3 . 1 1 29 29 LYS H H 183 8.779 8.779 8.520 0.259 17569 1405 1 3 . 1 1 30 30 ASP N N 184 116.500 116.500 120.284 -3.784 17569 1406 1 3 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.388 0.071 17569 1407 1 3 . 1 1 30 30 ASP CA C 184 54.536 54.536 55.555 -1.019 17569 1408 1 3 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.219 -0.248 17569 1409 1 3 . 1 1 30 30 ASP H H 184 8.556 8.556 8.637 -0.081 17569 1410 1 3 . 1 1 31 31 SER N N 185 111.505 111.505 111.369 0.136 17569 1411 1 3 . 1 1 31 31 SER HA H 185 4.695 4.695 4.721 -0.026 17569 1412 1 3 . 1 1 31 31 SER CA C 185 59.747 59.747 56.923 2.824 17569 1413 1 3 . 1 1 31 31 SER CB C 185 65.198 65.198 63.129 2.069 17569 1414 1 3 . 1 1 31 31 SER H H 185 7.933 7.933 7.970 -0.037 17569 1415 1 3 . 1 1 32 32 ILE N N 186 113.394 113.394 114.654 -1.260 17569 1416 1 3 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.626 0.260 17569 1417 1 3 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.103 -0.524 17569 1418 1 3 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.452 1.360 17569 1419 1 3 . 1 1 32 32 ILE H H 186 7.105 7.105 7.271 -0.166 17569 1420 1 3 . 1 1 33 33 TYR N N 187 119.098 119.098 120.655 -1.557 17569 1421 1 3 . 1 1 33 33 TYR HA H 187 4.523 4.523 4.738 -0.215 17569 1422 1 3 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.883 0.377 17569 1423 1 3 . 1 1 33 33 TYR CB C 187 43.440 43.440 42.510 0.930 17569 1424 1 3 . 1 1 33 33 TYR H H 187 8.954 8.954 8.194 0.760 17569 1425 1 3 . 1 1 34 34 ARG N N 188 118.502 118.502 124.539 -6.037 17569 1426 1 3 . 1 1 34 34 ARG HA H 188 4.637 4.637 5.119 -0.482 17569 1427 1 3 . 1 1 34 34 ARG CA C 188 54.752 54.752 55.385 -0.633 17569 1428 1 3 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.543 0.708 17569 1429 1 3 . 1 1 34 34 ARG H H 188 8.412 8.412 8.660 -0.248 17569 1430 1 3 . 1 1 35 35 HIS N N 189 126.596 126.596 128.902 -2.306 17569 1431 1 3 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.889 -0.297 17569 1432 1 3 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.176 -0.455 17569 1433 1 3 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.193 1.279 17569 1434 1 3 . 1 1 35 35 HIS H H 189 9.813 9.813 8.779 1.034 17569 1435 1 3 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.542 -0.244 17569 1436 1 3 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.448 0.827 17569 1437 1 3 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.226 0.625 17569 1438 1 3 . 1 1 37 37 SER N N 191 110.003 110.003 113.418 -3.415 17569 1439 1 3 . 1 1 37 37 SER HA H 191 4.918 4.918 4.265 0.653 17569 1440 1 3 . 1 1 37 37 SER CA C 191 59.031 59.031 60.661 -1.630 17569 1441 1 3 . 1 1 37 37 SER CB C 191 65.104 65.104 63.398 1.706 17569 1442 1 3 . 1 1 37 37 SER H H 191 8.934 8.934 8.238 0.696 17569 1443 1 3 . 1 1 38 38 LEU N N 192 120.959 120.959 113.315 7.644 17569 1444 1 3 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.851 -0.722 17569 1445 1 3 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.306 1.840 17569 1446 1 3 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.649 1.347 17569 1447 1 3 . 1 1 38 38 LEU H H 192 8.649 8.649 7.040 1.609 17569 1448 1 3 . 1 1 39 39 GLN N N 193 108.600 108.600 119.287 -10.687 17569 1449 1 3 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.083 -0.178 17569 1450 1 3 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.562 0.252 17569 1451 1 3 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.008 -1.974 17569 1452 1 3 . 1 1 39 39 GLN H H 193 8.465 8.465 7.915 0.550 17569 1453 1 3 . 1 1 40 40 VAL N N 194 105.325 105.325 118.870 -13.545 17569 1454 1 3 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.474 0.076 17569 1455 1 3 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.245 -1.604 17569 1456 1 3 . 1 1 40 40 VAL H H 194 6.256 6.256 7.910 -1.654 17569 1457 1 3 . 1 1 41 41 LEU N N 195 123.100 123.100 121.911 1.189 17569 1458 1 3 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.964 -0.148 17569 1459 1 3 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.669 3.514 17569 1460 1 3 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.936 -0.366 17569 1461 1 3 . 1 1 41 41 LEU H H 195 9.154 9.154 8.523 0.631 17569 1462 1 3 . 1 1 42 42 ILE N N 196 124.396 124.396 117.424 6.972 17569 1463 1 3 . 1 1 42 42 ILE HA H 196 6.352 6.352 5.069 1.283 17569 1464 1 3 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.611 0.619 17569 1465 1 3 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.990 1.280 17569 1466 1 3 . 1 1 42 42 ILE H H 196 9.766 9.766 8.925 0.841 17569 1467 1 3 . 1 1 43 43 CYS N N 197 121.500 121.500 115.419 6.081 17569 1468 1 3 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.104 0.158 17569 1469 1 3 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.444 0.259 17569 1470 1 3 . 1 1 43 43 CYS CB C 197 33.300 33.300 30.856 2.444 17569 1471 1 3 . 1 1 43 43 CYS H H 197 9.882 9.882 8.529 1.353 17569 1472 1 3 . 1 1 44 44 LYS N N 198 117.995 117.995 123.338 -5.343 17569 1473 1 3 . 1 1 44 44 LYS HA H 198 3.989 3.989 3.706 0.283 17569 1474 1 3 . 1 1 44 44 LYS CA C 198 59.660 59.660 59.984 -0.324 17569 1475 1 3 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.514 0.186 17569 1476 1 3 . 1 1 44 44 LYS H H 198 8.089 8.089 8.871 -0.782 17569 1477 1 3 . 1 1 45 45 ASN N N 199 119.200 119.200 116.768 2.432 17569 1478 1 3 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.492 0.022 17569 1479 1 3 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.119 0.601 17569 1480 1 3 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.202 -0.035 17569 1481 1 3 . 1 1 45 45 ASN H H 199 8.356 8.356 8.365 -0.009 17569 1482 1 3 . 1 1 46 46 CYS N N 200 126.600 126.600 118.686 7.914 17569 1483 1 3 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.921 0.260 17569 1484 1 3 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.248 2.247 17569 1485 1 3 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.203 1.979 17569 1486 1 3 . 1 1 46 46 CYS H H 200 9.189 9.189 8.083 1.106 17569 1487 1 3 . 1 1 47 47 PHE N N 201 121.962 121.962 119.867 2.095 17569 1488 1 3 . 1 1 47 47 PHE HA H 201 3.870 3.870 3.890 -0.020 17569 1489 1 3 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.717 1.552 17569 1490 1 3 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.022 1.145 17569 1491 1 3 . 1 1 47 47 PHE H H 201 8.826 8.826 7.646 1.180 17569 1492 1 3 . 1 1 48 48 LYS N N 202 117.400 117.400 118.916 -1.516 17569 1493 1 3 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.930 -0.232 17569 1494 1 3 . 1 1 48 48 LYS CA C 202 58.952 58.952 58.952 0.000 17569 1495 1 3 . 1 1 48 48 LYS CB C 202 31.542 31.542 31.983 -0.441 17569 1496 1 3 . 1 1 48 48 LYS H H 202 8.512 8.512 8.305 0.207 17569 1497 1 3 . 1 1 49 49 TYR N N 203 120.400 120.400 121.281 -0.881 17569 1498 1 3 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.089 0.325 17569 1499 1 3 . 1 1 49 49 TYR CA C 203 60.772 60.772 62.246 -1.474 17569 1500 1 3 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.394 0.052 17569 1501 1 3 . 1 1 49 49 TYR H H 203 8.133 8.133 7.734 0.399 17569 1502 1 3 . 1 1 50 50 TYR N N 204 121.783 121.783 117.162 4.621 17569 1503 1 3 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.708 -1.213 17569 1504 1 3 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.797 3.153 17569 1505 1 3 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.566 0.927 17569 1506 1 3 . 1 1 50 50 TYR H H 204 8.765 8.765 7.501 1.264 17569 1507 1 3 . 1 1 51 51 MET N N 205 110.800 110.800 116.233 -5.433 17569 1508 1 3 . 1 1 51 51 MET HA H 205 4.349 4.349 4.245 0.104 17569 1509 1 3 . 1 1 51 51 MET CA C 205 53.505 53.505 57.059 -3.554 17569 1510 1 3 . 1 1 51 51 MET CB C 205 30.384 30.384 33.245 -2.861 17569 1511 1 3 . 1 1 51 51 MET H H 205 7.771 7.771 7.821 -0.050 17569 1512 1 3 . 1 1 52 52 SER N N 206 116.800 116.800 112.336 4.464 17569 1513 1 3 . 1 1 52 52 SER HA H 206 3.919 3.919 4.408 -0.489 17569 1514 1 3 . 1 1 52 52 SER CA C 206 61.621 61.621 59.036 2.585 17569 1515 1 3 . 1 1 52 52 SER CB C 206 62.611 62.611 64.155 -1.544 17569 1516 1 3 . 1 1 52 52 SER H H 206 7.581 7.581 8.209 -0.628 17569 1517 1 3 . 1 1 53 53 ASP N N 207 117.400 117.400 121.783 -4.383 17569 1518 1 3 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.730 -0.158 17569 1519 1 3 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.659 -0.560 17569 1520 1 3 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.879 -0.691 17569 1521 1 3 . 1 1 53 53 ASP H H 207 7.085 7.085 7.928 -0.843 17569 1522 1 3 . 1 1 54 54 ASP N N 208 119.405 119.405 122.852 -3.447 17569 1523 1 3 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.967 -0.578 17569 1524 1 3 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.024 0.876 17569 1525 1 3 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.378 -2.029 17569 1526 1 3 . 1 1 54 54 ASP H H 208 8.439 8.439 8.264 0.175 17569 1527 1 3 . 1 1 55 55 ILE N N 209 124.698 124.698 121.266 3.432 17569 1528 1 3 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.209 -0.209 17569 1529 1 3 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.980 1.298 17569 1530 1 3 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.774 1.517 17569 1531 1 3 . 1 1 55 55 ILE H H 209 8.128 8.128 8.357 -0.229 17569 1532 1 3 . 1 1 56 56 SER N N 210 126.703 126.703 122.410 4.293 17569 1533 1 3 . 1 1 56 56 SER HA H 210 4.365 4.365 4.566 -0.201 17569 1534 1 3 . 1 1 56 56 SER CA C 210 57.769 57.769 57.932 -0.163 17569 1535 1 3 . 1 1 56 56 SER CB C 210 64.991 64.991 63.517 1.474 17569 1536 1 3 . 1 1 56 56 SER H H 210 8.815 8.815 8.685 0.130 17569 1537 1 3 . 1 1 57 57 ARG N N 211 116.885 116.885 118.982 -2.097 17569 1538 1 3 . 1 1 57 57 ARG HA H 211 5.042 5.042 3.954 1.088 17569 1539 1 3 . 1 1 57 57 ARG CA C 211 54.400 54.400 57.776 -3.377 17569 1540 1 3 . 1 1 57 57 ARG CB C 211 34.284 34.284 30.268 4.016 17569 1541 1 3 . 1 1 57 57 ARG H H 211 8.365 8.365 8.197 0.168 17569 1542 1 3 . 1 1 58 58 ASP N N 212 121.982 121.982 118.611 3.371 17569 1543 1 3 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.743 -0.128 17569 1544 1 3 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.829 -1.607 17569 1545 1 3 . 1 1 58 58 ASP CB C 212 41.502 41.502 43.555 -2.053 17569 1546 1 3 . 1 1 58 58 ASP H H 212 8.706 8.706 8.274 0.432 17569 1547 1 3 . 1 1 59 59 SER N N 213 114.164 114.164 117.219 -3.055 17569 1548 1 3 . 1 1 59 59 SER HA H 213 4.212 4.212 4.123 0.089 17569 1549 1 3 . 1 1 59 59 SER CA C 213 60.840 60.840 60.017 0.823 17569 1550 1 3 . 1 1 59 59 SER CB C 213 62.714 62.714 61.926 0.788 17569 1551 1 3 . 1 1 59 59 SER H H 213 8.687 8.687 8.794 -0.107 17569 1552 1 3 . 1 1 60 60 ASP N N 214 120.899 120.899 119.302 1.597 17569 1553 1 3 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.429 0.396 17569 1554 1 3 . 1 1 60 60 ASP CA C 214 54.211 54.211 54.826 -0.615 17569 1555 1 3 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.378 1.180 17569 1556 1 3 . 1 1 60 60 ASP H H 214 8.193 8.193 8.354 -0.161 17569 1557 1 3 . 1 1 61 61 GLY N N 215 108.300 108.300 105.127 3.173 17569 1558 1 3 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.599 -0.202 17569 1559 1 3 . 1 1 61 61 GLY H H 215 8.234 8.234 8.384 -0.150 17569 1560 1 3 . 1 1 62 62 MET N N 216 120.002 120.002 119.824 0.178 17569 1561 1 3 . 1 1 62 62 MET HA H 216 4.972 4.972 4.517 0.455 17569 1562 1 3 . 1 1 62 62 MET CA C 216 53.151 53.151 55.031 -1.880 17569 1563 1 3 . 1 1 62 62 MET CB C 216 32.311 32.311 34.017 -1.706 17569 1564 1 3 . 1 1 62 62 MET H H 216 8.376 8.376 7.925 0.451 17569 1565 1 3 . 1 1 63 63 ASP N N 217 127.300 127.300 129.067 -1.767 17569 1566 1 3 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.515 0.451 17569 1567 1 3 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.995 -0.426 17569 1568 1 3 . 1 1 63 63 ASP H H 217 9.368 9.368 8.820 0.548 17569 1569 1 3 . 1 1 64 64 GLU N N 218 114.400 114.400 123.879 -9.479 17569 1570 1 3 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.528 -0.372 17569 1571 1 3 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.724 0.126 17569 1572 1 3 . 1 1 64 64 GLU H H 218 8.583 8.583 8.532 0.051 17569 1573 1 3 . 1 1 65 65 GLN N N 219 115.500 115.500 116.480 -0.980 17569 1574 1 3 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.573 -0.262 17569 1575 1 3 . 1 1 65 65 GLN CA C 219 55.346 55.346 54.745 0.601 17569 1576 1 3 . 1 1 65 65 GLN H H 219 7.158 7.158 7.893 -0.735 17569 1577 1 3 . 1 1 66 66 CYS N N 220 122.600 122.600 118.327 4.273 17569 1578 1 3 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.523 -1.446 17569 1579 1 3 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.109 1.420 17569 1580 1 3 . 1 1 66 66 CYS CB C 220 31.972 31.972 31.070 0.902 17569 1581 1 3 . 1 1 66 66 CYS H H 220 8.248 8.248 8.491 -0.243 17569 1582 1 3 . 1 1 67 67 ARG N N 221 130.363 130.363 123.893 6.470 17569 1583 1 3 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.524 -0.457 17569 1584 1 3 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.780 -2.764 17569 1585 1 3 . 1 1 67 67 ARG H H 221 9.145 9.145 8.752 0.393 17569 1586 1 3 . 1 1 68 68 TRP N N 222 124.200 124.200 121.652 2.548 17569 1587 1 3 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.659 -0.223 17569 1588 1 3 . 1 1 68 68 TRP CA C 222 60.080 60.080 60.596 -0.516 17569 1589 1 3 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.007 1.187 17569 1590 1 3 . 1 1 68 68 TRP H H 222 9.689 9.689 8.505 1.184 17569 1591 1 3 . 1 1 69 69 CYS N N 223 116.297 116.297 110.243 6.054 17569 1592 1 3 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.182 -0.091 17569 1593 1 3 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.793 3.309 17569 1594 1 3 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.595 4.743 17569 1595 1 3 . 1 1 69 69 CYS H H 223 8.822 8.822 7.683 1.139 17569 1596 1 3 . 1 1 70 70 ALA N N 224 123.112 123.112 124.511 -1.399 17569 1597 1 3 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.339 0.067 17569 1598 1 3 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.169 -0.318 17569 1599 1 3 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.735 -0.015 17569 1600 1 3 . 1 1 70 70 ALA H H 224 8.787 8.787 8.312 0.475 17569 1601 1 3 . 1 1 71 71 GLU N N 225 118.300 118.300 120.872 -2.572 17569 1602 1 3 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.605 0.703 17569 1603 1 3 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.926 -2.627 17569 1604 1 3 . 1 1 71 71 GLU H H 225 8.541 8.541 7.805 0.736 17569 1605 1 3 . 1 1 72 72 GLY N N 226 111.995 111.995 109.836 2.159 17569 1606 1 3 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.701 -0.298 17569 1607 1 3 . 1 1 72 72 GLY H H 226 9.837 9.837 8.494 1.343 17569 1608 1 3 . 1 1 73 73 GLY N N 227 106.600 106.600 107.039 -0.439 17569 1609 1 3 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.111 0.860 17569 1610 1 3 . 1 1 73 73 GLY H H 227 7.772 7.772 8.454 -0.682 17569 1611 1 3 . 1 1 74 74 ASN N N 228 124.277 124.277 119.002 5.275 17569 1612 1 3 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.417 0.664 17569 1613 1 3 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.448 -0.348 17569 1614 1 3 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.601 -0.517 17569 1615 1 3 . 1 1 74 74 ASN H H 228 8.876 8.876 8.459 0.417 17569 1616 1 3 . 1 1 75 75 LEU N N 229 123.050 123.050 121.329 1.721 17569 1617 1 3 . 1 1 75 75 LEU HA H 229 4.600 4.600 5.180 -0.580 17569 1618 1 3 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.283 1.079 17569 1619 1 3 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.864 -1.364 17569 1620 1 3 . 1 1 75 75 LEU H H 229 8.901 8.901 7.819 1.082 17569 1621 1 3 . 1 1 76 76 ILE N N 230 123.552 123.552 121.783 1.769 17569 1622 1 3 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.405 0.080 17569 1623 1 3 . 1 1 76 76 ILE CA C 230 60.700 60.700 60.071 0.629 17569 1624 1 3 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.888 -1.489 17569 1625 1 3 . 1 1 76 76 ILE H H 230 9.406 9.406 9.184 0.222 17569 1626 1 3 . 1 1 77 77 CYS N N 231 124.637 124.637 124.993 -0.356 17569 1627 1 3 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.490 -0.616 17569 1628 1 3 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.866 0.493 17569 1629 1 3 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.332 0.102 17569 1630 1 3 . 1 1 77 77 CYS H H 231 8.809 8.809 8.482 0.327 17569 1631 1 3 . 1 1 78 78 CYS N N 232 125.697 125.697 121.824 3.873 17569 1632 1 3 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.776 -0.492 17569 1633 1 3 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.975 3.909 17569 1634 1 3 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.606 1.564 17569 1635 1 3 . 1 1 78 78 CYS H H 232 8.579 8.579 8.700 -0.121 17569 1636 1 3 . 1 1 79 79 ASP N N 233 123.600 123.600 125.465 -1.865 17569 1637 1 3 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.605 0.152 17569 1638 1 3 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.979 2.010 17569 1639 1 3 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.243 1.386 17569 1640 1 3 . 1 1 79 79 ASP H H 233 8.577 8.577 8.349 0.228 17569 1641 1 3 . 1 1 80 80 PHE N N 234 122.100 122.100 117.954 4.146 17569 1642 1 3 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.640 -0.114 17569 1643 1 3 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.671 1.238 17569 1644 1 3 . 1 1 80 80 PHE CB C 234 41.849 41.849 39.796 2.053 17569 1645 1 3 . 1 1 80 80 PHE H H 234 10.432 10.432 7.536 2.896 17569 1646 1 3 . 1 1 81 81 CYS N N 235 124.300 124.300 117.420 6.880 17569 1647 1 3 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.857 0.299 17569 1648 1 3 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.187 -0.142 17569 1649 1 3 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.892 3.515 17569 1650 1 3 . 1 1 81 81 CYS H H 235 8.476 8.476 8.090 0.386 17569 1651 1 3 . 1 1 82 82 HIS N N 236 112.598 112.598 118.793 -6.195 17569 1652 1 3 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.198 0.785 17569 1653 1 3 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.725 -1.327 17569 1654 1 3 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.605 2.652 17569 1655 1 3 . 1 1 82 82 HIS H H 236 6.699 6.699 8.196 -1.497 17569 1656 1 3 . 1 1 83 83 ASN N N 237 123.600 123.600 119.263 4.337 17569 1657 1 3 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.833 -0.032 17569 1658 1 3 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.694 2.922 17569 1659 1 3 . 1 1 83 83 ASN H H 237 9.097 9.097 7.855 1.242 17569 1660 1 3 . 1 1 84 84 ALA N N 238 122.000 122.000 123.611 -1.611 17569 1661 1 3 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.169 0.240 17569 1662 1 3 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.734 -0.370 17569 1663 1 3 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.979 3.091 17569 1664 1 3 . 1 1 84 84 ALA H H 238 9.885 9.885 8.286 1.599 17569 1665 1 3 . 1 1 85 85 PHE N N 239 116.707 116.707 120.892 -4.185 17569 1666 1 3 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.125 0.903 17569 1667 1 3 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.619 -0.402 17569 1668 1 3 . 1 1 85 85 PHE CB C 239 44.664 44.664 44.305 0.359 17569 1669 1 3 . 1 1 85 85 PHE H H 239 9.450 9.450 8.776 0.674 17569 1670 1 3 . 1 1 86 86 CYS N N 240 126.682 126.682 117.063 9.619 17569 1671 1 3 . 1 1 86 86 CYS HA H 240 5.622 5.622 5.338 0.284 17569 1672 1 3 . 1 1 86 86 CYS CA C 240 57.342 57.342 55.589 1.753 17569 1673 1 3 . 1 1 86 86 CYS CB C 240 32.257 32.257 31.705 0.552 17569 1674 1 3 . 1 1 86 86 CYS H H 240 11.309 11.309 8.960 2.349 17569 1675 1 3 . 1 1 87 87 LYS N N 241 117.865 117.865 122.860 -4.995 17569 1676 1 3 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.895 -0.046 17569 1677 1 3 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.483 -0.413 17569 1678 1 3 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.503 0.295 17569 1679 1 3 . 1 1 87 87 LYS H H 241 8.230 8.230 8.230 -0.000 17569 1680 1 3 . 1 1 88 88 LYS N N 242 117.949 117.949 117.926 0.023 17569 1681 1 3 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.109 -0.131 17569 1682 1 3 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.150 1.220 17569 1683 1 3 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.011 0.305 17569 1684 1 3 . 1 1 88 88 LYS H H 242 7.945 7.945 8.467 -0.522 17569 1685 1 3 . 1 1 89 89 CYS N N 243 125.305 125.305 118.311 6.994 17569 1686 1 3 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.243 -0.501 17569 1687 1 3 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.339 2.488 17569 1688 1 3 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.432 0.809 17569 1689 1 3 . 1 1 89 89 CYS H H 243 9.297 9.297 7.800 1.497 17569 1690 1 3 . 1 1 90 90 ILE N N 244 119.687 119.687 121.304 -1.617 17569 1691 1 3 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.948 -0.341 17569 1692 1 3 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.902 0.048 17569 1693 1 3 . 1 1 90 90 ILE H H 244 7.997 7.997 8.053 -0.056 17569 1694 1 3 . 1 1 91 91 LEU N N 245 120.280 120.280 121.041 -0.761 17569 1695 1 3 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.422 -0.737 17569 1696 1 3 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.610 0.625 17569 1697 1 3 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.020 -0.062 17569 1698 1 3 . 1 1 91 91 LEU H H 245 8.810 8.810 8.701 0.109 17569 1699 1 3 . 1 1 92 92 ARG N N 246 116.901 116.901 117.562 -0.661 17569 1700 1 3 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.124 -0.307 17569 1701 1 3 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.094 0.886 17569 1702 1 3 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.085 0.514 17569 1703 1 3 . 1 1 92 92 ARG H H 246 8.086 8.086 7.544 0.542 17569 1704 1 3 . 1 1 93 93 ASN N N 247 111.200 111.200 116.538 -5.338 17569 1705 1 3 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.498 0.105 17569 1706 1 3 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.787 1.021 17569 1707 1 3 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.938 3.546 17569 1708 1 3 . 1 1 93 93 ASN H H 247 7.136 7.136 8.158 -1.022 17569 1709 1 3 . 1 1 94 94 LEU N N 248 118.807 118.807 117.446 1.361 17569 1710 1 3 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.408 0.406 17569 1711 1 3 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.170 0.019 17569 1712 1 3 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.633 0.065 17569 1713 1 3 . 1 1 94 94 LEU H H 248 8.515 8.515 7.928 0.587 17569 1714 1 3 . 1 1 95 95 GLY N N 249 108.000 108.000 106.502 1.498 17569 1715 1 3 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.555 0.073 17569 1716 1 3 . 1 1 95 95 GLY H H 249 7.955 7.955 7.539 0.416 17569 1717 1 3 . 1 1 96 96 ARG N N 250 117.797 117.797 120.800 -3.003 17569 1718 1 3 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.324 -0.481 17569 1719 1 3 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.055 0.627 17569 1720 1 3 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.342 -0.482 17569 1721 1 3 . 1 1 96 96 ARG H H 250 8.559 8.559 8.644 -0.085 17569 1722 1 3 . 1 1 97 97 LYS N N 251 120.900 120.900 119.429 1.471 17569 1723 1 3 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.056 0.100 17569 1724 1 3 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.296 -0.140 17569 1725 1 3 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.605 -0.245 17569 1726 1 3 . 1 1 97 97 LYS H H 251 8.655 8.655 8.474 0.181 17569 1727 1 3 . 1 1 98 98 GLU N N 252 122.000 122.000 118.577 3.423 17569 1728 1 3 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.134 0.217 17569 1729 1 3 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.553 -0.971 17569 1730 1 3 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.224 -0.824 17569 1731 1 3 . 1 1 98 98 GLU H H 252 7.705 7.705 8.376 -0.671 17569 1732 1 3 . 1 1 99 99 LEU N N 253 117.400 117.400 121.213 -3.813 17569 1733 1 3 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.812 0.105 17569 1734 1 3 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.062 -0.064 17569 1735 1 3 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.831 -0.349 17569 1736 1 3 . 1 1 99 99 LEU H H 253 7.285 7.285 7.605 -0.320 17569 1737 1 3 . 1 1 100 100 SER N N 254 112.100 112.100 114.499 -2.399 17569 1738 1 3 . 1 1 100 100 SER HA H 254 4.107 4.107 4.146 -0.039 17569 1739 1 3 . 1 1 100 100 SER CA C 254 61.603 61.603 62.123 -0.520 17569 1740 1 3 . 1 1 100 100 SER CB C 254 62.622 62.622 62.887 -0.265 17569 1741 1 3 . 1 1 100 100 SER H H 254 8.326 8.326 7.989 0.337 17569 1742 1 3 . 1 1 101 101 THR N N 255 118.151 118.151 119.100 -0.949 17569 1743 1 3 . 1 1 101 101 THR HA H 255 4.026 4.026 4.085 -0.059 17569 1744 1 3 . 1 1 101 101 THR CA C 255 66.261 66.261 66.394 -0.133 17569 1745 1 3 . 1 1 101 101 THR CB C 255 68.735 68.735 68.769 -0.034 17569 1746 1 3 . 1 1 101 101 THR H H 255 7.972 7.972 7.783 0.189 17569 1747 1 3 . 1 1 102 102 ILE N N 256 120.100 120.100 123.233 -3.133 17569 1748 1 3 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.923 -0.460 17569 1749 1 3 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.654 0.120 17569 1750 1 3 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.457 0.284 17569 1751 1 3 . 1 1 102 102 ILE H H 256 7.868 7.868 8.696 -0.828 17569 1752 1 3 . 1 1 103 103 MET N N 257 114.876 114.876 116.306 -1.430 17569 1753 1 3 . 1 1 103 103 MET HA H 257 4.211 4.211 4.103 0.108 17569 1754 1 3 . 1 1 103 103 MET CA C 257 55.691 55.691 57.549 -1.858 17569 1755 1 3 . 1 1 103 103 MET CB C 257 32.000 32.000 32.272 -0.272 17569 1756 1 3 . 1 1 103 103 MET H H 257 7.606 7.606 7.273 0.333 17569 1757 1 3 . 1 1 104 104 ASP N N 258 119.976 119.976 119.157 0.819 17569 1758 1 3 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.782 -0.244 17569 1759 1 3 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.809 1.103 17569 1760 1 3 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.265 1.235 17569 1761 1 3 . 1 1 104 104 ASP H H 258 7.444 7.444 7.615 -0.171 17569 1762 1 3 . 1 1 105 105 GLU N N 259 124.388 124.388 121.868 2.520 17569 1763 1 3 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.527 -0.240 17569 1764 1 3 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.117 2.454 17569 1765 1 3 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.754 -0.212 17569 1766 1 3 . 1 1 105 105 GLU H H 259 8.559 8.559 8.323 0.236 17569 1767 1 3 . 1 1 106 106 ASN N N 260 117.201 117.201 118.839 -1.638 17569 1768 1 3 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.397 0.345 17569 1769 1 3 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.118 -0.375 17569 1770 1 3 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.339 1.579 17569 1771 1 3 . 1 1 106 106 ASN H H 260 8.673 8.673 8.729 -0.056 17569 1772 1 3 . 1 1 107 107 ASN N N 261 117.900 117.900 113.928 3.972 17569 1773 1 3 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.270 0.715 17569 1774 1 3 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.613 -2.311 17569 1775 1 3 . 1 1 107 107 ASN CB C 261 40.614 40.614 38.014 2.600 17569 1776 1 3 . 1 1 107 107 ASN H H 261 7.956 7.956 8.693 -0.737 17569 1777 1 3 . 1 1 108 108 GLN N N 262 121.500 121.500 115.189 6.311 17569 1778 1 3 . 1 1 108 108 GLN HA H 262 4.608 4.608 3.981 0.627 17569 1779 1 3 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.642 1.134 17569 1780 1 3 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.865 0.693 17569 1781 1 3 . 1 1 108 108 GLN H H 262 8.493 8.493 7.721 0.772 17569 1782 1 3 . 1 1 109 109 TRP N N 263 128.056 128.056 123.735 4.321 17569 1783 1 3 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.901 0.070 17569 1784 1 3 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.582 0.515 17569 1785 1 3 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.855 0.638 17569 1786 1 3 . 1 1 109 109 TRP H H 263 10.497 10.497 7.980 2.517 17569 1787 1 3 . 1 1 110 110 TYR N N 264 126.600 126.600 125.929 0.671 17569 1788 1 3 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.278 0.124 17569 1789 1 3 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.369 -2.698 17569 1790 1 3 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.105 -1.097 17569 1791 1 3 . 1 1 110 110 TYR H H 264 7.545 7.545 8.169 -0.624 17569 1792 1 3 . 1 1 111 111 CYS N N 265 124.622 124.622 114.192 10.430 17569 1793 1 3 . 1 1 111 111 CYS H H 265 8.586 8.586 8.434 0.152 17569 1794 1 3 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.837 -0.645 17569 1795 1 3 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.732 0.983 17569 1796 1 3 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.729 1.191 17569 1797 1 3 . 1 1 113 113 ILE N N 267 119.504 119.504 119.370 0.134 17569 1798 1 3 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.478 -0.527 17569 1799 1 3 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.932 0.317 17569 1800 1 3 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.514 -2.981 17569 1801 1 3 . 1 1 113 113 ILE H H 267 9.160 9.160 7.494 1.666 17569 1802 1 3 . 1 1 114 114 CYS N N 268 124.100 124.100 118.392 5.708 17569 1803 1 3 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.178 -0.364 17569 1804 1 3 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.699 3.601 17569 1805 1 3 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.091 2.630 17569 1806 1 3 . 1 1 114 114 CYS H H 268 7.818 7.818 8.257 -0.439 17569 1807 1 3 . 1 1 115 115 HIS N N 269 117.127 117.127 111.244 5.883 17569 1808 1 3 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.665 0.464 17569 1809 1 3 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.035 -0.874 17569 1810 1 3 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.809 2.383 17569 1811 1 3 . 1 1 115 115 HIS H H 269 8.953 8.953 7.819 1.134 17569 1812 1 3 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.451 0.491 17569 1813 1 3 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.497 -0.189 17569 1814 1 3 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.621 1.021 17569 1815 1 3 . 1 1 117 117 GLU N N 271 123.504 123.504 123.034 0.470 17569 1816 1 3 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.370 -0.350 17569 1817 1 3 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.174 3.695 17569 1818 1 3 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.920 -1.869 17569 1819 1 3 . 1 1 117 117 GLU H H 271 8.402 8.402 8.153 0.249 17569 1820 1 3 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.527 0.015 17569 1821 1 3 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.800 1.559 17569 1822 1 3 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.488 0.654 17569 1823 1 3 . 1 1 119 119 LEU N N 273 112.296 112.296 115.115 -2.819 17569 1824 1 3 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.905 -0.431 17569 1825 1 3 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.273 0.269 17569 1826 1 3 . 1 1 119 119 LEU H H 273 8.090 8.090 7.562 0.528 17569 1827 1 3 . 1 1 120 120 LEU N N 274 121.388 121.388 122.412 -1.024 17569 1828 1 3 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.912 0.115 17569 1829 1 3 . 1 1 120 120 LEU CA C 274 59.301 59.301 58.983 0.318 17569 1830 1 3 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.702 0.398 17569 1831 1 3 . 1 1 120 120 LEU H H 274 7.823 7.823 7.868 -0.045 17569 1832 1 3 . 1 1 121 121 ASP N N 275 118.600 118.600 118.743 -0.143 17569 1833 1 3 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.343 0.198 17569 1834 1 3 . 1 1 121 121 ASP CA C 275 57.703 57.703 56.503 1.200 17569 1835 1 3 . 1 1 121 121 ASP CB C 275 39.443 39.443 39.642 -0.199 17569 1836 1 3 . 1 1 121 121 ASP H H 275 8.694 8.694 8.437 0.257 17569 1837 1 3 . 1 1 122 122 LEU N N 276 123.192 123.192 121.419 1.773 17569 1838 1 3 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.054 0.338 17569 1839 1 3 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.760 0.211 17569 1840 1 3 . 1 1 122 122 LEU CB C 276 42.542 42.542 41.957 0.585 17569 1841 1 3 . 1 1 122 122 LEU H H 276 8.013 8.013 7.737 0.276 17569 1842 1 3 . 1 1 123 123 VAL N N 277 126.898 126.898 118.753 8.145 17569 1843 1 3 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.603 0.252 17569 1844 1 3 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.954 -0.291 17569 1845 1 3 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.549 0.509 17569 1846 1 3 . 1 1 123 123 VAL H H 277 8.781 8.781 7.855 0.926 17569 1847 1 3 . 1 1 124 124 THR N N 278 117.500 117.500 116.226 1.274 17569 1848 1 3 . 1 1 124 124 THR HA H 278 4.030 4.030 3.923 0.107 17569 1849 1 3 . 1 1 124 124 THR CA C 278 66.589 66.589 66.735 -0.146 17569 1850 1 3 . 1 1 124 124 THR CB C 278 68.410 68.410 68.040 0.370 17569 1851 1 3 . 1 1 124 124 THR H H 278 8.722 8.722 8.100 0.622 17569 1852 1 3 . 1 1 125 125 ALA N N 279 124.700 124.700 123.677 1.023 17569 1853 1 3 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.134 0.127 17569 1854 1 3 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.909 0.387 17569 1855 1 3 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.015 -0.066 17569 1856 1 3 . 1 1 125 125 ALA H H 279 8.239 8.239 7.979 0.260 17569 1857 1 3 . 1 1 126 126 CYS N N 280 119.276 119.276 117.694 1.582 17569 1858 1 3 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.927 0.187 17569 1859 1 3 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.901 -1.798 17569 1860 1 3 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.914 -1.418 17569 1861 1 3 . 1 1 126 126 CYS H H 280 8.128 8.128 7.778 0.350 17569 1862 1 3 . 1 1 127 127 ASN N N 281 118.000 118.000 118.152 -0.152 17569 1863 1 3 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.586 -0.026 17569 1864 1 3 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.113 0.026 17569 1865 1 3 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.835 -0.870 17569 1866 1 3 . 1 1 127 127 ASN H H 281 8.725 8.725 7.997 0.728 17569 1867 1 3 . 1 1 128 128 SER N N 282 116.601 116.601 117.435 -0.834 17569 1868 1 3 . 1 1 128 128 SER HA H 282 4.363 4.363 4.221 0.142 17569 1869 1 3 . 1 1 128 128 SER CA C 282 61.899 61.899 61.976 -0.077 17569 1870 1 3 . 1 1 128 128 SER CB C 282 62.630 62.630 63.206 -0.576 17569 1871 1 3 . 1 1 128 128 SER H H 282 8.542 8.542 7.698 0.844 17569 1872 1 3 . 1 1 129 129 VAL N N 283 123.272 123.272 122.179 1.093 17569 1873 1 3 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.495 0.182 17569 1874 1 3 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.644 -0.136 17569 1875 1 3 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.547 -0.329 17569 1876 1 3 . 1 1 129 129 VAL H H 283 7.990 7.990 8.240 -0.250 17569 1877 1 3 . 1 1 130 130 PHE N N 284 118.594 118.594 119.442 -0.848 17569 1878 1 3 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.237 -0.224 17569 1879 1 3 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.217 2.283 17569 1880 1 3 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.510 0.486 17569 1881 1 3 . 1 1 130 130 PHE H H 284 8.190 8.190 8.507 -0.317 17569 1882 1 3 . 1 1 131 131 GLU N N 285 120.905 120.905 120.269 0.636 17569 1883 1 3 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.066 0.139 17569 1884 1 3 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.395 -0.181 17569 1885 1 3 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.435 0.065 17569 1886 1 3 . 1 1 131 131 GLU H H 285 8.699 8.699 8.821 -0.122 17569 1887 1 3 . 1 1 132 132 ASN N N 286 117.997 117.997 118.589 -0.592 17569 1888 1 3 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.649 -0.054 17569 1889 1 3 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.839 -0.224 17569 1890 1 3 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.687 0.165 17569 1891 1 3 . 1 1 132 132 ASN H H 286 8.082 8.082 8.128 -0.046 17569 1892 1 3 . 1 1 133 133 LEU N N 287 120.800 120.800 121.779 -0.979 17569 1893 1 3 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.265 -0.148 17569 1894 1 3 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.387 -0.589 17569 1895 1 3 . 1 1 133 133 LEU H H 287 7.904 7.904 8.300 -0.396 17569 1896 1 3 . 1 1 134 134 GLU N N 288 118.200 118.200 118.709 -0.509 17569 1897 1 3 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.871 0.208 17569 1898 1 3 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.690 -0.693 17569 1899 1 3 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.498 -0.256 17569 1900 1 3 . 1 1 134 134 GLU H H 288 8.157 8.157 8.017 0.140 17569 1901 1 3 . 1 1 135 135 GLN N N 289 117.400 117.400 118.932 -1.532 17569 1902 1 3 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.087 0.087 17569 1903 1 3 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.687 -0.698 17569 1904 1 3 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.689 -0.609 17569 1905 1 3 . 1 1 135 135 GLN H H 289 7.869 7.869 7.551 0.318 17569 1906 1 3 . 1 1 136 136 LEU N N 290 121.000 121.000 121.260 -0.260 17569 1907 1 3 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.826 0.347 17569 1908 1 3 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.788 -0.650 17569 1909 1 3 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.791 0.209 17569 1910 1 3 . 1 1 136 136 LEU H H 290 7.968 7.968 8.086 -0.118 17569 1911 1 3 . 1 1 137 137 LEU N N 291 118.900 118.900 119.379 -0.479 17569 1912 1 3 . 1 1 137 137 LEU HA H 291 4.241 4.241 3.981 0.260 17569 1913 1 3 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.252 -0.892 17569 1914 1 3 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.184 -0.712 17569 1915 1 3 . 1 1 137 137 LEU H H 291 8.154 8.154 7.501 0.653 17569 1916 1 3 . 1 1 138 138 GLN N N 292 117.993 117.993 114.942 3.051 17569 1917 1 3 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.472 -0.200 17569 1918 1 3 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.928 1.704 17569 1919 1 3 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.043 -0.459 17569 1920 1 3 . 1 1 138 138 GLN H H 292 7.896 7.896 7.664 0.232 17569 1921 1 3 . 1 1 139 139 GLN N N 293 118.889 118.889 119.254 -0.365 17569 1922 1 3 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.471 -0.202 17569 1923 1 3 . 1 1 139 139 GLN CA C 293 56.454 56.454 54.313 2.141 17569 1924 1 3 . 1 1 139 139 GLN CB C 293 29.069 29.069 30.983 -1.914 17569 1925 1 3 . 1 1 139 139 GLN H H 293 8.091 8.091 7.376 0.715 17569 1926 1 3 . 1 1 140 140 ASN N N 294 118.604 118.604 120.808 -2.204 17569 1927 1 3 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.861 -0.102 17569 1928 1 3 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.172 0.049 17569 1929 1 3 . 1 1 140 140 ASN CB C 294 38.733 38.733 38.051 0.682 17569 1930 1 3 . 1 1 140 140 ASN H H 294 8.273 8.273 8.626 -0.353 17569 1931 1 3 . 1 1 141 141 LYS N N 295 121.685 121.685 121.240 0.445 17569 1932 1 3 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.325 0.035 17569 1933 1 3 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.728 -0.555 17569 1934 1 3 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.775 -1.240 17569 1935 1 3 . 1 1 141 141 LYS H H 295 8.089 8.089 8.457 -0.368 17569 1936 1 4 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.735 -0.348 17569 1937 1 4 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.321 0.124 17569 1938 1 4 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.387 -0.130 17569 1939 1 4 . 1 1 3 3 MET HA H 157 4.476 4.476 4.518 -0.042 17569 1940 1 4 . 1 1 3 3 MET CA C 157 55.401 55.401 55.709 -0.308 17569 1941 1 4 . 1 1 4 4 ALA N N 158 124.828 124.828 122.533 2.295 17569 1942 1 4 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.508 -0.194 17569 1943 1 4 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.876 0.635 17569 1944 1 4 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.516 -1.515 17569 1945 1 4 . 1 1 4 4 ALA H H 158 8.382 8.382 7.916 0.466 17569 1946 1 4 . 1 1 5 5 ASP N N 159 119.418 119.418 121.337 -1.919 17569 1947 1 4 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.791 -0.201 17569 1948 1 4 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.748 -0.612 17569 1949 1 4 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.221 -0.206 17569 1950 1 4 . 1 1 5 5 ASP H H 159 8.312 8.312 8.690 -0.378 17569 1951 1 4 . 1 1 6 6 LYS N N 160 121.604 121.604 119.805 1.799 17569 1952 1 4 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.343 0.000 17569 1953 1 4 . 1 1 6 6 LYS H H 160 8.274 8.274 7.624 0.650 17569 1954 1 4 . 1 1 7 7 ARG N N 161 121.611 121.611 120.480 1.131 17569 1955 1 4 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.138 0.190 17569 1956 1 4 . 1 1 7 7 ARG H H 161 8.430 8.430 8.321 0.109 17569 1957 1 4 . 1 1 8 8 GLY N N 162 109.606 109.606 111.495 -1.889 17569 1958 1 4 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.749 0.298 17569 1959 1 4 . 1 1 8 8 GLY H H 162 8.473 8.473 8.302 0.171 17569 1960 1 4 . 1 1 9 9 ASP N N 163 120.187 120.187 120.975 -0.788 17569 1961 1 4 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.884 -0.235 17569 1962 1 4 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.708 0.443 17569 1963 1 4 . 1 1 9 9 ASP H H 163 8.296 8.296 8.213 0.083 17569 1964 1 4 . 1 1 10 10 GLY N N 164 108.816 108.816 110.200 -1.384 17569 1965 1 4 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.489 -0.122 17569 1966 1 4 . 1 1 10 10 GLY H H 164 8.458 8.458 8.412 0.046 17569 1967 1 4 . 1 1 11 11 LEU N N 165 121.195 121.195 119.697 1.498 17569 1968 1 4 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.839 -0.523 17569 1969 1 4 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.352 0.648 17569 1970 1 4 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.676 -2.744 17569 1971 1 4 . 1 1 11 11 LEU H H 165 8.137 8.137 8.040 0.097 17569 1972 1 4 . 1 1 12 12 HIS N N 166 119.387 119.387 118.451 0.936 17569 1973 1 4 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.843 -0.188 17569 1974 1 4 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.410 0.859 17569 1975 1 4 . 1 1 12 12 HIS CB C 166 30.697 30.697 32.514 -1.817 17569 1976 1 4 . 1 1 12 12 HIS H H 166 8.270 8.270 8.424 -0.154 17569 1977 1 4 . 1 1 13 13 GLY N N 167 109.899 109.899 108.957 0.942 17569 1978 1 4 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.873 0.232 17569 1979 1 4 . 1 1 13 13 GLY H H 167 8.276 8.276 8.380 -0.104 17569 1980 1 4 . 1 1 14 14 ILE N N 168 119.597 119.597 123.752 -4.155 17569 1981 1 4 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.260 0.063 17569 1982 1 4 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.326 0.274 17569 1983 1 4 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.587 -2.638 17569 1984 1 4 . 1 1 14 14 ILE H H 168 7.962 7.962 8.112 -0.150 17569 1985 1 4 . 1 1 15 15 VAL N N 169 127.578 127.578 127.083 0.495 17569 1986 1 4 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.122 0.158 17569 1987 1 4 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.771 -1.454 17569 1988 1 4 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.670 1.732 17569 1989 1 4 . 1 1 15 15 VAL H H 169 9.011 9.011 8.512 0.499 17569 1990 1 4 . 1 1 16 16 SER N N 170 118.596 118.596 120.815 -2.219 17569 1991 1 4 . 1 1 16 16 SER HA H 170 5.140 5.140 4.651 0.489 17569 1992 1 4 . 1 1 16 16 SER CA C 170 55.985 55.985 57.288 -1.303 17569 1993 1 4 . 1 1 16 16 SER CB C 170 65.261 65.261 65.916 -0.655 17569 1994 1 4 . 1 1 16 16 SER H H 170 8.242 8.242 8.258 -0.016 17569 1995 1 4 . 1 1 17 17 CYS N N 171 123.783 123.783 123.709 0.074 17569 1996 1 4 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.168 0.013 17569 1997 1 4 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.691 -0.847 17569 1998 1 4 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.664 2.709 17569 1999 1 4 . 1 1 17 17 CYS H H 171 8.894 8.894 8.487 0.407 17569 2000 1 4 . 1 1 18 18 THR N N 172 121.703 121.703 117.668 4.035 17569 2001 1 4 . 1 1 18 18 THR HA H 172 4.386 4.386 4.124 0.262 17569 2002 1 4 . 1 1 18 18 THR CA C 172 64.667 64.667 64.161 0.506 17569 2003 1 4 . 1 1 18 18 THR CB C 172 69.498 69.498 68.863 0.635 17569 2004 1 4 . 1 1 18 18 THR H H 172 8.788 8.788 8.326 0.462 17569 2005 1 4 . 1 1 19 19 ALA N N 173 131.364 131.364 121.354 10.010 17569 2006 1 4 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.172 0.324 17569 2007 1 4 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.243 0.782 17569 2008 1 4 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.856 3.326 17569 2009 1 4 . 1 1 19 19 ALA H H 173 9.680 9.680 7.825 1.855 17569 2010 1 4 . 1 1 20 20 CYS N N 174 115.498 115.498 114.864 0.634 17569 2011 1 4 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.526 0.442 17569 2012 1 4 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.312 -1.218 17569 2013 1 4 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.460 4.784 17569 2014 1 4 . 1 1 20 20 CYS H H 174 8.470 8.470 7.663 0.807 17569 2015 1 4 . 1 1 21 21 GLY N N 175 112.464 112.464 109.166 3.298 17569 2016 1 4 . 1 1 21 21 GLY CA C 175 45.706 45.706 44.982 0.724 17569 2017 1 4 . 1 1 21 21 GLY H H 175 7.884 7.884 8.013 -0.129 17569 2018 1 4 . 1 1 22 22 GLN N N 176 121.784 121.784 118.217 3.567 17569 2019 1 4 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.506 -0.130 17569 2020 1 4 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.191 2.100 17569 2021 1 4 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.020 -2.679 17569 2022 1 4 . 1 1 22 22 GLN H H 176 8.723 8.723 7.981 0.742 17569 2023 1 4 . 1 1 23 23 GLN N N 177 122.900 122.900 122.352 0.548 17569 2024 1 4 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.269 0.261 17569 2025 1 4 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.442 0.108 17569 2026 1 4 . 1 1 23 23 GLN CB C 177 28.460 28.460 28.670 -0.210 17569 2027 1 4 . 1 1 23 23 GLN H H 177 8.721 8.721 8.578 0.143 17569 2028 1 4 . 1 1 24 24 VAL N N 178 121.000 121.000 124.995 -3.995 17569 2029 1 4 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.930 0.594 17569 2030 1 4 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.548 -2.671 17569 2031 1 4 . 1 1 24 24 VAL H H 178 8.689 8.689 7.803 0.886 17569 2032 1 4 . 1 1 25 25 ASN N N 179 121.392 121.392 123.507 -2.115 17569 2033 1 4 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.358 0.518 17569 2034 1 4 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.882 -2.732 17569 2035 1 4 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.395 -0.418 17569 2036 1 4 . 1 1 25 25 ASN H H 179 8.635 8.635 7.942 0.693 17569 2037 1 4 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.738 -0.278 17569 2038 1 4 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.970 0.028 17569 2039 1 4 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.643 -1.250 17569 2040 1 4 . 1 1 28 28 GLN N N 182 119.300 119.300 121.717 -2.417 17569 2041 1 4 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.403 0.115 17569 2042 1 4 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.642 -2.300 17569 2043 1 4 . 1 1 28 28 GLN CB C 182 30.350 30.350 29.989 0.361 17569 2044 1 4 . 1 1 28 28 GLN H H 182 7.494 7.494 8.284 -0.790 17569 2045 1 4 . 1 1 29 29 LYS N N 183 124.516 124.516 125.347 -0.831 17569 2046 1 4 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.564 -0.642 17569 2047 1 4 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.364 1.948 17569 2048 1 4 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.505 -0.219 17569 2049 1 4 . 1 1 29 29 LYS H H 183 8.779 8.779 8.606 0.173 17569 2050 1 4 . 1 1 30 30 ASP N N 184 116.500 116.500 119.370 -2.870 17569 2051 1 4 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.895 -0.436 17569 2052 1 4 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.175 0.361 17569 2053 1 4 . 1 1 30 30 ASP CB C 184 39.971 39.971 42.263 -2.292 17569 2054 1 4 . 1 1 30 30 ASP H H 184 8.556 8.556 8.086 0.470 17569 2055 1 4 . 1 1 31 31 SER N N 185 111.505 111.505 114.153 -2.648 17569 2056 1 4 . 1 1 31 31 SER HA H 185 4.695 4.695 4.783 -0.088 17569 2057 1 4 . 1 1 31 31 SER CA C 185 59.747 59.747 58.659 1.088 17569 2058 1 4 . 1 1 31 31 SER CB C 185 65.198 65.198 64.576 0.622 17569 2059 1 4 . 1 1 31 31 SER H H 185 7.933 7.933 8.594 -0.661 17569 2060 1 4 . 1 1 32 32 ILE N N 186 113.394 113.394 116.355 -2.961 17569 2061 1 4 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.008 -0.122 17569 2062 1 4 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.554 -0.976 17569 2063 1 4 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.825 0.987 17569 2064 1 4 . 1 1 32 32 ILE H H 186 7.105 7.105 7.606 -0.501 17569 2065 1 4 . 1 1 33 33 TYR N N 187 119.098 119.098 120.691 -1.593 17569 2066 1 4 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.154 -0.631 17569 2067 1 4 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.969 1.291 17569 2068 1 4 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.627 2.813 17569 2069 1 4 . 1 1 33 33 TYR H H 187 8.954 8.954 7.901 1.053 17569 2070 1 4 . 1 1 34 34 ARG N N 188 118.502 118.502 122.494 -3.992 17569 2071 1 4 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.845 -0.208 17569 2072 1 4 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.228 -1.476 17569 2073 1 4 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.152 1.099 17569 2074 1 4 . 1 1 34 34 ARG H H 188 8.412 8.412 8.526 -0.114 17569 2075 1 4 . 1 1 35 35 HIS N N 189 126.596 126.596 127.634 -1.038 17569 2076 1 4 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.905 -0.313 17569 2077 1 4 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.843 -0.122 17569 2078 1 4 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.116 1.356 17569 2079 1 4 . 1 1 35 35 HIS H H 189 9.813 9.813 9.094 0.719 17569 2080 1 4 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.561 -0.263 17569 2081 1 4 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.834 0.442 17569 2082 1 4 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.129 0.722 17569 2083 1 4 . 1 1 37 37 SER N N 191 110.003 110.003 113.885 -3.882 17569 2084 1 4 . 1 1 37 37 SER HA H 191 4.918 4.918 4.300 0.618 17569 2085 1 4 . 1 1 37 37 SER CA C 191 59.031 59.031 60.980 -1.949 17569 2086 1 4 . 1 1 37 37 SER CB C 191 65.104 65.104 63.281 1.823 17569 2087 1 4 . 1 1 37 37 SER H H 191 8.934 8.934 8.534 0.400 17569 2088 1 4 . 1 1 38 38 LEU N N 192 120.959 120.959 114.124 6.835 17569 2089 1 4 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.910 -0.781 17569 2090 1 4 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.260 1.886 17569 2091 1 4 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.464 1.532 17569 2092 1 4 . 1 1 38 38 LEU H H 192 8.649 8.649 7.026 1.623 17569 2093 1 4 . 1 1 39 39 GLN N N 193 108.600 108.600 119.279 -10.679 17569 2094 1 4 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.079 -0.174 17569 2095 1 4 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.594 0.220 17569 2096 1 4 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.817 -1.783 17569 2097 1 4 . 1 1 39 39 GLN H H 193 8.465 8.465 7.831 0.634 17569 2098 1 4 . 1 1 40 40 VAL N N 194 105.325 105.325 118.873 -13.548 17569 2099 1 4 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.466 0.084 17569 2100 1 4 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.227 -1.585 17569 2101 1 4 . 1 1 40 40 VAL H H 194 6.256 6.256 7.801 -1.545 17569 2102 1 4 . 1 1 41 41 LEU N N 195 123.100 123.100 122.013 1.087 17569 2103 1 4 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.822 -0.006 17569 2104 1 4 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.583 3.599 17569 2105 1 4 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.284 0.286 17569 2106 1 4 . 1 1 41 41 LEU H H 195 9.154 9.154 8.464 0.690 17569 2107 1 4 . 1 1 42 42 ILE N N 196 124.396 124.396 117.064 7.332 17569 2108 1 4 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.835 1.517 17569 2109 1 4 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.276 0.953 17569 2110 1 4 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.870 1.400 17569 2111 1 4 . 1 1 42 42 ILE H H 196 9.766 9.766 7.807 1.959 17569 2112 1 4 . 1 1 43 43 CYS N N 197 121.500 121.500 115.015 6.485 17569 2113 1 4 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.236 0.026 17569 2114 1 4 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.104 0.599 17569 2115 1 4 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.292 2.008 17569 2116 1 4 . 1 1 43 43 CYS H H 197 9.882 9.882 8.313 1.569 17569 2117 1 4 . 1 1 44 44 LYS N N 198 117.995 117.995 122.086 -4.091 17569 2118 1 4 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.147 -0.158 17569 2119 1 4 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.125 -0.465 17569 2120 1 4 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.315 0.385 17569 2121 1 4 . 1 1 44 44 LYS H H 198 8.089 8.089 8.562 -0.473 17569 2122 1 4 . 1 1 45 45 ASN N N 199 119.200 119.200 117.590 1.610 17569 2123 1 4 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.608 -0.094 17569 2124 1 4 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.096 0.624 17569 2125 1 4 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.130 0.037 17569 2126 1 4 . 1 1 45 45 ASN H H 199 8.356 8.356 8.573 -0.217 17569 2127 1 4 . 1 1 46 46 CYS N N 200 126.600 126.600 118.474 8.126 17569 2128 1 4 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.989 0.192 17569 2129 1 4 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.137 2.358 17569 2130 1 4 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.157 2.026 17569 2131 1 4 . 1 1 46 46 CYS H H 200 9.189 9.189 7.922 1.267 17569 2132 1 4 . 1 1 47 47 PHE N N 201 121.962 121.962 120.320 1.642 17569 2133 1 4 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.178 -0.308 17569 2134 1 4 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.908 1.361 17569 2135 1 4 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.551 0.616 17569 2136 1 4 . 1 1 47 47 PHE H H 201 8.826 8.826 7.957 0.869 17569 2137 1 4 . 1 1 48 48 LYS N N 202 117.400 117.400 120.529 -3.129 17569 2138 1 4 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.950 -0.252 17569 2139 1 4 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.279 -0.327 17569 2140 1 4 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.079 -0.537 17569 2141 1 4 . 1 1 48 48 LYS H H 202 8.512 8.512 8.041 0.471 17569 2142 1 4 . 1 1 49 49 TYR N N 203 120.400 120.400 120.256 0.144 17569 2143 1 4 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.161 0.253 17569 2144 1 4 . 1 1 49 49 TYR CA C 203 60.772 60.772 62.075 -1.302 17569 2145 1 4 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.684 -0.239 17569 2146 1 4 . 1 1 49 49 TYR H H 203 8.133 8.133 7.708 0.425 17569 2147 1 4 . 1 1 50 50 TYR N N 204 121.783 121.783 118.060 3.723 17569 2148 1 4 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.606 -1.111 17569 2149 1 4 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.923 3.027 17569 2150 1 4 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.713 0.779 17569 2151 1 4 . 1 1 50 50 TYR H H 204 8.765 8.765 7.664 1.101 17569 2152 1 4 . 1 1 51 51 MET N N 205 110.800 110.800 115.860 -5.060 17569 2153 1 4 . 1 1 51 51 MET HA H 205 4.349 4.349 4.225 0.124 17569 2154 1 4 . 1 1 51 51 MET CA C 205 53.505 53.505 57.108 -3.603 17569 2155 1 4 . 1 1 51 51 MET CB C 205 30.384 30.384 32.440 -2.056 17569 2156 1 4 . 1 1 51 51 MET H H 205 7.771 7.771 8.532 -0.761 17569 2157 1 4 . 1 1 52 52 SER N N 206 116.800 116.800 112.894 3.906 17569 2158 1 4 . 1 1 52 52 SER HA H 206 3.919 3.919 4.336 -0.417 17569 2159 1 4 . 1 1 52 52 SER CA C 206 61.621 61.621 60.230 1.391 17569 2160 1 4 . 1 1 52 52 SER CB C 206 62.611 62.611 64.217 -1.606 17569 2161 1 4 . 1 1 52 52 SER H H 206 7.581 7.581 8.342 -0.761 17569 2162 1 4 . 1 1 53 53 ASP N N 207 117.400 117.400 120.888 -3.488 17569 2163 1 4 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.753 -0.181 17569 2164 1 4 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.336 -0.236 17569 2165 1 4 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.707 0.481 17569 2166 1 4 . 1 1 53 53 ASP H H 207 7.085 7.085 8.005 -0.920 17569 2167 1 4 . 1 1 54 54 ASP N N 208 119.405 119.405 122.792 -3.387 17569 2168 1 4 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.948 -0.559 17569 2169 1 4 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.295 0.605 17569 2170 1 4 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.833 -1.484 17569 2171 1 4 . 1 1 54 54 ASP H H 208 8.439 8.439 8.408 0.031 17569 2172 1 4 . 1 1 55 55 ILE N N 209 124.698 124.698 120.515 4.183 17569 2173 1 4 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.275 -0.275 17569 2174 1 4 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.396 1.882 17569 2175 1 4 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.402 0.889 17569 2176 1 4 . 1 1 55 55 ILE H H 209 8.128 8.128 8.354 -0.226 17569 2177 1 4 . 1 1 56 56 SER N N 210 126.703 126.703 118.994 7.709 17569 2178 1 4 . 1 1 56 56 SER HA H 210 4.365 4.365 4.753 -0.388 17569 2179 1 4 . 1 1 56 56 SER CA C 210 57.769 57.769 57.592 0.177 17569 2180 1 4 . 1 1 56 56 SER CB C 210 64.991 64.991 64.155 0.836 17569 2181 1 4 . 1 1 56 56 SER H H 210 8.815 8.815 8.660 0.155 17569 2182 1 4 . 1 1 57 57 ARG N N 211 116.885 116.885 119.417 -2.532 17569 2183 1 4 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.544 0.498 17569 2184 1 4 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.259 -0.859 17569 2185 1 4 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.901 2.383 17569 2186 1 4 . 1 1 57 57 ARG H H 211 8.365 8.365 8.411 -0.046 17569 2187 1 4 . 1 1 58 58 ASP N N 212 121.982 121.982 120.096 1.886 17569 2188 1 4 . 1 1 58 58 ASP HA H 212 4.615 4.615 5.005 -0.390 17569 2189 1 4 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.646 -1.424 17569 2190 1 4 . 1 1 58 58 ASP CB C 212 41.502 41.502 41.734 -0.232 17569 2191 1 4 . 1 1 58 58 ASP H H 212 8.706 8.706 8.585 0.121 17569 2192 1 4 . 1 1 59 59 SER N N 213 114.164 114.164 115.173 -1.009 17569 2193 1 4 . 1 1 59 59 SER HA H 213 4.212 4.212 4.256 -0.044 17569 2194 1 4 . 1 1 59 59 SER CA C 213 60.840 60.840 61.171 -0.331 17569 2195 1 4 . 1 1 59 59 SER CB C 213 62.714 62.714 63.002 -0.288 17569 2196 1 4 . 1 1 59 59 SER H H 213 8.687 8.687 8.544 0.143 17569 2197 1 4 . 1 1 60 60 ASP N N 214 120.899 120.899 118.811 2.088 17569 2198 1 4 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.833 -0.008 17569 2199 1 4 . 1 1 60 60 ASP CA C 214 54.211 54.211 52.868 1.343 17569 2200 1 4 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.226 1.332 17569 2201 1 4 . 1 1 60 60 ASP H H 214 8.193 8.193 7.764 0.429 17569 2202 1 4 . 1 1 61 61 GLY N N 215 108.300 108.300 107.786 0.514 17569 2203 1 4 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.877 -0.480 17569 2204 1 4 . 1 1 61 61 GLY H H 215 8.234 8.234 7.805 0.429 17569 2205 1 4 . 1 1 62 62 MET N N 216 120.002 120.002 117.959 2.043 17569 2206 1 4 . 1 1 62 62 MET HA H 216 4.972 4.972 4.645 0.327 17569 2207 1 4 . 1 1 62 62 MET CA C 216 53.151 53.151 54.796 -1.645 17569 2208 1 4 . 1 1 62 62 MET CB C 216 32.311 32.311 32.916 -0.605 17569 2209 1 4 . 1 1 62 62 MET H H 216 8.376 8.376 7.760 0.616 17569 2210 1 4 . 1 1 63 63 ASP N N 217 127.300 127.300 118.140 9.160 17569 2211 1 4 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.308 0.658 17569 2212 1 4 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.522 0.048 17569 2213 1 4 . 1 1 63 63 ASP H H 217 9.368 9.368 7.985 1.383 17569 2214 1 4 . 1 1 64 64 GLU N N 218 114.400 114.400 124.330 -9.930 17569 2215 1 4 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.461 -0.305 17569 2216 1 4 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.866 -0.016 17569 2217 1 4 . 1 1 64 64 GLU H H 218 8.583 8.583 8.240 0.343 17569 2218 1 4 . 1 1 65 65 GLN N N 219 115.500 115.500 116.886 -1.386 17569 2219 1 4 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.486 -0.175 17569 2220 1 4 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.225 0.121 17569 2221 1 4 . 1 1 65 65 GLN H H 219 7.158 7.158 7.591 -0.433 17569 2222 1 4 . 1 1 66 66 CYS N N 220 122.600 122.600 117.997 4.603 17569 2223 1 4 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.254 -1.177 17569 2224 1 4 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.351 1.178 17569 2225 1 4 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.448 1.524 17569 2226 1 4 . 1 1 66 66 CYS H H 220 8.248 8.248 8.360 -0.112 17569 2227 1 4 . 1 1 67 67 ARG N N 221 130.363 130.363 124.359 6.004 17569 2228 1 4 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.434 -0.367 17569 2229 1 4 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.543 -2.527 17569 2230 1 4 . 1 1 67 67 ARG H H 221 9.145 9.145 8.582 0.563 17569 2231 1 4 . 1 1 68 68 TRP N N 222 124.200 124.200 120.672 3.528 17569 2232 1 4 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.744 -0.308 17569 2233 1 4 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.519 0.562 17569 2234 1 4 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.417 0.777 17569 2235 1 4 . 1 1 68 68 TRP H H 222 9.689 9.689 8.198 1.491 17569 2236 1 4 . 1 1 69 69 CYS N N 223 116.297 116.297 111.516 4.781 17569 2237 1 4 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.118 -0.027 17569 2238 1 4 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.554 2.548 17569 2239 1 4 . 1 1 69 69 CYS CB C 223 32.338 32.338 26.807 5.531 17569 2240 1 4 . 1 1 69 69 CYS H H 223 8.822 8.822 7.857 0.965 17569 2241 1 4 . 1 1 70 70 ALA N N 224 123.112 123.112 123.543 -0.431 17569 2242 1 4 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.265 0.141 17569 2243 1 4 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.553 -0.702 17569 2244 1 4 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.614 0.105 17569 2245 1 4 . 1 1 70 70 ALA H H 224 8.787 8.787 8.154 0.633 17569 2246 1 4 . 1 1 71 71 GLU N N 225 118.300 118.300 120.652 -2.352 17569 2247 1 4 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.480 0.828 17569 2248 1 4 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.688 -2.389 17569 2249 1 4 . 1 1 71 71 GLU H H 225 8.541 8.541 8.219 0.322 17569 2250 1 4 . 1 1 72 72 GLY N N 226 111.995 111.995 109.605 2.390 17569 2251 1 4 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.857 -0.454 17569 2252 1 4 . 1 1 72 72 GLY H H 226 9.837 9.837 8.492 1.345 17569 2253 1 4 . 1 1 73 73 GLY N N 227 106.600 106.600 107.359 -0.759 17569 2254 1 4 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.036 0.935 17569 2255 1 4 . 1 1 73 73 GLY H H 227 7.772 7.772 8.242 -0.470 17569 2256 1 4 . 1 1 74 74 ASN N N 228 124.277 124.277 119.200 5.077 17569 2257 1 4 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.455 0.626 17569 2258 1 4 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.848 -0.748 17569 2259 1 4 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.278 -0.194 17569 2260 1 4 . 1 1 74 74 ASN H H 228 8.876 8.876 8.549 0.327 17569 2261 1 4 . 1 1 75 75 LEU N N 229 123.050 123.050 121.402 1.648 17569 2262 1 4 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.794 -0.194 17569 2263 1 4 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.462 0.901 17569 2264 1 4 . 1 1 75 75 LEU CB C 229 43.500 43.500 42.949 0.551 17569 2265 1 4 . 1 1 75 75 LEU H H 229 8.901 8.901 8.004 0.897 17569 2266 1 4 . 1 1 76 76 ILE N N 230 123.552 123.552 123.886 -0.334 17569 2267 1 4 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.055 0.430 17569 2268 1 4 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.733 -1.033 17569 2269 1 4 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.840 -0.441 17569 2270 1 4 . 1 1 76 76 ILE H H 230 9.406 9.406 9.246 0.160 17569 2271 1 4 . 1 1 77 77 CYS N N 231 124.637 124.637 124.374 0.263 17569 2272 1 4 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.562 -0.687 17569 2273 1 4 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.027 1.332 17569 2274 1 4 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.027 0.407 17569 2275 1 4 . 1 1 77 77 CYS H H 231 8.809 8.809 8.408 0.401 17569 2276 1 4 . 1 1 78 78 CYS N N 232 125.697 125.697 122.676 3.021 17569 2277 1 4 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.802 -0.518 17569 2278 1 4 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.736 3.148 17569 2279 1 4 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.773 1.397 17569 2280 1 4 . 1 1 78 78 CYS H H 232 8.579 8.579 8.777 -0.198 17569 2281 1 4 . 1 1 79 79 ASP N N 233 123.600 123.600 124.370 -0.770 17569 2282 1 4 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.600 0.157 17569 2283 1 4 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.182 2.807 17569 2284 1 4 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.193 1.436 17569 2285 1 4 . 1 1 79 79 ASP H H 233 8.577 8.577 8.174 0.403 17569 2286 1 4 . 1 1 80 80 PHE N N 234 122.100 122.100 117.149 4.951 17569 2287 1 4 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.689 -0.163 17569 2288 1 4 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.605 1.304 17569 2289 1 4 . 1 1 80 80 PHE CB C 234 41.849 41.849 39.946 1.903 17569 2290 1 4 . 1 1 80 80 PHE H H 234 10.432 10.432 7.527 2.905 17569 2291 1 4 . 1 1 81 81 CYS N N 235 124.300 124.300 117.570 6.730 17569 2292 1 4 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.842 0.314 17569 2293 1 4 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.209 -0.164 17569 2294 1 4 . 1 1 81 81 CYS CB C 235 31.407 31.407 28.078 3.329 17569 2295 1 4 . 1 1 81 81 CYS H H 235 8.476 8.476 8.150 0.326 17569 2296 1 4 . 1 1 82 82 HIS N N 236 112.598 112.598 118.471 -5.873 17569 2297 1 4 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.155 0.828 17569 2298 1 4 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.876 -1.478 17569 2299 1 4 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.658 2.599 17569 2300 1 4 . 1 1 82 82 HIS H H 236 6.699 6.699 8.503 -1.804 17569 2301 1 4 . 1 1 83 83 ASN N N 237 123.600 123.600 118.925 4.675 17569 2302 1 4 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.940 -0.139 17569 2303 1 4 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.461 2.155 17569 2304 1 4 . 1 1 83 83 ASN H H 237 9.097 9.097 7.920 1.177 17569 2305 1 4 . 1 1 84 84 ALA N N 238 122.000 122.000 123.704 -1.704 17569 2306 1 4 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.379 0.030 17569 2307 1 4 . 1 1 84 84 ALA CA C 238 50.364 50.364 49.964 0.400 17569 2308 1 4 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.174 2.896 17569 2309 1 4 . 1 1 84 84 ALA H H 238 9.885 9.885 8.479 1.406 17569 2310 1 4 . 1 1 85 85 PHE N N 239 116.707 116.707 121.474 -4.767 17569 2311 1 4 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.141 0.887 17569 2312 1 4 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.611 -0.394 17569 2313 1 4 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.893 1.771 17569 2314 1 4 . 1 1 85 85 PHE H H 239 9.450 9.450 9.154 0.296 17569 2315 1 4 . 1 1 86 86 CYS N N 240 126.682 126.682 124.793 1.889 17569 2316 1 4 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.716 0.906 17569 2317 1 4 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.806 -0.464 17569 2318 1 4 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.343 2.914 17569 2319 1 4 . 1 1 86 86 CYS H H 240 11.309 11.309 9.468 1.841 17569 2320 1 4 . 1 1 87 87 LYS N N 241 117.865 117.865 124.289 -6.424 17569 2321 1 4 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.946 -0.097 17569 2322 1 4 . 1 1 87 87 LYS CA C 241 60.070 60.070 59.985 0.085 17569 2323 1 4 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.458 0.341 17569 2324 1 4 . 1 1 87 87 LYS H H 241 8.230 8.230 8.787 -0.557 17569 2325 1 4 . 1 1 88 88 LYS N N 242 117.949 117.949 118.062 -0.113 17569 2326 1 4 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.104 -0.126 17569 2327 1 4 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.290 1.080 17569 2328 1 4 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.095 0.221 17569 2329 1 4 . 1 1 88 88 LYS H H 242 7.945 7.945 8.562 -0.618 17569 2330 1 4 . 1 1 89 89 CYS N N 243 125.305 125.305 117.905 7.400 17569 2331 1 4 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.302 -0.560 17569 2332 1 4 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.812 2.015 17569 2333 1 4 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.304 0.937 17569 2334 1 4 . 1 1 89 89 CYS H H 243 9.297 9.297 7.662 1.635 17569 2335 1 4 . 1 1 90 90 ILE N N 244 119.687 119.687 121.517 -1.830 17569 2336 1 4 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.919 -0.312 17569 2337 1 4 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.667 0.283 17569 2338 1 4 . 1 1 90 90 ILE H H 244 7.997 7.997 7.683 0.314 17569 2339 1 4 . 1 1 91 91 LEU N N 245 120.280 120.280 120.698 -0.418 17569 2340 1 4 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.279 -0.594 17569 2341 1 4 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.563 0.672 17569 2342 1 4 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.086 -0.128 17569 2343 1 4 . 1 1 91 91 LEU H H 245 8.810 8.810 8.807 0.003 17569 2344 1 4 . 1 1 92 92 ARG N N 246 116.901 116.901 117.566 -0.665 17569 2345 1 4 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.081 -0.264 17569 2346 1 4 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.454 0.526 17569 2347 1 4 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.183 0.417 17569 2348 1 4 . 1 1 92 92 ARG H H 246 8.086 8.086 7.587 0.499 17569 2349 1 4 . 1 1 93 93 ASN N N 247 111.200 111.200 116.029 -4.829 17569 2350 1 4 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.517 0.086 17569 2351 1 4 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.835 0.973 17569 2352 1 4 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.050 3.434 17569 2353 1 4 . 1 1 93 93 ASN H H 247 7.136 7.136 8.166 -1.030 17569 2354 1 4 . 1 1 94 94 LEU N N 248 118.807 118.807 117.377 1.430 17569 2355 1 4 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.353 0.461 17569 2356 1 4 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.035 0.154 17569 2357 1 4 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.601 0.097 17569 2358 1 4 . 1 1 94 94 LEU H H 248 8.515 8.515 7.951 0.564 17569 2359 1 4 . 1 1 95 95 GLY N N 249 108.000 108.000 106.459 1.541 17569 2360 1 4 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.574 0.054 17569 2361 1 4 . 1 1 95 95 GLY H H 249 7.955 7.955 7.607 0.348 17569 2362 1 4 . 1 1 96 96 ARG N N 250 117.797 117.797 121.033 -3.236 17569 2363 1 4 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.296 -0.453 17569 2364 1 4 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.338 0.344 17569 2365 1 4 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.178 -0.318 17569 2366 1 4 . 1 1 96 96 ARG H H 250 8.559 8.559 8.690 -0.131 17569 2367 1 4 . 1 1 97 97 LYS N N 251 120.900 120.900 119.721 1.179 17569 2368 1 4 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.011 0.145 17569 2369 1 4 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.624 -0.468 17569 2370 1 4 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.736 -0.376 17569 2371 1 4 . 1 1 97 97 LYS H H 251 8.655 8.655 8.507 0.148 17569 2372 1 4 . 1 1 98 98 GLU N N 252 122.000 122.000 118.924 3.076 17569 2373 1 4 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.065 0.286 17569 2374 1 4 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.921 -1.339 17569 2375 1 4 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.273 -0.874 17569 2376 1 4 . 1 1 98 98 GLU H H 252 7.705 7.705 8.416 -0.711 17569 2377 1 4 . 1 1 99 99 LEU N N 253 117.400 117.400 120.942 -3.542 17569 2378 1 4 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.795 0.122 17569 2379 1 4 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.246 -0.248 17569 2380 1 4 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.804 -0.322 17569 2381 1 4 . 1 1 99 99 LEU H H 253 7.285 7.285 7.604 -0.319 17569 2382 1 4 . 1 1 100 100 SER N N 254 112.100 112.100 114.320 -2.220 17569 2383 1 4 . 1 1 100 100 SER HA H 254 4.107 4.107 4.114 -0.007 17569 2384 1 4 . 1 1 100 100 SER CA C 254 61.603 61.603 61.651 -0.048 17569 2385 1 4 . 1 1 100 100 SER CB C 254 62.622 62.622 63.030 -0.408 17569 2386 1 4 . 1 1 100 100 SER H H 254 8.326 8.326 8.147 0.179 17569 2387 1 4 . 1 1 101 101 THR N N 255 118.151 118.151 118.584 -0.433 17569 2388 1 4 . 1 1 101 101 THR HA H 255 4.026 4.026 4.076 -0.050 17569 2389 1 4 . 1 1 101 101 THR CA C 255 66.261 66.261 66.876 -0.615 17569 2390 1 4 . 1 1 101 101 THR CB C 255 68.735 68.735 68.800 -0.065 17569 2391 1 4 . 1 1 101 101 THR H H 255 7.972 7.972 7.958 0.014 17569 2392 1 4 . 1 1 102 102 ILE N N 256 120.100 120.100 122.984 -2.884 17569 2393 1 4 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.639 -0.176 17569 2394 1 4 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.770 0.004 17569 2395 1 4 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.502 0.239 17569 2396 1 4 . 1 1 102 102 ILE H H 256 7.868 7.868 8.590 -0.722 17569 2397 1 4 . 1 1 103 103 MET N N 257 114.876 114.876 117.276 -2.400 17569 2398 1 4 . 1 1 103 103 MET HA H 257 4.211 4.211 4.057 0.154 17569 2399 1 4 . 1 1 103 103 MET CA C 257 55.691 55.691 58.395 -2.704 17569 2400 1 4 . 1 1 103 103 MET CB C 257 32.000 32.000 32.949 -0.949 17569 2401 1 4 . 1 1 103 103 MET H H 257 7.606 7.606 7.292 0.314 17569 2402 1 4 . 1 1 104 104 ASP N N 258 119.976 119.976 118.562 1.414 17569 2403 1 4 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.810 -0.272 17569 2404 1 4 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.835 1.077 17569 2405 1 4 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.113 1.387 17569 2406 1 4 . 1 1 104 104 ASP H H 258 7.444 7.444 7.548 -0.104 17569 2407 1 4 . 1 1 105 105 GLU N N 259 124.388 124.388 120.789 3.599 17569 2408 1 4 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.511 -0.224 17569 2409 1 4 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.023 2.548 17569 2410 1 4 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.282 -0.740 17569 2411 1 4 . 1 1 105 105 GLU H H 259 8.559 8.559 8.058 0.501 17569 2412 1 4 . 1 1 106 106 ASN N N 260 117.201 117.201 117.667 -0.466 17569 2413 1 4 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.391 0.351 17569 2414 1 4 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.894 -0.151 17569 2415 1 4 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.647 1.271 17569 2416 1 4 . 1 1 106 106 ASN H H 260 8.673 8.673 8.737 -0.064 17569 2417 1 4 . 1 1 107 107 ASN N N 261 117.900 117.900 112.710 5.190 17569 2418 1 4 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.291 0.694 17569 2419 1 4 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.635 -2.333 17569 2420 1 4 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.251 3.363 17569 2421 1 4 . 1 1 107 107 ASN H H 261 7.956 7.956 8.716 -0.760 17569 2422 1 4 . 1 1 108 108 GLN N N 262 121.500 121.500 114.920 6.580 17569 2423 1 4 . 1 1 108 108 GLN HA H 262 4.608 4.608 3.958 0.650 17569 2424 1 4 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.838 0.938 17569 2425 1 4 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.779 0.779 17569 2426 1 4 . 1 1 108 108 GLN H H 262 8.493 8.493 7.580 0.913 17569 2427 1 4 . 1 1 109 109 TRP N N 263 128.056 128.056 122.591 5.465 17569 2428 1 4 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.673 0.298 17569 2429 1 4 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.622 0.475 17569 2430 1 4 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.067 0.426 17569 2431 1 4 . 1 1 109 109 TRP H H 263 10.497 10.497 7.981 2.516 17569 2432 1 4 . 1 1 110 110 TYR N N 264 126.600 126.600 125.581 1.019 17569 2433 1 4 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.335 0.067 17569 2434 1 4 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.808 -2.137 17569 2435 1 4 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.273 -1.265 17569 2436 1 4 . 1 1 110 110 TYR H H 264 7.545 7.545 8.173 -0.628 17569 2437 1 4 . 1 1 111 111 CYS N N 265 124.622 124.622 114.529 10.093 17569 2438 1 4 . 1 1 111 111 CYS H H 265 8.586 8.586 8.400 0.186 17569 2439 1 4 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.808 -0.616 17569 2440 1 4 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.639 1.076 17569 2441 1 4 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.612 1.308 17569 2442 1 4 . 1 1 113 113 ILE N N 267 119.504 119.504 119.692 -0.188 17569 2443 1 4 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.692 -0.742 17569 2444 1 4 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.988 0.261 17569 2445 1 4 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.565 -3.032 17569 2446 1 4 . 1 1 113 113 ILE H H 267 9.160 9.160 7.500 1.660 17569 2447 1 4 . 1 1 114 114 CYS N N 268 124.100 124.100 118.374 5.726 17569 2448 1 4 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.184 -0.370 17569 2449 1 4 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.676 3.624 17569 2450 1 4 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.109 2.612 17569 2451 1 4 . 1 1 114 114 CYS H H 268 7.818 7.818 8.258 -0.440 17569 2452 1 4 . 1 1 115 115 HIS N N 269 117.127 117.127 111.198 5.929 17569 2453 1 4 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.667 0.462 17569 2454 1 4 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.053 -0.893 17569 2455 1 4 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.800 2.392 17569 2456 1 4 . 1 1 115 115 HIS H H 269 8.953 8.953 7.811 1.142 17569 2457 1 4 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.470 0.472 17569 2458 1 4 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.575 -0.267 17569 2459 1 4 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.433 1.208 17569 2460 1 4 . 1 1 117 117 GLU N N 271 123.504 123.504 123.030 0.474 17569 2461 1 4 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.333 -0.313 17569 2462 1 4 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.201 3.668 17569 2463 1 4 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.003 -1.952 17569 2464 1 4 . 1 1 117 117 GLU H H 271 8.402 8.402 8.099 0.303 17569 2465 1 4 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.547 -0.005 17569 2466 1 4 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.706 1.653 17569 2467 1 4 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.491 0.651 17569 2468 1 4 . 1 1 119 119 LEU N N 273 112.296 112.296 114.357 -2.061 17569 2469 1 4 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.906 -0.432 17569 2470 1 4 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.416 0.126 17569 2471 1 4 . 1 1 119 119 LEU H H 273 8.090 8.090 7.442 0.648 17569 2472 1 4 . 1 1 120 120 LEU N N 274 121.388 121.388 122.827 -1.439 17569 2473 1 4 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.919 0.108 17569 2474 1 4 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.567 -0.266 17569 2475 1 4 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.748 0.352 17569 2476 1 4 . 1 1 120 120 LEU H H 274 7.823 7.823 8.041 -0.218 17569 2477 1 4 . 1 1 121 121 ASP N N 275 118.600 118.600 118.707 -0.107 17569 2478 1 4 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.312 0.229 17569 2479 1 4 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.362 0.341 17569 2480 1 4 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.601 -1.158 17569 2481 1 4 . 1 1 121 121 ASP H H 275 8.694 8.694 8.465 0.229 17569 2482 1 4 . 1 1 122 122 LEU N N 276 123.192 123.192 120.313 2.879 17569 2483 1 4 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.980 0.412 17569 2484 1 4 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.232 -0.261 17569 2485 1 4 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.055 0.487 17569 2486 1 4 . 1 1 122 122 LEU H H 276 8.013 8.013 7.386 0.627 17569 2487 1 4 . 1 1 123 123 VAL N N 277 126.898 126.898 118.845 8.053 17569 2488 1 4 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.620 0.235 17569 2489 1 4 . 1 1 123 123 VAL CA C 277 66.663 66.663 67.359 -0.696 17569 2490 1 4 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.552 0.506 17569 2491 1 4 . 1 1 123 123 VAL H H 277 8.781 8.781 7.799 0.982 17569 2492 1 4 . 1 1 124 124 THR N N 278 117.500 117.500 116.441 1.059 17569 2493 1 4 . 1 1 124 124 THR HA H 278 4.030 4.030 3.868 0.162 17569 2494 1 4 . 1 1 124 124 THR CA C 278 66.589 66.589 67.272 -0.683 17569 2495 1 4 . 1 1 124 124 THR CB C 278 68.410 68.410 68.498 -0.088 17569 2496 1 4 . 1 1 124 124 THR H H 278 8.722 8.722 8.237 0.485 17569 2497 1 4 . 1 1 125 125 ALA N N 279 124.700 124.700 124.303 0.397 17569 2498 1 4 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.092 0.169 17569 2499 1 4 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.793 0.503 17569 2500 1 4 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.105 -0.156 17569 2501 1 4 . 1 1 125 125 ALA H H 279 8.239 8.239 7.860 0.379 17569 2502 1 4 . 1 1 126 126 CYS N N 280 119.276 119.276 118.115 1.161 17569 2503 1 4 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.981 0.133 17569 2504 1 4 . 1 1 126 126 CYS CA C 280 62.103 62.103 62.380 -0.277 17569 2505 1 4 . 1 1 126 126 CYS CB C 280 26.496 26.496 26.655 -0.159 17569 2506 1 4 . 1 1 126 126 CYS H H 280 8.128 8.128 7.819 0.309 17569 2507 1 4 . 1 1 127 127 ASN N N 281 118.000 118.000 118.389 -0.389 17569 2508 1 4 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.612 -0.052 17569 2509 1 4 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.619 -0.480 17569 2510 1 4 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.067 -1.102 17569 2511 1 4 . 1 1 127 127 ASN H H 281 8.725 8.725 7.959 0.766 17569 2512 1 4 . 1 1 128 128 SER N N 282 116.601 116.601 116.980 -0.379 17569 2513 1 4 . 1 1 128 128 SER HA H 282 4.363 4.363 4.225 0.138 17569 2514 1 4 . 1 1 128 128 SER CA C 282 61.899 61.899 62.123 -0.224 17569 2515 1 4 . 1 1 128 128 SER CB C 282 62.630 62.630 62.924 -0.294 17569 2516 1 4 . 1 1 128 128 SER H H 282 8.542 8.542 7.603 0.939 17569 2517 1 4 . 1 1 129 129 VAL N N 283 123.272 123.272 121.946 1.326 17569 2518 1 4 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.600 0.077 17569 2519 1 4 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.334 0.174 17569 2520 1 4 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.146 0.072 17569 2521 1 4 . 1 1 129 129 VAL H H 283 7.990 7.990 7.692 0.298 17569 2522 1 4 . 1 1 130 130 PHE N N 284 118.594 118.594 119.193 -0.599 17569 2523 1 4 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.263 -0.250 17569 2524 1 4 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.198 2.302 17569 2525 1 4 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.234 0.762 17569 2526 1 4 . 1 1 130 130 PHE H H 284 8.190 8.190 7.821 0.369 17569 2527 1 4 . 1 1 131 131 GLU N N 285 120.905 120.905 120.156 0.749 17569 2528 1 4 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.062 0.143 17569 2529 1 4 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.702 -0.488 17569 2530 1 4 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.360 0.140 17569 2531 1 4 . 1 1 131 131 GLU H H 285 8.699 8.699 8.970 -0.271 17569 2532 1 4 . 1 1 132 132 ASN N N 286 117.997 117.997 117.824 0.173 17569 2533 1 4 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.669 -0.074 17569 2534 1 4 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.063 -0.448 17569 2535 1 4 . 1 1 132 132 ASN CB C 286 38.852 38.852 39.134 -0.282 17569 2536 1 4 . 1 1 132 132 ASN H H 286 8.082 8.082 7.968 0.114 17569 2537 1 4 . 1 1 133 133 LEU N N 287 120.800 120.800 122.307 -1.507 17569 2538 1 4 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.354 -0.237 17569 2539 1 4 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.113 -0.315 17569 2540 1 4 . 1 1 133 133 LEU H H 287 7.904 7.904 8.631 -0.727 17569 2541 1 4 . 1 1 134 134 GLU N N 288 118.200 118.200 118.043 0.157 17569 2542 1 4 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.937 0.142 17569 2543 1 4 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.999 -1.002 17569 2544 1 4 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.129 0.113 17569 2545 1 4 . 1 1 134 134 GLU H H 288 8.157 8.157 8.611 -0.454 17569 2546 1 4 . 1 1 135 135 GLN N N 289 117.400 117.400 119.136 -1.736 17569 2547 1 4 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.162 0.012 17569 2548 1 4 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.291 -0.302 17569 2549 1 4 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.108 -0.028 17569 2550 1 4 . 1 1 135 135 GLN H H 289 7.869 7.869 7.673 0.196 17569 2551 1 4 . 1 1 136 136 LEU N N 290 121.000 121.000 121.614 -0.614 17569 2552 1 4 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.805 0.368 17569 2553 1 4 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.743 -0.605 17569 2554 1 4 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.650 0.350 17569 2555 1 4 . 1 1 136 136 LEU H H 290 7.968 7.968 7.612 0.356 17569 2556 1 4 . 1 1 137 137 LEU N N 291 118.900 118.900 119.885 -0.985 17569 2557 1 4 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.029 0.212 17569 2558 1 4 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.480 -1.120 17569 2559 1 4 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.310 -0.838 17569 2560 1 4 . 1 1 137 137 LEU H H 291 8.154 8.154 7.901 0.253 17569 2561 1 4 . 1 1 138 138 GLN N N 292 117.993 117.993 115.159 2.834 17569 2562 1 4 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.526 -0.254 17569 2563 1 4 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.947 1.685 17569 2564 1 4 . 1 1 138 138 GLN CB C 292 28.584 28.584 28.780 -0.196 17569 2565 1 4 . 1 1 138 138 GLN H H 292 7.896 7.896 7.648 0.248 17569 2566 1 4 . 1 1 139 139 GLN N N 293 118.889 118.889 119.736 -0.847 17569 2567 1 4 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.470 -0.201 17569 2568 1 4 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.542 0.911 17569 2569 1 4 . 1 1 139 139 GLN CB C 293 29.069 29.069 30.328 -1.259 17569 2570 1 4 . 1 1 139 139 GLN H H 293 8.091 8.091 7.550 0.541 17569 2571 1 4 . 1 1 140 140 ASN N N 294 118.604 118.604 120.063 -1.459 17569 2572 1 4 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.827 -0.068 17569 2573 1 4 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.525 0.696 17569 2574 1 4 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.077 -1.343 17569 2575 1 4 . 1 1 140 140 ASN H H 294 8.273 8.273 8.505 -0.232 17569 2576 1 4 . 1 1 141 141 LYS N N 295 121.685 121.685 122.391 -0.706 17569 2577 1 4 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.598 -0.238 17569 2578 1 4 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.573 -0.400 17569 2579 1 4 . 1 1 141 141 LYS CB C 295 32.535 32.535 32.905 -0.370 17569 2580 1 4 . 1 1 141 141 LYS H H 295 8.089 8.089 8.567 -0.478 17569 2581 1 5 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.744 -0.357 17569 2582 1 5 . 1 1 2 2 ALA CA C 156 52.445 52.445 51.995 0.450 17569 2583 1 5 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.384 -0.128 17569 2584 1 5 . 1 1 3 3 MET HA H 157 4.476 4.476 4.679 -0.203 17569 2585 1 5 . 1 1 3 3 MET CA C 157 55.401 55.401 55.672 -0.271 17569 2586 1 5 . 1 1 4 4 ALA N N 158 124.828 124.828 126.393 -1.565 17569 2587 1 5 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.629 -0.315 17569 2588 1 5 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.987 0.524 17569 2589 1 5 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.559 -1.558 17569 2590 1 5 . 1 1 4 4 ALA H H 158 8.382 8.382 8.290 0.092 17569 2591 1 5 . 1 1 5 5 ASP N N 159 119.418 119.418 122.083 -2.665 17569 2592 1 5 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.773 -0.183 17569 2593 1 5 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.520 -0.384 17569 2594 1 5 . 1 1 5 5 ASP CB C 159 41.015 41.015 40.908 0.107 17569 2595 1 5 . 1 1 5 5 ASP H H 159 8.312 8.312 8.600 -0.288 17569 2596 1 5 . 1 1 6 6 LYS N N 160 121.604 121.604 121.834 -0.230 17569 2597 1 5 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.615 -0.272 17569 2598 1 5 . 1 1 6 6 LYS H H 160 8.274 8.274 8.426 -0.152 17569 2599 1 5 . 1 1 7 7 ARG N N 161 121.611 121.611 121.155 0.456 17569 2600 1 5 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.478 -0.151 17569 2601 1 5 . 1 1 7 7 ARG H H 161 8.430 8.430 8.630 -0.200 17569 2602 1 5 . 1 1 8 8 GLY N N 162 109.606 109.606 113.099 -3.493 17569 2603 1 5 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.846 0.201 17569 2604 1 5 . 1 1 8 8 GLY H H 162 8.473 8.473 8.653 -0.180 17569 2605 1 5 . 1 1 9 9 ASP N N 163 120.187 120.187 119.741 0.446 17569 2606 1 5 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.921 -0.272 17569 2607 1 5 . 1 1 9 9 ASP CA C 163 54.151 54.151 52.880 1.272 17569 2608 1 5 . 1 1 9 9 ASP H H 163 8.296 8.296 7.891 0.405 17569 2609 1 5 . 1 1 10 10 GLY N N 164 108.816 108.816 108.269 0.547 17569 2610 1 5 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.416 -0.049 17569 2611 1 5 . 1 1 10 10 GLY H H 164 8.458 8.458 8.186 0.272 17569 2612 1 5 . 1 1 11 11 LEU N N 165 121.195 121.195 122.540 -1.345 17569 2613 1 5 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.757 -0.441 17569 2614 1 5 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.585 0.415 17569 2615 1 5 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.376 -2.444 17569 2616 1 5 . 1 1 11 11 LEU H H 165 8.137 8.137 7.773 0.364 17569 2617 1 5 . 1 1 12 12 HIS N N 166 119.387 119.387 119.080 0.307 17569 2618 1 5 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.953 -0.298 17569 2619 1 5 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.446 0.823 17569 2620 1 5 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.200 -0.502 17569 2621 1 5 . 1 1 12 12 HIS H H 166 8.270 8.270 8.106 0.164 17569 2622 1 5 . 1 1 13 13 GLY N N 167 109.899 109.899 110.955 -1.056 17569 2623 1 5 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.315 0.790 17569 2624 1 5 . 1 1 13 13 GLY H H 167 8.276 8.276 8.284 -0.008 17569 2625 1 5 . 1 1 14 14 ILE N N 168 119.597 119.597 120.849 -1.252 17569 2626 1 5 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.287 0.036 17569 2627 1 5 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.455 0.145 17569 2628 1 5 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.053 -2.103 17569 2629 1 5 . 1 1 14 14 ILE H H 168 7.962 7.962 8.022 -0.060 17569 2630 1 5 . 1 1 15 15 VAL N N 169 127.578 127.578 125.600 1.978 17569 2631 1 5 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.048 0.232 17569 2632 1 5 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.704 -1.387 17569 2633 1 5 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.320 3.083 17569 2634 1 5 . 1 1 15 15 VAL H H 169 9.011 9.011 8.494 0.517 17569 2635 1 5 . 1 1 16 16 SER N N 170 118.596 118.596 120.301 -1.705 17569 2636 1 5 . 1 1 16 16 SER HA H 170 5.140 5.140 4.620 0.520 17569 2637 1 5 . 1 1 16 16 SER CA C 170 55.985 55.985 56.633 -0.648 17569 2638 1 5 . 1 1 16 16 SER CB C 170 65.261 65.261 66.039 -0.778 17569 2639 1 5 . 1 1 16 16 SER H H 170 8.242 8.242 7.765 0.477 17569 2640 1 5 . 1 1 17 17 CYS N N 171 123.783 123.783 123.109 0.674 17569 2641 1 5 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.172 0.009 17569 2642 1 5 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.634 -0.790 17569 2643 1 5 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.646 2.727 17569 2644 1 5 . 1 1 17 17 CYS H H 171 8.894 8.894 8.520 0.374 17569 2645 1 5 . 1 1 18 18 THR N N 172 121.703 121.703 117.829 3.874 17569 2646 1 5 . 1 1 18 18 THR HA H 172 4.386 4.386 4.115 0.271 17569 2647 1 5 . 1 1 18 18 THR CA C 172 64.667 64.667 64.259 0.408 17569 2648 1 5 . 1 1 18 18 THR CB C 172 69.498 69.498 68.837 0.661 17569 2649 1 5 . 1 1 18 18 THR H H 172 8.788 8.788 8.276 0.512 17569 2650 1 5 . 1 1 19 19 ALA N N 173 131.364 131.364 121.343 10.021 17569 2651 1 5 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.118 0.378 17569 2652 1 5 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.510 0.515 17569 2653 1 5 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.514 3.668 17569 2654 1 5 . 1 1 19 19 ALA H H 173 9.680 9.680 8.046 1.634 17569 2655 1 5 . 1 1 20 20 CYS N N 174 115.498 115.498 114.508 0.990 17569 2656 1 5 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.722 0.246 17569 2657 1 5 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.486 -1.392 17569 2658 1 5 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.152 4.092 17569 2659 1 5 . 1 1 20 20 CYS H H 174 8.470 8.470 7.675 0.795 17569 2660 1 5 . 1 1 21 21 GLY N N 175 112.464 112.464 108.157 4.307 17569 2661 1 5 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.078 0.628 17569 2662 1 5 . 1 1 21 21 GLY H H 175 7.884 7.884 7.895 -0.011 17569 2663 1 5 . 1 1 22 22 GLN N N 176 121.784 121.784 118.382 3.402 17569 2664 1 5 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.411 -0.035 17569 2665 1 5 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.696 1.595 17569 2666 1 5 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.722 -2.381 17569 2667 1 5 . 1 1 22 22 GLN H H 176 8.723 8.723 7.936 0.787 17569 2668 1 5 . 1 1 23 23 GLN N N 177 122.900 122.900 123.125 -0.225 17569 2669 1 5 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.173 0.357 17569 2670 1 5 . 1 1 23 23 GLN CA C 177 56.550 56.550 57.014 -0.465 17569 2671 1 5 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.247 -0.787 17569 2672 1 5 . 1 1 23 23 GLN H H 177 8.721 8.721 8.593 0.128 17569 2673 1 5 . 1 1 24 24 VAL N N 178 121.000 121.000 125.481 -4.481 17569 2674 1 5 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.029 0.495 17569 2675 1 5 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.265 -2.388 17569 2676 1 5 . 1 1 24 24 VAL H H 178 8.689 8.689 7.872 0.817 17569 2677 1 5 . 1 1 25 25 ASN N N 179 121.392 121.392 123.494 -2.102 17569 2678 1 5 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.327 0.549 17569 2679 1 5 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.431 -2.281 17569 2680 1 5 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.450 -0.473 17569 2681 1 5 . 1 1 25 25 ASN H H 179 8.635 8.635 8.168 0.467 17569 2682 1 5 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.744 -0.284 17569 2683 1 5 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.730 0.268 17569 2684 1 5 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.859 -1.466 17569 2685 1 5 . 1 1 28 28 GLN N N 182 119.300 119.300 122.180 -2.880 17569 2686 1 5 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.453 0.065 17569 2687 1 5 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.106 -1.764 17569 2688 1 5 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.074 0.276 17569 2689 1 5 . 1 1 28 28 GLN H H 182 7.494 7.494 8.219 -0.725 17569 2690 1 5 . 1 1 29 29 LYS N N 183 124.516 124.516 124.729 -0.213 17569 2691 1 5 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.466 -0.544 17569 2692 1 5 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.238 2.074 17569 2693 1 5 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.516 -0.230 17569 2694 1 5 . 1 1 29 29 LYS H H 183 8.779 8.779 8.533 0.246 17569 2695 1 5 . 1 1 30 30 ASP N N 184 116.500 116.500 119.394 -2.894 17569 2696 1 5 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.752 -0.293 17569 2697 1 5 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.178 0.358 17569 2698 1 5 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.271 -1.300 17569 2699 1 5 . 1 1 30 30 ASP H H 184 8.556 8.556 8.210 0.346 17569 2700 1 5 . 1 1 31 31 SER N N 185 111.505 111.505 114.076 -2.571 17569 2701 1 5 . 1 1 31 31 SER HA H 185 4.695 4.695 4.764 -0.069 17569 2702 1 5 . 1 1 31 31 SER CA C 185 59.747 59.747 57.820 1.927 17569 2703 1 5 . 1 1 31 31 SER CB C 185 65.198 65.198 64.106 1.091 17569 2704 1 5 . 1 1 31 31 SER H H 185 7.933 7.933 8.485 -0.552 17569 2705 1 5 . 1 1 32 32 ILE N N 186 113.394 113.394 116.161 -2.767 17569 2706 1 5 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.046 -0.160 17569 2707 1 5 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.694 -1.115 17569 2708 1 5 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.522 1.290 17569 2709 1 5 . 1 1 32 32 ILE H H 186 7.105 7.105 7.540 -0.435 17569 2710 1 5 . 1 1 33 33 TYR N N 187 119.098 119.098 121.504 -2.406 17569 2711 1 5 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.145 -0.622 17569 2712 1 5 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.589 1.671 17569 2713 1 5 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.862 2.578 17569 2714 1 5 . 1 1 33 33 TYR H H 187 8.954 8.954 7.772 1.182 17569 2715 1 5 . 1 1 34 34 ARG N N 188 118.502 118.502 123.079 -4.577 17569 2716 1 5 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.809 -0.172 17569 2717 1 5 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.334 -1.582 17569 2718 1 5 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.516 0.735 17569 2719 1 5 . 1 1 34 34 ARG H H 188 8.412 8.412 8.520 -0.108 17569 2720 1 5 . 1 1 35 35 HIS N N 189 126.596 126.596 128.650 -2.054 17569 2721 1 5 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.940 -0.348 17569 2722 1 5 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.071 -0.350 17569 2723 1 5 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.206 1.266 17569 2724 1 5 . 1 1 35 35 HIS H H 189 9.813 9.813 9.175 0.638 17569 2725 1 5 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.559 -0.261 17569 2726 1 5 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.997 0.279 17569 2727 1 5 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.242 0.609 17569 2728 1 5 . 1 1 37 37 SER N N 191 110.003 110.003 114.211 -4.208 17569 2729 1 5 . 1 1 37 37 SER HA H 191 4.918 4.918 4.296 0.622 17569 2730 1 5 . 1 1 37 37 SER CA C 191 59.031 59.031 61.010 -1.979 17569 2731 1 5 . 1 1 37 37 SER CB C 191 65.104 65.104 63.295 1.809 17569 2732 1 5 . 1 1 37 37 SER H H 191 8.934 8.934 8.556 0.378 17569 2733 1 5 . 1 1 38 38 LEU N N 192 120.959 120.959 113.314 7.645 17569 2734 1 5 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.886 -0.757 17569 2735 1 5 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.220 1.926 17569 2736 1 5 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.543 1.453 17569 2737 1 5 . 1 1 38 38 LEU H H 192 8.649 8.649 7.053 1.596 17569 2738 1 5 . 1 1 39 39 GLN N N 193 108.600 108.600 119.580 -10.980 17569 2739 1 5 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.066 -0.161 17569 2740 1 5 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.599 0.215 17569 2741 1 5 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.923 -1.889 17569 2742 1 5 . 1 1 39 39 GLN H H 193 8.465 8.465 7.820 0.645 17569 2743 1 5 . 1 1 40 40 VAL N N 194 105.325 105.325 119.381 -14.056 17569 2744 1 5 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.466 0.084 17569 2745 1 5 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.390 -1.749 17569 2746 1 5 . 1 1 40 40 VAL H H 194 6.256 6.256 7.779 -1.523 17569 2747 1 5 . 1 1 41 41 LEU N N 195 123.100 123.100 122.450 0.650 17569 2748 1 5 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.781 0.035 17569 2749 1 5 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.726 3.456 17569 2750 1 5 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.300 0.270 17569 2751 1 5 . 1 1 41 41 LEU H H 195 9.154 9.154 8.505 0.649 17569 2752 1 5 . 1 1 42 42 ILE N N 196 124.396 124.396 117.379 7.017 17569 2753 1 5 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.827 1.525 17569 2754 1 5 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.252 0.978 17569 2755 1 5 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.878 1.392 17569 2756 1 5 . 1 1 42 42 ILE H H 196 9.766 9.766 7.849 1.917 17569 2757 1 5 . 1 1 43 43 CYS N N 197 121.500 121.500 115.073 6.427 17569 2758 1 5 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.221 0.041 17569 2759 1 5 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.180 0.523 17569 2760 1 5 . 1 1 43 43 CYS CB C 197 33.300 33.300 30.890 2.409 17569 2761 1 5 . 1 1 43 43 CYS H H 197 9.882 9.882 8.349 1.533 17569 2762 1 5 . 1 1 44 44 LYS N N 198 117.995 117.995 122.274 -4.279 17569 2763 1 5 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.175 -0.186 17569 2764 1 5 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.444 -0.784 17569 2765 1 5 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.496 0.204 17569 2766 1 5 . 1 1 44 44 LYS H H 198 8.089 8.089 8.854 -0.765 17569 2767 1 5 . 1 1 45 45 ASN N N 199 119.200 119.200 117.280 1.920 17569 2768 1 5 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.561 -0.047 17569 2769 1 5 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.270 0.450 17569 2770 1 5 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.202 -0.035 17569 2771 1 5 . 1 1 45 45 ASN H H 199 8.356 8.356 8.504 -0.148 17569 2772 1 5 . 1 1 46 46 CYS N N 200 126.600 126.600 118.384 8.216 17569 2773 1 5 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.056 0.125 17569 2774 1 5 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.070 2.425 17569 2775 1 5 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.206 1.976 17569 2776 1 5 . 1 1 46 46 CYS H H 200 9.189 9.189 7.740 1.449 17569 2777 1 5 . 1 1 47 47 PHE N N 201 121.962 121.962 120.339 1.623 17569 2778 1 5 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.127 -0.257 17569 2779 1 5 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.601 1.668 17569 2780 1 5 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.561 0.606 17569 2781 1 5 . 1 1 47 47 PHE H H 201 8.826 8.826 7.892 0.934 17569 2782 1 5 . 1 1 48 48 LYS N N 202 117.400 117.400 120.314 -2.914 17569 2783 1 5 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.876 -0.178 17569 2784 1 5 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.175 -1.223 17569 2785 1 5 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.269 -0.727 17569 2786 1 5 . 1 1 48 48 LYS H H 202 8.512 8.512 7.906 0.606 17569 2787 1 5 . 1 1 49 49 TYR N N 203 120.400 120.400 120.469 -0.069 17569 2788 1 5 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.225 0.189 17569 2789 1 5 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.175 -0.403 17569 2790 1 5 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.600 -0.154 17569 2791 1 5 . 1 1 49 49 TYR H H 203 8.133 8.133 7.638 0.495 17569 2792 1 5 . 1 1 50 50 TYR N N 204 121.783 121.783 118.105 3.678 17569 2793 1 5 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.706 -1.211 17569 2794 1 5 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.853 3.097 17569 2795 1 5 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.665 0.827 17569 2796 1 5 . 1 1 50 50 TYR H H 204 8.765 8.765 7.513 1.252 17569 2797 1 5 . 1 1 51 51 MET N N 205 110.800 110.800 115.132 -4.332 17569 2798 1 5 . 1 1 51 51 MET HA H 205 4.349 4.349 4.242 0.107 17569 2799 1 5 . 1 1 51 51 MET CA C 205 53.505 53.505 57.110 -3.605 17569 2800 1 5 . 1 1 51 51 MET CB C 205 30.384 30.384 32.612 -2.228 17569 2801 1 5 . 1 1 51 51 MET H H 205 7.771 7.771 8.459 -0.688 17569 2802 1 5 . 1 1 52 52 SER N N 206 116.800 116.800 114.063 2.737 17569 2803 1 5 . 1 1 52 52 SER HA H 206 3.919 3.919 4.391 -0.472 17569 2804 1 5 . 1 1 52 52 SER CA C 206 61.621 61.621 60.028 1.593 17569 2805 1 5 . 1 1 52 52 SER CB C 206 62.611 62.611 64.648 -2.037 17569 2806 1 5 . 1 1 52 52 SER H H 206 7.581 7.581 8.362 -0.781 17569 2807 1 5 . 1 1 53 53 ASP N N 207 117.400 117.400 121.191 -3.791 17569 2808 1 5 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.807 -0.235 17569 2809 1 5 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.786 -0.687 17569 2810 1 5 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.042 0.145 17569 2811 1 5 . 1 1 53 53 ASP H H 207 7.085 7.085 8.161 -1.076 17569 2812 1 5 . 1 1 54 54 ASP N N 208 119.405 119.405 122.354 -2.949 17569 2813 1 5 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.978 -0.589 17569 2814 1 5 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.477 0.423 17569 2815 1 5 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.060 -1.711 17569 2816 1 5 . 1 1 54 54 ASP H H 208 8.439 8.439 8.498 -0.059 17569 2817 1 5 . 1 1 55 55 ILE N N 209 124.698 124.698 121.087 3.611 17569 2818 1 5 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.392 -0.392 17569 2819 1 5 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.460 1.818 17569 2820 1 5 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.550 0.741 17569 2821 1 5 . 1 1 55 55 ILE H H 209 8.128 8.128 8.367 -0.239 17569 2822 1 5 . 1 1 56 56 SER N N 210 126.703 126.703 119.757 6.946 17569 2823 1 5 . 1 1 56 56 SER HA H 210 4.365 4.365 4.714 -0.349 17569 2824 1 5 . 1 1 56 56 SER CA C 210 57.769 57.769 56.657 1.112 17569 2825 1 5 . 1 1 56 56 SER CB C 210 64.991 64.991 64.858 0.133 17569 2826 1 5 . 1 1 56 56 SER H H 210 8.815 8.815 8.317 0.498 17569 2827 1 5 . 1 1 57 57 ARG N N 211 116.885 116.885 119.830 -2.945 17569 2828 1 5 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.746 0.296 17569 2829 1 5 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.956 -1.556 17569 2830 1 5 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.996 2.288 17569 2831 1 5 . 1 1 57 57 ARG H H 211 8.365 8.365 8.527 -0.162 17569 2832 1 5 . 1 1 58 58 ASP N N 212 121.982 121.982 124.056 -2.074 17569 2833 1 5 . 1 1 58 58 ASP HA H 212 4.615 4.615 5.007 -0.392 17569 2834 1 5 . 1 1 58 58 ASP CA C 212 52.222 52.222 52.989 -0.767 17569 2835 1 5 . 1 1 58 58 ASP CB C 212 41.502 41.502 44.992 -3.490 17569 2836 1 5 . 1 1 58 58 ASP H H 212 8.706 8.706 8.768 -0.062 17569 2837 1 5 . 1 1 59 59 SER N N 213 114.164 114.164 114.894 -0.730 17569 2838 1 5 . 1 1 59 59 SER HA H 213 4.212 4.212 4.051 0.161 17569 2839 1 5 . 1 1 59 59 SER CA C 213 60.840 60.840 60.770 0.070 17569 2840 1 5 . 1 1 59 59 SER CB C 213 62.714 62.714 62.966 -0.252 17569 2841 1 5 . 1 1 59 59 SER H H 213 8.687 8.687 8.652 0.035 17569 2842 1 5 . 1 1 60 60 ASP N N 214 120.899 120.899 123.055 -2.156 17569 2843 1 5 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.925 -0.100 17569 2844 1 5 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.186 1.025 17569 2845 1 5 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.786 0.772 17569 2846 1 5 . 1 1 60 60 ASP H H 214 8.193 8.193 8.103 0.090 17569 2847 1 5 . 1 1 61 61 GLY N N 215 108.300 108.300 106.806 1.494 17569 2848 1 5 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.717 -0.320 17569 2849 1 5 . 1 1 61 61 GLY H H 215 8.234 8.234 8.277 -0.043 17569 2850 1 5 . 1 1 62 62 MET N N 216 120.002 120.002 117.475 2.527 17569 2851 1 5 . 1 1 62 62 MET HA H 216 4.972 4.972 4.741 0.231 17569 2852 1 5 . 1 1 62 62 MET CA C 216 53.151 53.151 53.702 -0.551 17569 2853 1 5 . 1 1 62 62 MET CB C 216 32.311 32.311 35.706 -3.395 17569 2854 1 5 . 1 1 62 62 MET H H 216 8.376 8.376 7.404 0.972 17569 2855 1 5 . 1 1 63 63 ASP N N 217 127.300 127.300 123.646 3.654 17569 2856 1 5 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.926 0.040 17569 2857 1 5 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.622 -0.053 17569 2858 1 5 . 1 1 63 63 ASP H H 217 9.368 9.368 8.730 0.638 17569 2859 1 5 . 1 1 64 64 GLU N N 218 114.400 114.400 123.199 -8.799 17569 2860 1 5 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.504 -0.348 17569 2861 1 5 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.793 0.057 17569 2862 1 5 . 1 1 64 64 GLU H H 218 8.583 8.583 8.605 -0.022 17569 2863 1 5 . 1 1 65 65 GLN N N 219 115.500 115.500 117.074 -1.574 17569 2864 1 5 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.500 -0.189 17569 2865 1 5 . 1 1 65 65 GLN CA C 219 55.346 55.346 54.312 1.034 17569 2866 1 5 . 1 1 65 65 GLN H H 219 7.158 7.158 7.606 -0.448 17569 2867 1 5 . 1 1 66 66 CYS N N 220 122.600 122.600 117.933 4.667 17569 2868 1 5 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.013 -0.936 17569 2869 1 5 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.765 0.764 17569 2870 1 5 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.788 1.184 17569 2871 1 5 . 1 1 66 66 CYS H H 220 8.248 8.248 8.382 -0.134 17569 2872 1 5 . 1 1 67 67 ARG N N 221 130.363 130.363 124.067 6.296 17569 2873 1 5 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.401 -0.334 17569 2874 1 5 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.966 -2.950 17569 2875 1 5 . 1 1 67 67 ARG H H 221 9.145 9.145 8.421 0.724 17569 2876 1 5 . 1 1 68 68 TRP N N 222 124.200 124.200 120.508 3.692 17569 2877 1 5 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.685 -0.249 17569 2878 1 5 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.490 0.590 17569 2879 1 5 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.426 0.768 17569 2880 1 5 . 1 1 68 68 TRP H H 222 9.689 9.689 8.172 1.517 17569 2881 1 5 . 1 1 69 69 CYS N N 223 116.297 116.297 110.774 5.523 17569 2882 1 5 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.017 0.074 17569 2883 1 5 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.048 3.054 17569 2884 1 5 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.557 4.781 17569 2885 1 5 . 1 1 69 69 CYS H H 223 8.822 8.822 7.737 1.085 17569 2886 1 5 . 1 1 70 70 ALA N N 224 123.112 123.112 124.111 -0.999 17569 2887 1 5 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.233 0.173 17569 2888 1 5 . 1 1 70 70 ALA CA C 224 52.851 52.851 52.927 -0.076 17569 2889 1 5 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.966 -0.246 17569 2890 1 5 . 1 1 70 70 ALA H H 224 8.787 8.787 8.085 0.702 17569 2891 1 5 . 1 1 71 71 GLU N N 225 118.300 118.300 120.540 -2.240 17569 2892 1 5 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.450 0.858 17569 2893 1 5 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.607 -2.308 17569 2894 1 5 . 1 1 71 71 GLU H H 225 8.541 8.541 8.111 0.430 17569 2895 1 5 . 1 1 72 72 GLY N N 226 111.995 111.995 110.710 1.285 17569 2896 1 5 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.669 -1.266 17569 2897 1 5 . 1 1 72 72 GLY H H 226 9.837 9.837 8.280 1.557 17569 2898 1 5 . 1 1 73 73 GLY N N 227 106.600 106.600 106.773 -0.173 17569 2899 1 5 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.956 1.015 17569 2900 1 5 . 1 1 73 73 GLY H H 227 7.772 7.772 8.473 -0.701 17569 2901 1 5 . 1 1 74 74 ASN N N 228 124.277 124.277 119.115 5.162 17569 2902 1 5 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.460 0.621 17569 2903 1 5 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.890 -0.790 17569 2904 1 5 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.391 -0.307 17569 2905 1 5 . 1 1 74 74 ASN H H 228 8.876 8.876 8.520 0.356 17569 2906 1 5 . 1 1 75 75 LEU N N 229 123.050 123.050 122.293 0.757 17569 2907 1 5 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.882 -0.282 17569 2908 1 5 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.365 0.997 17569 2909 1 5 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.637 -0.137 17569 2910 1 5 . 1 1 75 75 LEU H H 229 8.901 8.901 8.064 0.837 17569 2911 1 5 . 1 1 76 76 ILE N N 230 123.552 123.552 123.311 0.241 17569 2912 1 5 . 1 1 76 76 ILE HA H 230 4.485 4.485 3.975 0.510 17569 2913 1 5 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.923 -1.223 17569 2914 1 5 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.440 -1.041 17569 2915 1 5 . 1 1 76 76 ILE H H 230 9.406 9.406 9.153 0.253 17569 2916 1 5 . 1 1 77 77 CYS N N 231 124.637 124.637 126.834 -2.197 17569 2917 1 5 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.442 -0.567 17569 2918 1 5 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.907 0.452 17569 2919 1 5 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.562 0.872 17569 2920 1 5 . 1 1 77 77 CYS H H 231 8.809 8.809 8.383 0.426 17569 2921 1 5 . 1 1 78 78 CYS N N 232 125.697 125.697 125.975 -0.278 17569 2922 1 5 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.823 -0.539 17569 2923 1 5 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.723 4.161 17569 2924 1 5 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.806 1.364 17569 2925 1 5 . 1 1 78 78 CYS H H 232 8.579 8.579 8.924 -0.345 17569 2926 1 5 . 1 1 79 79 ASP N N 233 123.600 123.600 127.018 -3.418 17569 2927 1 5 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.673 0.084 17569 2928 1 5 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.373 2.616 17569 2929 1 5 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.030 1.599 17569 2930 1 5 . 1 1 79 79 ASP H H 233 8.577 8.577 8.072 0.505 17569 2931 1 5 . 1 1 80 80 PHE N N 234 122.100 122.100 117.144 4.956 17569 2932 1 5 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.578 -0.052 17569 2933 1 5 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.315 1.594 17569 2934 1 5 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.056 1.793 17569 2935 1 5 . 1 1 80 80 PHE H H 234 10.432 10.432 7.367 3.065 17569 2936 1 5 . 1 1 81 81 CYS N N 235 124.300 124.300 117.731 6.569 17569 2937 1 5 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.700 0.456 17569 2938 1 5 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.071 -0.026 17569 2939 1 5 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.742 3.665 17569 2940 1 5 . 1 1 81 81 CYS H H 235 8.476 8.476 8.031 0.445 17569 2941 1 5 . 1 1 82 82 HIS N N 236 112.598 112.598 118.745 -6.147 17569 2942 1 5 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.143 0.840 17569 2943 1 5 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.863 -1.465 17569 2944 1 5 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.991 2.267 17569 2945 1 5 . 1 1 82 82 HIS H H 236 6.699 6.699 8.164 -1.465 17569 2946 1 5 . 1 1 83 83 ASN N N 237 123.600 123.600 119.153 4.447 17569 2947 1 5 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.945 -0.144 17569 2948 1 5 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.274 2.342 17569 2949 1 5 . 1 1 83 83 ASN H H 237 9.097 9.097 7.935 1.162 17569 2950 1 5 . 1 1 84 84 ALA N N 238 122.000 122.000 123.412 -1.412 17569 2951 1 5 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.395 0.014 17569 2952 1 5 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.206 0.158 17569 2953 1 5 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.130 2.940 17569 2954 1 5 . 1 1 84 84 ALA H H 238 9.885 9.885 8.601 1.284 17569 2955 1 5 . 1 1 85 85 PHE N N 239 116.707 116.707 121.453 -4.746 17569 2956 1 5 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.126 0.902 17569 2957 1 5 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.705 -0.488 17569 2958 1 5 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.971 1.693 17569 2959 1 5 . 1 1 85 85 PHE H H 239 9.450 9.450 9.272 0.178 17569 2960 1 5 . 1 1 86 86 CYS N N 240 126.682 126.682 124.840 1.842 17569 2961 1 5 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.777 0.845 17569 2962 1 5 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.857 -0.515 17569 2963 1 5 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.160 3.097 17569 2964 1 5 . 1 1 86 86 CYS H H 240 11.309 11.309 9.426 1.883 17569 2965 1 5 . 1 1 87 87 LYS N N 241 117.865 117.865 124.525 -6.660 17569 2966 1 5 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.931 -0.082 17569 2967 1 5 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.003 0.067 17569 2968 1 5 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.465 0.333 17569 2969 1 5 . 1 1 87 87 LYS H H 241 8.230 8.230 8.778 -0.548 17569 2970 1 5 . 1 1 88 88 LYS N N 242 117.949 117.949 118.484 -0.535 17569 2971 1 5 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.117 -0.139 17569 2972 1 5 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.105 1.265 17569 2973 1 5 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.182 0.134 17569 2974 1 5 . 1 1 88 88 LYS H H 242 7.945 7.945 8.514 -0.569 17569 2975 1 5 . 1 1 89 89 CYS N N 243 125.305 125.305 117.692 7.613 17569 2976 1 5 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.255 -0.513 17569 2977 1 5 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.522 2.305 17569 2978 1 5 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.177 1.064 17569 2979 1 5 . 1 1 89 89 CYS H H 243 9.297 9.297 7.736 1.561 17569 2980 1 5 . 1 1 90 90 ILE N N 244 119.687 119.687 121.320 -1.633 17569 2981 1 5 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.872 -0.265 17569 2982 1 5 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.869 0.081 17569 2983 1 5 . 1 1 90 90 ILE H H 244 7.997 7.997 7.621 0.376 17569 2984 1 5 . 1 1 91 91 LEU N N 245 120.280 120.280 120.657 -0.377 17569 2985 1 5 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.258 -0.573 17569 2986 1 5 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.585 0.650 17569 2987 1 5 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.035 -0.077 17569 2988 1 5 . 1 1 91 91 LEU H H 245 8.810 8.810 8.719 0.091 17569 2989 1 5 . 1 1 92 92 ARG N N 246 116.901 116.901 117.627 -0.726 17569 2990 1 5 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.087 -0.270 17569 2991 1 5 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.526 0.453 17569 2992 1 5 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.133 0.467 17569 2993 1 5 . 1 1 92 92 ARG H H 246 8.086 8.086 7.638 0.448 17569 2994 1 5 . 1 1 93 93 ASN N N 247 111.200 111.200 116.359 -5.159 17569 2995 1 5 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.552 0.051 17569 2996 1 5 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.607 1.201 17569 2997 1 5 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.073 3.411 17569 2998 1 5 . 1 1 93 93 ASN H H 247 7.136 7.136 8.278 -1.142 17569 2999 1 5 . 1 1 94 94 LEU N N 248 118.807 118.807 117.369 1.438 17569 3000 1 5 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.406 0.408 17569 3001 1 5 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.258 -0.069 17569 3002 1 5 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.709 -0.011 17569 3003 1 5 . 1 1 94 94 LEU H H 248 8.515 8.515 7.991 0.524 17569 3004 1 5 . 1 1 95 95 GLY N N 249 108.000 108.000 105.850 2.150 17569 3005 1 5 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.701 -0.073 17569 3006 1 5 . 1 1 95 95 GLY H H 249 7.955 7.955 7.723 0.232 17569 3007 1 5 . 1 1 96 96 ARG N N 250 117.797 117.797 122.064 -4.267 17569 3008 1 5 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.227 -0.384 17569 3009 1 5 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.348 0.334 17569 3010 1 5 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.146 -0.286 17569 3011 1 5 . 1 1 96 96 ARG H H 250 8.559 8.559 8.661 -0.102 17569 3012 1 5 . 1 1 97 97 LYS N N 251 120.900 120.900 119.829 1.071 17569 3013 1 5 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.047 0.109 17569 3014 1 5 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.709 -0.554 17569 3015 1 5 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.646 -0.286 17569 3016 1 5 . 1 1 97 97 LYS H H 251 8.655 8.655 8.548 0.107 17569 3017 1 5 . 1 1 98 98 GLU N N 252 122.000 122.000 118.800 3.200 17569 3018 1 5 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.085 0.266 17569 3019 1 5 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.778 -1.196 17569 3020 1 5 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.179 -0.779 17569 3021 1 5 . 1 1 98 98 GLU H H 252 7.705 7.705 8.424 -0.719 17569 3022 1 5 . 1 1 99 99 LEU N N 253 117.400 117.400 121.032 -3.632 17569 3023 1 5 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.769 0.148 17569 3024 1 5 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.187 -0.189 17569 3025 1 5 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.818 -0.336 17569 3026 1 5 . 1 1 99 99 LEU H H 253 7.285 7.285 7.630 -0.345 17569 3027 1 5 . 1 1 100 100 SER N N 254 112.100 112.100 114.894 -2.794 17569 3028 1 5 . 1 1 100 100 SER HA H 254 4.107 4.107 4.110 -0.003 17569 3029 1 5 . 1 1 100 100 SER CA C 254 61.603 61.603 62.185 -0.582 17569 3030 1 5 . 1 1 100 100 SER CB C 254 62.622 62.622 62.891 -0.269 17569 3031 1 5 . 1 1 100 100 SER H H 254 8.326 8.326 8.287 0.039 17569 3032 1 5 . 1 1 101 101 THR N N 255 118.151 118.151 118.547 -0.396 17569 3033 1 5 . 1 1 101 101 THR HA H 255 4.026 4.026 4.113 -0.087 17569 3034 1 5 . 1 1 101 101 THR CA C 255 66.261 66.261 65.638 0.623 17569 3035 1 5 . 1 1 101 101 THR CB C 255 68.735 68.735 68.472 0.263 17569 3036 1 5 . 1 1 101 101 THR H H 255 7.972 7.972 7.952 0.020 17569 3037 1 5 . 1 1 102 102 ILE N N 256 120.100 120.100 123.328 -3.228 17569 3038 1 5 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.842 -0.379 17569 3039 1 5 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.657 0.117 17569 3040 1 5 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.389 0.352 17569 3041 1 5 . 1 1 102 102 ILE H H 256 7.868 7.868 8.496 -0.628 17569 3042 1 5 . 1 1 103 103 MET N N 257 114.876 114.876 116.677 -1.801 17569 3043 1 5 . 1 1 103 103 MET HA H 257 4.211 4.211 4.059 0.152 17569 3044 1 5 . 1 1 103 103 MET CA C 257 55.691 55.691 58.371 -2.680 17569 3045 1 5 . 1 1 103 103 MET CB C 257 32.000 32.000 32.686 -0.686 17569 3046 1 5 . 1 1 103 103 MET H H 257 7.606 7.606 7.315 0.291 17569 3047 1 5 . 1 1 104 104 ASP N N 258 119.976 119.976 118.737 1.239 17569 3048 1 5 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.808 -0.270 17569 3049 1 5 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.866 1.046 17569 3050 1 5 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.148 1.352 17569 3051 1 5 . 1 1 104 104 ASP H H 258 7.444 7.444 7.642 -0.198 17569 3052 1 5 . 1 1 105 105 GLU N N 259 124.388 124.388 121.222 3.166 17569 3053 1 5 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.492 -0.205 17569 3054 1 5 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.624 2.947 17569 3055 1 5 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.180 -0.638 17569 3056 1 5 . 1 1 105 105 GLU H H 259 8.559 8.559 8.125 0.434 17569 3057 1 5 . 1 1 106 106 ASN N N 260 117.201 117.201 117.647 -0.446 17569 3058 1 5 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.398 0.344 17569 3059 1 5 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.317 -0.574 17569 3060 1 5 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.269 1.649 17569 3061 1 5 . 1 1 106 106 ASN H H 260 8.673 8.673 8.640 0.033 17569 3062 1 5 . 1 1 107 107 ASN N N 261 117.900 117.900 114.298 3.602 17569 3063 1 5 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.295 0.690 17569 3064 1 5 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.690 -2.388 17569 3065 1 5 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.492 3.122 17569 3066 1 5 . 1 1 107 107 ASN H H 261 7.956 7.956 8.690 -0.734 17569 3067 1 5 . 1 1 108 108 GLN N N 262 121.500 121.500 115.847 5.653 17569 3068 1 5 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.039 0.569 17569 3069 1 5 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.581 1.195 17569 3070 1 5 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.742 0.816 17569 3071 1 5 . 1 1 108 108 GLN H H 262 8.493 8.493 7.710 0.783 17569 3072 1 5 . 1 1 109 109 TRP N N 263 128.056 128.056 122.798 5.258 17569 3073 1 5 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.682 0.289 17569 3074 1 5 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.915 0.182 17569 3075 1 5 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.322 0.171 17569 3076 1 5 . 1 1 109 109 TRP H H 263 10.497 10.497 7.858 2.639 17569 3077 1 5 . 1 1 110 110 TYR N N 264 126.600 126.600 124.504 2.096 17569 3078 1 5 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.447 -0.045 17569 3079 1 5 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.392 -1.721 17569 3080 1 5 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.677 -1.669 17569 3081 1 5 . 1 1 110 110 TYR H H 264 7.545 7.545 8.126 -0.581 17569 3082 1 5 . 1 1 111 111 CYS N N 265 124.622 124.622 114.494 10.128 17569 3083 1 5 . 1 1 111 111 CYS H H 265 8.586 8.586 8.090 0.496 17569 3084 1 5 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.785 -0.593 17569 3085 1 5 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.591 1.124 17569 3086 1 5 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.586 1.334 17569 3087 1 5 . 1 1 113 113 ILE N N 267 119.504 119.504 119.414 0.090 17569 3088 1 5 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.486 -0.536 17569 3089 1 5 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.915 0.334 17569 3090 1 5 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.525 -2.992 17569 3091 1 5 . 1 1 113 113 ILE H H 267 9.160 9.160 7.458 1.702 17569 3092 1 5 . 1 1 114 114 CYS N N 268 124.100 124.100 118.370 5.730 17569 3093 1 5 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.166 -0.352 17569 3094 1 5 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.678 3.622 17569 3095 1 5 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.085 2.636 17569 3096 1 5 . 1 1 114 114 CYS H H 268 7.818 7.818 8.246 -0.428 17569 3097 1 5 . 1 1 115 115 HIS N N 269 117.127 117.127 111.152 5.975 17569 3098 1 5 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.656 0.473 17569 3099 1 5 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.037 -0.876 17569 3100 1 5 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.795 2.397 17569 3101 1 5 . 1 1 115 115 HIS H H 269 8.953 8.953 7.798 1.155 17569 3102 1 5 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.450 0.492 17569 3103 1 5 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.576 -0.268 17569 3104 1 5 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.437 1.205 17569 3105 1 5 . 1 1 117 117 GLU N N 271 123.504 123.504 122.945 0.559 17569 3106 1 5 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.323 -0.303 17569 3107 1 5 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.324 3.546 17569 3108 1 5 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.950 -1.899 17569 3109 1 5 . 1 1 117 117 GLU H H 271 8.402 8.402 8.104 0.298 17569 3110 1 5 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.556 -0.014 17569 3111 1 5 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.753 1.606 17569 3112 1 5 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.486 0.656 17569 3113 1 5 . 1 1 119 119 LEU N N 273 112.296 112.296 114.222 -1.926 17569 3114 1 5 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.921 -0.447 17569 3115 1 5 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.408 0.134 17569 3116 1 5 . 1 1 119 119 LEU H H 273 8.090 8.090 7.448 0.642 17569 3117 1 5 . 1 1 120 120 LEU N N 274 121.388 121.388 123.061 -1.673 17569 3118 1 5 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.916 0.111 17569 3119 1 5 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.340 -0.039 17569 3120 1 5 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.686 0.414 17569 3121 1 5 . 1 1 120 120 LEU H H 274 7.823 7.823 7.816 0.007 17569 3122 1 5 . 1 1 121 121 ASP N N 275 118.600 118.600 118.866 -0.266 17569 3123 1 5 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.336 0.205 17569 3124 1 5 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.977 -0.274 17569 3125 1 5 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.197 -0.754 17569 3126 1 5 . 1 1 121 121 ASP H H 275 8.694 8.694 8.392 0.302 17569 3127 1 5 . 1 1 122 122 LEU N N 276 123.192 123.192 120.784 2.408 17569 3128 1 5 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.061 0.331 17569 3129 1 5 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.753 0.218 17569 3130 1 5 . 1 1 122 122 LEU CB C 276 42.542 42.542 41.881 0.661 17569 3131 1 5 . 1 1 122 122 LEU H H 276 8.013 8.013 7.708 0.305 17569 3132 1 5 . 1 1 123 123 VAL N N 277 126.898 126.898 118.537 8.361 17569 3133 1 5 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.678 0.177 17569 3134 1 5 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.610 0.053 17569 3135 1 5 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.899 1.159 17569 3136 1 5 . 1 1 123 123 VAL H H 277 8.781 8.781 7.936 0.845 17569 3137 1 5 . 1 1 124 124 THR N N 278 117.500 117.500 116.320 1.180 17569 3138 1 5 . 1 1 124 124 THR HA H 278 4.030 4.030 3.941 0.089 17569 3139 1 5 . 1 1 124 124 THR CA C 278 66.589 66.589 66.683 -0.094 17569 3140 1 5 . 1 1 124 124 THR CB C 278 68.410 68.410 67.939 0.471 17569 3141 1 5 . 1 1 124 124 THR H H 278 8.722 8.722 8.288 0.434 17569 3142 1 5 . 1 1 125 125 ALA N N 279 124.700 124.700 124.429 0.271 17569 3143 1 5 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.081 0.180 17569 3144 1 5 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.784 0.512 17569 3145 1 5 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.915 0.034 17569 3146 1 5 . 1 1 125 125 ALA H H 279 8.239 8.239 7.776 0.463 17569 3147 1 5 . 1 1 126 126 CYS N N 280 119.276 119.276 117.622 1.654 17569 3148 1 5 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.910 0.204 17569 3149 1 5 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.114 -1.011 17569 3150 1 5 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.408 -0.912 17569 3151 1 5 . 1 1 126 126 CYS H H 280 8.128 8.128 7.804 0.324 17569 3152 1 5 . 1 1 127 127 ASN N N 281 118.000 118.000 118.264 -0.264 17569 3153 1 5 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.575 -0.015 17569 3154 1 5 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.491 -0.352 17569 3155 1 5 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.043 -1.078 17569 3156 1 5 . 1 1 127 127 ASN H H 281 8.725 8.725 8.009 0.716 17569 3157 1 5 . 1 1 128 128 SER N N 282 116.601 116.601 116.947 -0.346 17569 3158 1 5 . 1 1 128 128 SER HA H 282 4.363 4.363 4.115 0.248 17569 3159 1 5 . 1 1 128 128 SER CA C 282 61.899 61.899 61.769 0.130 17569 3160 1 5 . 1 1 128 128 SER CB C 282 62.630 62.630 62.988 -0.358 17569 3161 1 5 . 1 1 128 128 SER H H 282 8.542 8.542 7.638 0.904 17569 3162 1 5 . 1 1 129 129 VAL N N 283 123.272 123.272 121.755 1.517 17569 3163 1 5 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.613 0.064 17569 3164 1 5 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.208 0.300 17569 3165 1 5 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.017 0.201 17569 3166 1 5 . 1 1 129 129 VAL H H 283 7.990 7.990 7.927 0.063 17569 3167 1 5 . 1 1 130 130 PHE N N 284 118.594 118.594 119.392 -0.798 17569 3168 1 5 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.318 -0.305 17569 3169 1 5 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.315 2.185 17569 3170 1 5 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.235 0.761 17569 3171 1 5 . 1 1 130 130 PHE H H 284 8.190 8.190 8.069 0.121 17569 3172 1 5 . 1 1 131 131 GLU N N 285 120.905 120.905 120.236 0.669 17569 3173 1 5 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.989 0.216 17569 3174 1 5 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.146 -0.932 17569 3175 1 5 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.465 0.035 17569 3176 1 5 . 1 1 131 131 GLU H H 285 8.699 8.699 8.741 -0.042 17569 3177 1 5 . 1 1 132 132 ASN N N 286 117.997 117.997 118.095 -0.098 17569 3178 1 5 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.664 -0.069 17569 3179 1 5 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.759 -0.144 17569 3180 1 5 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.571 0.281 17569 3181 1 5 . 1 1 132 132 ASN H H 286 8.082 8.082 7.904 0.178 17569 3182 1 5 . 1 1 133 133 LEU N N 287 120.800 120.800 122.883 -2.083 17569 3183 1 5 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.325 -0.208 17569 3184 1 5 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.363 -0.565 17569 3185 1 5 . 1 1 133 133 LEU H H 287 7.904 7.904 8.608 -0.704 17569 3186 1 5 . 1 1 134 134 GLU N N 288 118.200 118.200 118.685 -0.485 17569 3187 1 5 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.937 0.142 17569 3188 1 5 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.093 -1.096 17569 3189 1 5 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.316 -0.074 17569 3190 1 5 . 1 1 134 134 GLU H H 288 8.157 8.157 8.687 -0.530 17569 3191 1 5 . 1 1 135 135 GLN N N 289 117.400 117.400 118.052 -0.652 17569 3192 1 5 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.117 0.057 17569 3193 1 5 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.286 -0.297 17569 3194 1 5 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.564 -0.484 17569 3195 1 5 . 1 1 135 135 GLN H H 289 7.869 7.869 7.695 0.174 17569 3196 1 5 . 1 1 136 136 LEU N N 290 121.000 121.000 122.191 -1.191 17569 3197 1 5 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.837 0.336 17569 3198 1 5 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.771 -0.633 17569 3199 1 5 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.736 0.264 17569 3200 1 5 . 1 1 136 136 LEU H H 290 7.968 7.968 7.676 0.292 17569 3201 1 5 . 1 1 137 137 LEU N N 291 118.900 118.900 118.016 0.884 17569 3202 1 5 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.065 0.176 17569 3203 1 5 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.338 -0.978 17569 3204 1 5 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.167 -0.695 17569 3205 1 5 . 1 1 137 137 LEU H H 291 8.154 8.154 7.692 0.462 17569 3206 1 5 . 1 1 138 138 GLN N N 292 117.993 117.993 116.362 1.631 17569 3207 1 5 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.471 -0.199 17569 3208 1 5 . 1 1 138 138 GLN CA C 292 56.632 56.632 55.714 0.918 17569 3209 1 5 . 1 1 138 138 GLN CB C 292 28.584 28.584 28.651 -0.067 17569 3210 1 5 . 1 1 138 138 GLN H H 292 7.896 7.896 7.574 0.322 17569 3211 1 5 . 1 1 139 139 GLN N N 293 118.889 118.889 119.175 -0.286 17569 3212 1 5 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.470 -0.201 17569 3213 1 5 . 1 1 139 139 GLN CA C 293 56.454 56.454 56.032 0.422 17569 3214 1 5 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.319 -0.250 17569 3215 1 5 . 1 1 139 139 GLN H H 293 8.091 8.091 7.499 0.592 17569 3216 1 5 . 1 1 140 140 ASN N N 294 118.604 118.604 117.951 0.653 17569 3217 1 5 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.915 -0.156 17569 3218 1 5 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.148 0.073 17569 3219 1 5 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.379 -1.646 17569 3220 1 5 . 1 1 140 140 ASN H H 294 8.273 8.273 8.226 0.047 17569 3221 1 5 . 1 1 141 141 LYS N N 295 121.685 121.685 120.670 1.015 17569 3222 1 5 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.609 -0.249 17569 3223 1 5 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.454 0.719 17569 3224 1 5 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.813 -1.278 17569 3225 1 5 . 1 1 141 141 LYS H H 295 8.089 8.089 8.156 -0.067 17569 3226 1 6 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.797 -0.410 17569 3227 1 6 . 1 1 2 2 ALA CA C 156 52.445 52.445 51.525 0.920 17569 3228 1 6 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.233 -0.977 17569 3229 1 6 . 1 1 3 3 MET HA H 157 4.476 4.476 4.763 -0.287 17569 3230 1 6 . 1 1 3 3 MET CA C 157 55.401 55.401 55.150 0.251 17569 3231 1 6 . 1 1 4 4 ALA N N 158 124.828 124.828 126.121 -1.293 17569 3232 1 6 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.632 -0.318 17569 3233 1 6 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.897 0.615 17569 3234 1 6 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.675 -1.674 17569 3235 1 6 . 1 1 4 4 ALA H H 158 8.382 8.382 8.337 0.045 17569 3236 1 6 . 1 1 5 5 ASP N N 159 119.418 119.418 120.923 -1.505 17569 3237 1 6 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.711 -0.121 17569 3238 1 6 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.355 -0.218 17569 3239 1 6 . 1 1 5 5 ASP CB C 159 41.015 41.015 40.951 0.064 17569 3240 1 6 . 1 1 5 5 ASP H H 159 8.312 8.312 8.421 -0.109 17569 3241 1 6 . 1 1 6 6 LYS N N 160 121.604 121.604 119.721 1.883 17569 3242 1 6 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.822 -0.479 17569 3243 1 6 . 1 1 6 6 LYS H H 160 8.274 8.274 7.814 0.460 17569 3244 1 6 . 1 1 7 7 ARG N N 161 121.611 121.611 119.350 2.261 17569 3245 1 6 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.518 -0.191 17569 3246 1 6 . 1 1 7 7 ARG H H 161 8.430 8.430 8.499 -0.069 17569 3247 1 6 . 1 1 8 8 GLY N N 162 109.606 109.606 111.154 -1.548 17569 3248 1 6 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.632 0.415 17569 3249 1 6 . 1 1 8 8 GLY H H 162 8.473 8.473 8.131 0.342 17569 3250 1 6 . 1 1 9 9 ASP N N 163 120.187 120.187 120.541 -0.354 17569 3251 1 6 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.773 -0.124 17569 3252 1 6 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.127 1.024 17569 3253 1 6 . 1 1 9 9 ASP H H 163 8.296 8.296 7.669 0.627 17569 3254 1 6 . 1 1 10 10 GLY N N 164 108.816 108.816 110.366 -1.550 17569 3255 1 6 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.368 -0.001 17569 3256 1 6 . 1 1 10 10 GLY H H 164 8.458 8.458 8.489 -0.031 17569 3257 1 6 . 1 1 11 11 LEU N N 165 121.195 121.195 121.182 0.013 17569 3258 1 6 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.700 -0.384 17569 3259 1 6 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.715 0.285 17569 3260 1 6 . 1 1 11 11 LEU CB C 165 41.932 41.932 43.879 -1.947 17569 3261 1 6 . 1 1 11 11 LEU H H 165 8.137 8.137 7.865 0.272 17569 3262 1 6 . 1 1 12 12 HIS N N 166 119.387 119.387 122.254 -2.867 17569 3263 1 6 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.753 -0.098 17569 3264 1 6 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.425 0.844 17569 3265 1 6 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.964 0.733 17569 3266 1 6 . 1 1 12 12 HIS H H 166 8.270 8.270 8.670 -0.400 17569 3267 1 6 . 1 1 13 13 GLY N N 167 109.899 109.899 111.688 -1.789 17569 3268 1 6 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.546 0.559 17569 3269 1 6 . 1 1 13 13 GLY H H 167 8.276 8.276 8.542 -0.266 17569 3270 1 6 . 1 1 14 14 ILE N N 168 119.597 119.597 121.171 -1.574 17569 3271 1 6 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.375 -0.052 17569 3272 1 6 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.521 0.079 17569 3273 1 6 . 1 1 14 14 ILE CB C 168 38.950 38.950 40.790 -1.840 17569 3274 1 6 . 1 1 14 14 ILE H H 168 7.962 7.962 8.092 -0.130 17569 3275 1 6 . 1 1 15 15 VAL N N 169 127.578 127.578 128.292 -0.714 17569 3276 1 6 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.226 0.054 17569 3277 1 6 . 1 1 15 15 VAL CA C 169 61.317 61.317 61.494 -0.177 17569 3278 1 6 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.975 1.427 17569 3279 1 6 . 1 1 15 15 VAL H H 169 9.011 9.011 8.478 0.533 17569 3280 1 6 . 1 1 16 16 SER N N 170 118.596 118.596 120.880 -2.284 17569 3281 1 6 . 1 1 16 16 SER HA H 170 5.140 5.140 5.018 0.122 17569 3282 1 6 . 1 1 16 16 SER CA C 170 55.985 55.985 56.931 -0.945 17569 3283 1 6 . 1 1 16 16 SER CB C 170 65.261 65.261 65.236 0.025 17569 3284 1 6 . 1 1 16 16 SER H H 170 8.242 8.242 8.315 -0.073 17569 3285 1 6 . 1 1 17 17 CYS N N 171 123.783 123.783 125.512 -1.729 17569 3286 1 6 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.230 -0.049 17569 3287 1 6 . 1 1 17 17 CYS CA C 171 59.844 59.844 59.995 -0.151 17569 3288 1 6 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.929 2.444 17569 3289 1 6 . 1 1 17 17 CYS H H 171 8.894 8.894 8.528 0.366 17569 3290 1 6 . 1 1 18 18 THR N N 172 121.703 121.703 117.774 3.929 17569 3291 1 6 . 1 1 18 18 THR HA H 172 4.386 4.386 4.094 0.292 17569 3292 1 6 . 1 1 18 18 THR CA C 172 64.667 64.667 64.210 0.457 17569 3293 1 6 . 1 1 18 18 THR CB C 172 69.498 69.498 68.483 1.015 17569 3294 1 6 . 1 1 18 18 THR H H 172 8.788 8.788 8.298 0.490 17569 3295 1 6 . 1 1 19 19 ALA N N 173 131.364 131.364 121.538 9.826 17569 3296 1 6 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.187 0.309 17569 3297 1 6 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.160 0.865 17569 3298 1 6 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.955 3.227 17569 3299 1 6 . 1 1 19 19 ALA H H 173 9.680 9.680 7.791 1.889 17569 3300 1 6 . 1 1 20 20 CYS N N 174 115.498 115.498 115.675 -0.177 17569 3301 1 6 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.393 0.575 17569 3302 1 6 . 1 1 20 20 CYS CA C 174 58.094 58.094 58.597 -0.503 17569 3303 1 6 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.518 3.726 17569 3304 1 6 . 1 1 20 20 CYS H H 174 8.470 8.470 7.639 0.831 17569 3305 1 6 . 1 1 21 21 GLY N N 175 112.464 112.464 108.781 3.683 17569 3306 1 6 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.009 0.697 17569 3307 1 6 . 1 1 21 21 GLY H H 175 7.884 7.884 8.002 -0.118 17569 3308 1 6 . 1 1 22 22 GLN N N 176 121.784 121.784 118.100 3.684 17569 3309 1 6 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.558 -0.182 17569 3310 1 6 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.511 1.780 17569 3311 1 6 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.444 -3.103 17569 3312 1 6 . 1 1 22 22 GLN H H 176 8.723 8.723 7.890 0.833 17569 3313 1 6 . 1 1 23 23 GLN N N 177 122.900 122.900 121.417 1.483 17569 3314 1 6 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.292 0.238 17569 3315 1 6 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.966 -0.416 17569 3316 1 6 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.371 -0.911 17569 3317 1 6 . 1 1 23 23 GLN H H 177 8.721 8.721 8.640 0.081 17569 3318 1 6 . 1 1 24 24 VAL N N 178 121.000 121.000 125.347 -4.347 17569 3319 1 6 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.914 0.610 17569 3320 1 6 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.357 -2.480 17569 3321 1 6 . 1 1 24 24 VAL H H 178 8.689 8.689 8.625 0.064 17569 3322 1 6 . 1 1 25 25 ASN N N 179 121.392 121.392 123.929 -2.537 17569 3323 1 6 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.411 0.465 17569 3324 1 6 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.788 -2.639 17569 3325 1 6 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.716 -0.739 17569 3326 1 6 . 1 1 25 25 ASN H H 179 8.635 8.635 8.054 0.581 17569 3327 1 6 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.605 -0.145 17569 3328 1 6 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.385 0.613 17569 3329 1 6 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.553 -1.160 17569 3330 1 6 . 1 1 28 28 GLN N N 182 119.300 119.300 121.547 -2.247 17569 3331 1 6 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.353 0.165 17569 3332 1 6 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.376 -2.034 17569 3333 1 6 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.328 0.023 17569 3334 1 6 . 1 1 28 28 GLN H H 182 7.494 7.494 8.285 -0.791 17569 3335 1 6 . 1 1 29 29 LYS N N 183 124.516 124.516 123.829 0.687 17569 3336 1 6 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.313 -0.391 17569 3337 1 6 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.431 1.881 17569 3338 1 6 . 1 1 29 29 LYS CB C 183 32.286 32.286 33.164 -0.878 17569 3339 1 6 . 1 1 29 29 LYS H H 183 8.779 8.779 8.417 0.362 17569 3340 1 6 . 1 1 30 30 ASP N N 184 116.500 116.500 120.510 -4.010 17569 3341 1 6 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.335 0.124 17569 3342 1 6 . 1 1 30 30 ASP CA C 184 54.536 54.536 55.327 -0.791 17569 3343 1 6 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.466 -0.495 17569 3344 1 6 . 1 1 30 30 ASP H H 184 8.556 8.556 8.650 -0.094 17569 3345 1 6 . 1 1 31 31 SER N N 185 111.505 111.505 111.998 -0.493 17569 3346 1 6 . 1 1 31 31 SER HA H 185 4.695 4.695 4.644 0.052 17569 3347 1 6 . 1 1 31 31 SER CA C 185 59.747 59.747 57.267 2.480 17569 3348 1 6 . 1 1 31 31 SER CB C 185 65.198 65.198 62.871 2.327 17569 3349 1 6 . 1 1 31 31 SER H H 185 7.933 7.933 8.086 -0.153 17569 3350 1 6 . 1 1 32 32 ILE N N 186 113.394 113.394 114.441 -1.047 17569 3351 1 6 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.408 0.478 17569 3352 1 6 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.270 -0.691 17569 3353 1 6 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.467 1.345 17569 3354 1 6 . 1 1 32 32 ILE H H 186 7.105 7.105 7.082 0.023 17569 3355 1 6 . 1 1 33 33 TYR N N 187 119.098 119.098 120.692 -1.594 17569 3356 1 6 . 1 1 33 33 TYR HA H 187 4.523 4.523 4.751 -0.228 17569 3357 1 6 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.926 0.334 17569 3358 1 6 . 1 1 33 33 TYR CB C 187 43.440 43.440 42.639 0.801 17569 3359 1 6 . 1 1 33 33 TYR H H 187 8.954 8.954 8.278 0.676 17569 3360 1 6 . 1 1 34 34 ARG N N 188 118.502 118.502 124.707 -6.205 17569 3361 1 6 . 1 1 34 34 ARG HA H 188 4.637 4.637 5.171 -0.534 17569 3362 1 6 . 1 1 34 34 ARG CA C 188 54.752 54.752 55.506 -0.754 17569 3363 1 6 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.915 0.336 17569 3364 1 6 . 1 1 34 34 ARG H H 188 8.412 8.412 8.773 -0.361 17569 3365 1 6 . 1 1 35 35 HIS N N 189 126.596 126.596 128.659 -2.063 17569 3366 1 6 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.853 -0.261 17569 3367 1 6 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.037 -0.316 17569 3368 1 6 . 1 1 35 35 HIS CB C 189 32.472 32.472 30.864 1.607 17569 3369 1 6 . 1 1 35 35 HIS H H 189 9.813 9.813 9.149 0.664 17569 3370 1 6 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.509 -0.211 17569 3371 1 6 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.873 0.403 17569 3372 1 6 . 1 1 36 36 PRO CB C 190 32.851 32.851 31.867 0.984 17569 3373 1 6 . 1 1 37 37 SER N N 191 110.003 110.003 113.370 -3.367 17569 3374 1 6 . 1 1 37 37 SER HA H 191 4.918 4.918 4.328 0.590 17569 3375 1 6 . 1 1 37 37 SER CA C 191 59.031 59.031 61.079 -2.048 17569 3376 1 6 . 1 1 37 37 SER CB C 191 65.104 65.104 63.285 1.819 17569 3377 1 6 . 1 1 37 37 SER H H 191 8.934 8.934 8.493 0.441 17569 3378 1 6 . 1 1 38 38 LEU N N 192 120.959 120.959 114.450 6.509 17569 3379 1 6 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.914 -0.785 17569 3380 1 6 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.369 1.777 17569 3381 1 6 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.360 1.636 17569 3382 1 6 . 1 1 38 38 LEU H H 192 8.649 8.649 6.971 1.678 17569 3383 1 6 . 1 1 39 39 GLN N N 193 108.600 108.600 119.314 -10.714 17569 3384 1 6 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.074 -0.169 17569 3385 1 6 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.630 0.184 17569 3386 1 6 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.029 -1.995 17569 3387 1 6 . 1 1 39 39 GLN H H 193 8.465 8.465 7.936 0.529 17569 3388 1 6 . 1 1 40 40 VAL N N 194 105.325 105.325 117.252 -11.927 17569 3389 1 6 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.547 0.003 17569 3390 1 6 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.041 -1.401 17569 3391 1 6 . 1 1 40 40 VAL H H 194 6.256 6.256 7.970 -1.714 17569 3392 1 6 . 1 1 41 41 LEU N N 195 123.100 123.100 123.022 0.078 17569 3393 1 6 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.849 -0.033 17569 3394 1 6 . 1 1 41 41 LEU CA C 195 58.182 58.182 55.010 3.172 17569 3395 1 6 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.670 0.900 17569 3396 1 6 . 1 1 41 41 LEU H H 195 9.154 9.154 8.616 0.538 17569 3397 1 6 . 1 1 42 42 ILE N N 196 124.396 124.396 118.011 6.385 17569 3398 1 6 . 1 1 42 42 ILE HA H 196 6.352 6.352 5.049 1.303 17569 3399 1 6 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.540 0.690 17569 3400 1 6 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.920 1.350 17569 3401 1 6 . 1 1 42 42 ILE H H 196 9.766 9.766 9.217 0.549 17569 3402 1 6 . 1 1 43 43 CYS N N 197 121.500 121.500 115.620 5.880 17569 3403 1 6 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.065 0.197 17569 3404 1 6 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.361 0.342 17569 3405 1 6 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.042 2.258 17569 3406 1 6 . 1 1 43 43 CYS H H 197 9.882 9.882 8.485 1.397 17569 3407 1 6 . 1 1 44 44 LYS N N 198 117.995 117.995 122.670 -4.675 17569 3408 1 6 . 1 1 44 44 LYS HA H 198 3.989 3.989 3.673 0.316 17569 3409 1 6 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.052 -0.392 17569 3410 1 6 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.589 0.112 17569 3411 1 6 . 1 1 44 44 LYS H H 198 8.089 8.089 9.012 -0.923 17569 3412 1 6 . 1 1 45 45 ASN N N 199 119.200 119.200 116.743 2.457 17569 3413 1 6 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.506 0.008 17569 3414 1 6 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.227 0.493 17569 3415 1 6 . 1 1 45 45 ASN CB C 199 38.167 38.167 37.903 0.264 17569 3416 1 6 . 1 1 45 45 ASN H H 199 8.356 8.356 8.321 0.035 17569 3417 1 6 . 1 1 46 46 CYS N N 200 126.600 126.600 119.016 7.584 17569 3418 1 6 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.872 0.309 17569 3419 1 6 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.231 2.264 17569 3420 1 6 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.080 2.102 17569 3421 1 6 . 1 1 46 46 CYS H H 200 9.189 9.189 7.840 1.349 17569 3422 1 6 . 1 1 47 47 PHE N N 201 121.962 121.962 119.561 2.401 17569 3423 1 6 . 1 1 47 47 PHE HA H 201 3.870 3.870 3.949 -0.079 17569 3424 1 6 . 1 1 47 47 PHE CA C 201 62.269 62.269 61.174 1.095 17569 3425 1 6 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.145 1.022 17569 3426 1 6 . 1 1 47 47 PHE H H 201 8.826 8.826 7.579 1.247 17569 3427 1 6 . 1 1 48 48 LYS N N 202 117.400 117.400 119.584 -2.184 17569 3428 1 6 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.891 -0.193 17569 3429 1 6 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.709 -0.757 17569 3430 1 6 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.340 -0.798 17569 3431 1 6 . 1 1 48 48 LYS H H 202 8.512 8.512 8.323 0.189 17569 3432 1 6 . 1 1 49 49 TYR N N 203 120.400 120.400 121.293 -0.893 17569 3433 1 6 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.052 0.362 17569 3434 1 6 . 1 1 49 49 TYR CA C 203 60.772 60.772 62.095 -1.323 17569 3435 1 6 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.493 -0.047 17569 3436 1 6 . 1 1 49 49 TYR H H 203 8.133 8.133 7.878 0.255 17569 3437 1 6 . 1 1 50 50 TYR N N 204 121.783 121.783 117.303 4.480 17569 3438 1 6 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.657 -1.162 17569 3439 1 6 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.108 2.842 17569 3440 1 6 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.756 0.736 17569 3441 1 6 . 1 1 50 50 TYR H H 204 8.765 8.765 7.665 1.100 17569 3442 1 6 . 1 1 51 51 MET N N 205 110.800 110.800 115.444 -4.644 17569 3443 1 6 . 1 1 51 51 MET HA H 205 4.349 4.349 4.212 0.137 17569 3444 1 6 . 1 1 51 51 MET CA C 205 53.505 53.505 57.151 -3.646 17569 3445 1 6 . 1 1 51 51 MET CB C 205 30.384 30.384 32.621 -2.237 17569 3446 1 6 . 1 1 51 51 MET H H 205 7.771 7.771 7.807 -0.036 17569 3447 1 6 . 1 1 52 52 SER N N 206 116.800 116.800 113.447 3.353 17569 3448 1 6 . 1 1 52 52 SER HA H 206 3.919 3.919 4.380 -0.461 17569 3449 1 6 . 1 1 52 52 SER CA C 206 61.621 61.621 59.344 2.277 17569 3450 1 6 . 1 1 52 52 SER CB C 206 62.611 62.611 64.190 -1.579 17569 3451 1 6 . 1 1 52 52 SER H H 206 7.581 7.581 8.337 -0.756 17569 3452 1 6 . 1 1 53 53 ASP N N 207 117.400 117.400 120.930 -3.530 17569 3453 1 6 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.763 -0.191 17569 3454 1 6 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.712 -0.613 17569 3455 1 6 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.077 0.111 17569 3456 1 6 . 1 1 53 53 ASP H H 207 7.085 7.085 7.946 -0.861 17569 3457 1 6 . 1 1 54 54 ASP N N 208 119.405 119.405 122.423 -3.018 17569 3458 1 6 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.969 -0.580 17569 3459 1 6 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.236 0.664 17569 3460 1 6 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.139 -1.790 17569 3461 1 6 . 1 1 54 54 ASP H H 208 8.439 8.439 8.357 0.082 17569 3462 1 6 . 1 1 55 55 ILE N N 209 124.698 124.698 120.732 3.966 17569 3463 1 6 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.470 -0.470 17569 3464 1 6 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.144 2.134 17569 3465 1 6 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.398 0.893 17569 3466 1 6 . 1 1 55 55 ILE H H 209 8.128 8.128 8.473 -0.345 17569 3467 1 6 . 1 1 56 56 SER N N 210 126.703 126.703 118.460 8.243 17569 3468 1 6 . 1 1 56 56 SER HA H 210 4.365 4.365 4.791 -0.426 17569 3469 1 6 . 1 1 56 56 SER CA C 210 57.769 57.769 57.293 0.476 17569 3470 1 6 . 1 1 56 56 SER CB C 210 64.991 64.991 64.308 0.683 17569 3471 1 6 . 1 1 56 56 SER H H 210 8.815 8.815 8.739 0.076 17569 3472 1 6 . 1 1 57 57 ARG N N 211 116.885 116.885 120.146 -3.261 17569 3473 1 6 . 1 1 57 57 ARG HA H 211 5.042 5.042 5.023 0.019 17569 3474 1 6 . 1 1 57 57 ARG CA C 211 54.400 54.400 54.658 -0.258 17569 3475 1 6 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.541 2.743 17569 3476 1 6 . 1 1 57 57 ARG H H 211 8.365 8.365 8.396 -0.031 17569 3477 1 6 . 1 1 58 58 ASP N N 212 121.982 121.982 124.381 -2.399 17569 3478 1 6 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.607 0.008 17569 3479 1 6 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.533 -2.312 17569 3480 1 6 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.607 -1.105 17569 3481 1 6 . 1 1 58 58 ASP H H 212 8.706 8.706 8.368 0.338 17569 3482 1 6 . 1 1 59 59 SER N N 213 114.164 114.164 116.054 -1.890 17569 3483 1 6 . 1 1 59 59 SER HA H 213 4.212 4.212 4.188 0.024 17569 3484 1 6 . 1 1 59 59 SER CA C 213 60.840 60.840 61.202 -0.361 17569 3485 1 6 . 1 1 59 59 SER CB C 213 62.714 62.714 63.373 -0.659 17569 3486 1 6 . 1 1 59 59 SER H H 213 8.687 8.687 8.800 -0.113 17569 3487 1 6 . 1 1 60 60 ASP N N 214 120.899 120.899 118.902 1.997 17569 3488 1 6 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.708 0.117 17569 3489 1 6 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.066 1.145 17569 3490 1 6 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.386 1.173 17569 3491 1 6 . 1 1 60 60 ASP H H 214 8.193 8.193 7.780 0.413 17569 3492 1 6 . 1 1 61 61 GLY N N 215 108.300 108.300 107.688 0.612 17569 3493 1 6 . 1 1 61 61 GLY CA C 215 45.397 45.397 46.020 -0.623 17569 3494 1 6 . 1 1 61 61 GLY H H 215 8.234 8.234 8.117 0.117 17569 3495 1 6 . 1 1 62 62 MET N N 216 120.002 120.002 118.233 1.769 17569 3496 1 6 . 1 1 62 62 MET HA H 216 4.972 4.972 4.592 0.380 17569 3497 1 6 . 1 1 62 62 MET CA C 216 53.151 53.151 54.299 -1.148 17569 3498 1 6 . 1 1 62 62 MET CB C 216 32.311 32.311 34.778 -2.467 17569 3499 1 6 . 1 1 62 62 MET H H 216 8.376 8.376 7.367 1.009 17569 3500 1 6 . 1 1 63 63 ASP N N 217 127.300 127.300 119.849 7.451 17569 3501 1 6 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.815 0.151 17569 3502 1 6 . 1 1 63 63 ASP CA C 217 55.569 55.569 53.992 1.577 17569 3503 1 6 . 1 1 63 63 ASP H H 217 9.368 9.368 8.406 0.962 17569 3504 1 6 . 1 1 64 64 GLU N N 218 114.400 114.400 125.783 -11.383 17569 3505 1 6 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.493 -0.337 17569 3506 1 6 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.566 0.284 17569 3507 1 6 . 1 1 64 64 GLU H H 218 8.583 8.583 8.601 -0.018 17569 3508 1 6 . 1 1 65 65 GLN N N 219 115.500 115.500 116.994 -1.494 17569 3509 1 6 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.574 -0.263 17569 3510 1 6 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.333 0.014 17569 3511 1 6 . 1 1 65 65 GLN H H 219 7.158 7.158 7.664 -0.506 17569 3512 1 6 . 1 1 66 66 CYS N N 220 122.600 122.600 117.632 4.968 17569 3513 1 6 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.410 -1.333 17569 3514 1 6 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.307 1.222 17569 3515 1 6 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.474 1.498 17569 3516 1 6 . 1 1 66 66 CYS H H 220 8.248 8.248 8.448 -0.200 17569 3517 1 6 . 1 1 67 67 ARG N N 221 130.363 130.363 123.458 6.905 17569 3518 1 6 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.550 -0.483 17569 3519 1 6 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.173 -3.158 17569 3520 1 6 . 1 1 67 67 ARG H H 221 9.145 9.145 8.924 0.221 17569 3521 1 6 . 1 1 68 68 TRP N N 222 124.200 124.200 121.114 3.086 17569 3522 1 6 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.777 -0.341 17569 3523 1 6 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.484 0.596 17569 3524 1 6 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.294 0.899 17569 3525 1 6 . 1 1 68 68 TRP H H 222 9.689 9.689 8.291 1.398 17569 3526 1 6 . 1 1 69 69 CYS N N 223 116.297 116.297 111.011 5.286 17569 3527 1 6 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.038 0.053 17569 3528 1 6 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.953 3.149 17569 3529 1 6 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.373 4.965 17569 3530 1 6 . 1 1 69 69 CYS H H 223 8.822 8.822 7.740 1.082 17569 3531 1 6 . 1 1 70 70 ALA N N 224 123.112 123.112 123.045 0.067 17569 3532 1 6 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.350 0.056 17569 3533 1 6 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.505 -0.654 17569 3534 1 6 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.822 -0.102 17569 3535 1 6 . 1 1 70 70 ALA H H 224 8.787 8.787 8.223 0.564 17569 3536 1 6 . 1 1 71 71 GLU N N 225 118.300 118.300 120.458 -2.158 17569 3537 1 6 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.487 0.821 17569 3538 1 6 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.659 -2.360 17569 3539 1 6 . 1 1 71 71 GLU H H 225 8.541 8.541 8.210 0.331 17569 3540 1 6 . 1 1 72 72 GLY N N 226 111.995 111.995 109.377 2.618 17569 3541 1 6 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.772 -0.369 17569 3542 1 6 . 1 1 72 72 GLY H H 226 9.837 9.837 8.501 1.336 17569 3543 1 6 . 1 1 73 73 GLY N N 227 106.600 106.600 106.988 -0.388 17569 3544 1 6 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.084 0.887 17569 3545 1 6 . 1 1 73 73 GLY H H 227 7.772 7.772 8.319 -0.547 17569 3546 1 6 . 1 1 74 74 ASN N N 228 124.277 124.277 117.730 6.547 17569 3547 1 6 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.428 0.653 17569 3548 1 6 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.921 -0.821 17569 3549 1 6 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.008 0.076 17569 3550 1 6 . 1 1 74 74 ASN H H 228 8.876 8.876 8.554 0.322 17569 3551 1 6 . 1 1 75 75 LEU N N 229 123.050 123.050 119.714 3.336 17569 3552 1 6 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.799 -0.199 17569 3553 1 6 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.611 0.751 17569 3554 1 6 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.468 0.032 17569 3555 1 6 . 1 1 75 75 LEU H H 229 8.901 8.901 8.004 0.897 17569 3556 1 6 . 1 1 76 76 ILE N N 230 123.552 123.552 123.904 -0.352 17569 3557 1 6 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.084 0.401 17569 3558 1 6 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.313 -0.613 17569 3559 1 6 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.552 -0.153 17569 3560 1 6 . 1 1 76 76 ILE H H 230 9.406 9.406 9.284 0.122 17569 3561 1 6 . 1 1 77 77 CYS N N 231 124.637 124.637 125.335 -0.698 17569 3562 1 6 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.392 -0.517 17569 3563 1 6 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.672 0.687 17569 3564 1 6 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.262 0.172 17569 3565 1 6 . 1 1 77 77 CYS H H 231 8.809 8.809 8.466 0.343 17569 3566 1 6 . 1 1 78 78 CYS N N 232 125.697 125.697 122.171 3.526 17569 3567 1 6 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.895 -0.611 17569 3568 1 6 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.275 3.609 17569 3569 1 6 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.554 1.616 17569 3570 1 6 . 1 1 78 78 CYS H H 232 8.579 8.579 8.500 0.079 17569 3571 1 6 . 1 1 79 79 ASP N N 233 123.600 123.600 125.036 -1.436 17569 3572 1 6 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.515 0.242 17569 3573 1 6 . 1 1 79 79 ASP CA C 233 56.989 56.989 53.987 3.002 17569 3574 1 6 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.685 0.944 17569 3575 1 6 . 1 1 79 79 ASP H H 233 8.577 8.577 8.220 0.357 17569 3576 1 6 . 1 1 80 80 PHE N N 234 122.100 122.100 116.252 5.848 17569 3577 1 6 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.530 -0.004 17569 3578 1 6 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.307 1.602 17569 3579 1 6 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.524 1.325 17569 3580 1 6 . 1 1 80 80 PHE H H 234 10.432 10.432 7.147 3.285 17569 3581 1 6 . 1 1 81 81 CYS N N 235 124.300 124.300 117.155 7.145 17569 3582 1 6 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.711 0.445 17569 3583 1 6 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.941 0.104 17569 3584 1 6 . 1 1 81 81 CYS CB C 235 31.407 31.407 26.786 4.621 17569 3585 1 6 . 1 1 81 81 CYS H H 235 8.476 8.476 7.879 0.597 17569 3586 1 6 . 1 1 82 82 HIS N N 236 112.598 112.598 118.632 -6.034 17569 3587 1 6 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.150 0.833 17569 3588 1 6 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.141 -1.743 17569 3589 1 6 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.482 2.775 17569 3590 1 6 . 1 1 82 82 HIS H H 236 6.699 6.699 7.931 -1.232 17569 3591 1 6 . 1 1 83 83 ASN N N 237 123.600 123.600 118.674 4.926 17569 3592 1 6 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.822 -0.021 17569 3593 1 6 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.924 2.692 17569 3594 1 6 . 1 1 83 83 ASN H H 237 9.097 9.097 7.854 1.243 17569 3595 1 6 . 1 1 84 84 ALA N N 238 122.000 122.000 124.842 -2.842 17569 3596 1 6 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.065 0.344 17569 3597 1 6 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.129 0.235 17569 3598 1 6 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.891 3.179 17569 3599 1 6 . 1 1 84 84 ALA H H 238 9.885 9.885 8.502 1.383 17569 3600 1 6 . 1 1 85 85 PHE N N 239 116.707 116.707 122.101 -5.394 17569 3601 1 6 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.159 0.869 17569 3602 1 6 . 1 1 85 85 PHE CA C 239 56.217 56.217 55.992 0.225 17569 3603 1 6 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.252 2.412 17569 3604 1 6 . 1 1 85 85 PHE H H 239 9.450 9.450 9.074 0.376 17569 3605 1 6 . 1 1 86 86 CYS N N 240 126.682 126.682 124.637 2.045 17569 3606 1 6 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.713 0.909 17569 3607 1 6 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.830 -0.488 17569 3608 1 6 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.119 3.138 17569 3609 1 6 . 1 1 86 86 CYS H H 240 11.309 11.309 9.542 1.767 17569 3610 1 6 . 1 1 87 87 LYS N N 241 117.865 117.865 123.935 -6.070 17569 3611 1 6 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.921 -0.072 17569 3612 1 6 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.202 -0.132 17569 3613 1 6 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.475 0.323 17569 3614 1 6 . 1 1 87 87 LYS H H 241 8.230 8.230 8.735 -0.505 17569 3615 1 6 . 1 1 88 88 LYS N N 242 117.949 117.949 118.518 -0.569 17569 3616 1 6 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.090 -0.112 17569 3617 1 6 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.071 1.299 17569 3618 1 6 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.096 0.220 17569 3619 1 6 . 1 1 88 88 LYS H H 242 7.945 7.945 8.523 -0.578 17569 3620 1 6 . 1 1 89 89 CYS N N 243 125.305 125.305 117.188 8.117 17569 3621 1 6 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.249 -0.507 17569 3622 1 6 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.281 2.546 17569 3623 1 6 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.070 1.171 17569 3624 1 6 . 1 1 89 89 CYS H H 243 9.297 9.297 7.627 1.670 17569 3625 1 6 . 1 1 90 90 ILE N N 244 119.687 119.687 121.705 -2.018 17569 3626 1 6 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.084 -0.477 17569 3627 1 6 . 1 1 90 90 ILE CA C 244 65.950 65.950 63.933 2.017 17569 3628 1 6 . 1 1 90 90 ILE H H 244 7.997 7.997 7.637 0.360 17569 3629 1 6 . 1 1 91 91 LEU N N 245 120.280 120.280 121.372 -1.092 17569 3630 1 6 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.369 -0.684 17569 3631 1 6 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.700 0.535 17569 3632 1 6 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.845 0.113 17569 3633 1 6 . 1 1 91 91 LEU H H 245 8.810 8.810 8.856 -0.046 17569 3634 1 6 . 1 1 92 92 ARG N N 246 116.901 116.901 117.054 -0.153 17569 3635 1 6 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.156 -0.339 17569 3636 1 6 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.677 1.303 17569 3637 1 6 . 1 1 92 92 ARG CB C 246 30.600 30.600 29.967 0.633 17569 3638 1 6 . 1 1 92 92 ARG H H 246 8.086 8.086 7.645 0.441 17569 3639 1 6 . 1 1 93 93 ASN N N 247 111.200 111.200 116.232 -5.032 17569 3640 1 6 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.499 0.104 17569 3641 1 6 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.594 1.214 17569 3642 1 6 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.102 3.382 17569 3643 1 6 . 1 1 93 93 ASN H H 247 7.136 7.136 8.201 -1.065 17569 3644 1 6 . 1 1 94 94 LEU N N 248 118.807 118.807 117.300 1.507 17569 3645 1 6 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.608 0.206 17569 3646 1 6 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.024 0.165 17569 3647 1 6 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.729 -0.031 17569 3648 1 6 . 1 1 94 94 LEU H H 248 8.515 8.515 7.954 0.561 17569 3649 1 6 . 1 1 95 95 GLY N N 249 108.000 108.000 106.239 1.761 17569 3650 1 6 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.745 -0.117 17569 3651 1 6 . 1 1 95 95 GLY H H 249 7.955 7.955 7.874 0.081 17569 3652 1 6 . 1 1 96 96 ARG N N 250 117.797 117.797 121.857 -4.060 17569 3653 1 6 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.228 -0.385 17569 3654 1 6 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.168 0.514 17569 3655 1 6 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.204 -0.344 17569 3656 1 6 . 1 1 96 96 ARG H H 250 8.559 8.559 8.580 -0.021 17569 3657 1 6 . 1 1 97 97 LYS N N 251 120.900 120.900 119.719 1.181 17569 3658 1 6 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.022 0.134 17569 3659 1 6 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.401 -0.245 17569 3660 1 6 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.726 -0.366 17569 3661 1 6 . 1 1 97 97 LYS H H 251 8.655 8.655 8.484 0.171 17569 3662 1 6 . 1 1 98 98 GLU N N 252 122.000 122.000 118.767 3.233 17569 3663 1 6 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.104 0.247 17569 3664 1 6 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.210 -0.628 17569 3665 1 6 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.405 -1.005 17569 3666 1 6 . 1 1 98 98 GLU H H 252 7.705 7.705 8.430 -0.725 17569 3667 1 6 . 1 1 99 99 LEU N N 253 117.400 117.400 120.758 -3.358 17569 3668 1 6 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.797 0.120 17569 3669 1 6 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.087 -0.089 17569 3670 1 6 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.839 -0.357 17569 3671 1 6 . 1 1 99 99 LEU H H 253 7.285 7.285 7.692 -0.407 17569 3672 1 6 . 1 1 100 100 SER N N 254 112.100 112.100 114.101 -2.001 17569 3673 1 6 . 1 1 100 100 SER HA H 254 4.107 4.107 4.109 -0.002 17569 3674 1 6 . 1 1 100 100 SER CA C 254 61.603 61.603 61.801 -0.198 17569 3675 1 6 . 1 1 100 100 SER CB C 254 62.622 62.622 63.096 -0.474 17569 3676 1 6 . 1 1 100 100 SER H H 254 8.326 8.326 7.997 0.329 17569 3677 1 6 . 1 1 101 101 THR N N 255 118.151 118.151 118.612 -0.461 17569 3678 1 6 . 1 1 101 101 THR HA H 255 4.026 4.026 4.048 -0.022 17569 3679 1 6 . 1 1 101 101 THR CA C 255 66.261 66.261 66.525 -0.264 17569 3680 1 6 . 1 1 101 101 THR CB C 255 68.735 68.735 68.882 -0.147 17569 3681 1 6 . 1 1 101 101 THR H H 255 7.972 7.972 7.800 0.172 17569 3682 1 6 . 1 1 102 102 ILE N N 256 120.100 120.100 122.748 -2.648 17569 3683 1 6 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.636 -0.173 17569 3684 1 6 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.915 -0.141 17569 3685 1 6 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.508 0.234 17569 3686 1 6 . 1 1 102 102 ILE H H 256 7.868 7.868 8.522 -0.654 17569 3687 1 6 . 1 1 103 103 MET N N 257 114.876 114.876 116.103 -1.227 17569 3688 1 6 . 1 1 103 103 MET HA H 257 4.211 4.211 4.074 0.137 17569 3689 1 6 . 1 1 103 103 MET CA C 257 55.691 55.691 58.374 -2.683 17569 3690 1 6 . 1 1 103 103 MET CB C 257 32.000 32.000 32.726 -0.726 17569 3691 1 6 . 1 1 103 103 MET H H 257 7.606 7.606 7.249 0.357 17569 3692 1 6 . 1 1 104 104 ASP N N 258 119.976 119.976 118.556 1.420 17569 3693 1 6 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.783 -0.245 17569 3694 1 6 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.409 1.503 17569 3695 1 6 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.234 1.266 17569 3696 1 6 . 1 1 104 104 ASP H H 258 7.444 7.444 7.563 -0.119 17569 3697 1 6 . 1 1 105 105 GLU N N 259 124.388 124.388 121.799 2.589 17569 3698 1 6 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.541 -0.254 17569 3699 1 6 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.664 2.907 17569 3700 1 6 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.595 -0.053 17569 3701 1 6 . 1 1 105 105 GLU H H 259 8.559 8.559 8.263 0.296 17569 3702 1 6 . 1 1 106 106 ASN N N 260 117.201 117.201 119.411 -2.210 17569 3703 1 6 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.414 0.328 17569 3704 1 6 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.955 -0.212 17569 3705 1 6 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.605 1.313 17569 3706 1 6 . 1 1 106 106 ASN H H 260 8.673 8.673 8.281 0.392 17569 3707 1 6 . 1 1 107 107 ASN N N 261 117.900 117.900 112.467 5.433 17569 3708 1 6 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.300 0.685 17569 3709 1 6 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.688 -2.386 17569 3710 1 6 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.322 3.292 17569 3711 1 6 . 1 1 107 107 ASN H H 261 7.956 7.956 8.756 -0.800 17569 3712 1 6 . 1 1 108 108 GLN N N 262 121.500 121.500 114.853 6.647 17569 3713 1 6 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.056 0.552 17569 3714 1 6 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.419 1.357 17569 3715 1 6 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.936 0.622 17569 3716 1 6 . 1 1 108 108 GLN H H 262 8.493 8.493 7.626 0.867 17569 3717 1 6 . 1 1 109 109 TRP N N 263 128.056 128.056 123.042 5.014 17569 3718 1 6 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.654 0.317 17569 3719 1 6 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.488 0.609 17569 3720 1 6 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.754 0.739 17569 3721 1 6 . 1 1 109 109 TRP H H 263 10.497 10.497 8.017 2.480 17569 3722 1 6 . 1 1 110 110 TYR N N 264 126.600 126.600 125.867 0.733 17569 3723 1 6 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.259 0.143 17569 3724 1 6 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.590 -2.918 17569 3725 1 6 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.972 -0.965 17569 3726 1 6 . 1 1 110 110 TYR H H 264 7.545 7.545 8.163 -0.618 17569 3727 1 6 . 1 1 111 111 CYS N N 265 124.622 124.622 115.151 9.471 17569 3728 1 6 . 1 1 111 111 CYS H H 265 8.586 8.586 8.694 -0.108 17569 3729 1 6 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.829 -0.637 17569 3730 1 6 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.563 1.152 17569 3731 1 6 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.712 1.208 17569 3732 1 6 . 1 1 113 113 ILE N N 267 119.504 119.504 119.787 -0.283 17569 3733 1 6 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.709 -0.759 17569 3734 1 6 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.969 0.280 17569 3735 1 6 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.548 -3.015 17569 3736 1 6 . 1 1 113 113 ILE H H 267 9.160 9.160 7.510 1.650 17569 3737 1 6 . 1 1 114 114 CYS N N 268 124.100 124.100 118.360 5.740 17569 3738 1 6 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.170 -0.356 17569 3739 1 6 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.663 3.637 17569 3740 1 6 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.073 2.648 17569 3741 1 6 . 1 1 114 114 CYS H H 268 7.818 7.818 8.235 -0.417 17569 3742 1 6 . 1 1 115 115 HIS N N 269 117.127 117.127 111.323 5.804 17569 3743 1 6 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.658 0.471 17569 3744 1 6 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.006 -0.845 17569 3745 1 6 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.841 2.350 17569 3746 1 6 . 1 1 115 115 HIS H H 269 8.953 8.953 7.785 1.168 17569 3747 1 6 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.463 0.479 17569 3748 1 6 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.477 -0.169 17569 3749 1 6 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.727 0.915 17569 3750 1 6 . 1 1 117 117 GLU N N 271 123.504 123.504 123.474 0.030 17569 3751 1 6 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.425 -0.405 17569 3752 1 6 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.686 4.183 17569 3753 1 6 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.172 -2.121 17569 3754 1 6 . 1 1 117 117 GLU H H 271 8.402 8.402 8.202 0.200 17569 3755 1 6 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.566 -0.024 17569 3756 1 6 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.642 1.717 17569 3757 1 6 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.439 0.703 17569 3758 1 6 . 1 1 119 119 LEU N N 273 112.296 112.296 114.950 -2.654 17569 3759 1 6 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.915 -0.441 17569 3760 1 6 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.436 0.106 17569 3761 1 6 . 1 1 119 119 LEU H H 273 8.090 8.090 7.506 0.584 17569 3762 1 6 . 1 1 120 120 LEU N N 274 121.388 121.388 123.323 -1.935 17569 3763 1 6 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.954 0.073 17569 3764 1 6 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.462 -0.161 17569 3765 1 6 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.267 0.833 17569 3766 1 6 . 1 1 120 120 LEU H H 274 7.823 7.823 8.461 -0.638 17569 3767 1 6 . 1 1 121 121 ASP N N 275 118.600 118.600 118.980 -0.380 17569 3768 1 6 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.353 0.188 17569 3769 1 6 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.717 -0.014 17569 3770 1 6 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.138 -0.695 17569 3771 1 6 . 1 1 121 121 ASP H H 275 8.694 8.694 8.344 0.350 17569 3772 1 6 . 1 1 122 122 LEU N N 276 123.192 123.192 120.485 2.707 17569 3773 1 6 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.892 0.500 17569 3774 1 6 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.964 0.007 17569 3775 1 6 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.051 0.491 17569 3776 1 6 . 1 1 122 122 LEU H H 276 8.013 8.013 8.031 -0.018 17569 3777 1 6 . 1 1 123 123 VAL N N 277 126.898 126.898 118.537 8.361 17569 3778 1 6 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.689 0.166 17569 3779 1 6 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.741 -0.078 17569 3780 1 6 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.933 1.125 17569 3781 1 6 . 1 1 123 123 VAL H H 277 8.781 8.781 7.736 1.045 17569 3782 1 6 . 1 1 124 124 THR N N 278 117.500 117.500 116.267 1.233 17569 3783 1 6 . 1 1 124 124 THR HA H 278 4.030 4.030 3.943 0.087 17569 3784 1 6 . 1 1 124 124 THR CA C 278 66.589 66.589 67.016 -0.427 17569 3785 1 6 . 1 1 124 124 THR CB C 278 68.410 68.410 68.525 -0.115 17569 3786 1 6 . 1 1 124 124 THR H H 278 8.722 8.722 8.230 0.492 17569 3787 1 6 . 1 1 125 125 ALA N N 279 124.700 124.700 123.935 0.765 17569 3788 1 6 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.077 0.184 17569 3789 1 6 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.029 0.267 17569 3790 1 6 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.081 -0.132 17569 3791 1 6 . 1 1 125 125 ALA H H 279 8.239 8.239 7.782 0.457 17569 3792 1 6 . 1 1 126 126 CYS N N 280 119.276 119.276 117.881 1.395 17569 3793 1 6 . 1 1 126 126 CYS HA H 280 4.114 4.114 4.010 0.104 17569 3794 1 6 . 1 1 126 126 CYS CA C 280 62.103 62.103 62.310 -0.207 17569 3795 1 6 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.109 -0.613 17569 3796 1 6 . 1 1 126 126 CYS H H 280 8.128 8.128 7.813 0.315 17569 3797 1 6 . 1 1 127 127 ASN N N 281 118.000 118.000 118.579 -0.579 17569 3798 1 6 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.487 0.073 17569 3799 1 6 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.933 -0.794 17569 3800 1 6 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.170 -1.205 17569 3801 1 6 . 1 1 127 127 ASN H H 281 8.725 8.725 8.069 0.656 17569 3802 1 6 . 1 1 128 128 SER N N 282 116.601 116.601 116.947 -0.346 17569 3803 1 6 . 1 1 128 128 SER HA H 282 4.363 4.363 4.167 0.196 17569 3804 1 6 . 1 1 128 128 SER CA C 282 61.899 61.899 61.792 0.107 17569 3805 1 6 . 1 1 128 128 SER CB C 282 62.630 62.630 63.129 -0.499 17569 3806 1 6 . 1 1 128 128 SER H H 282 8.542 8.542 7.521 1.021 17569 3807 1 6 . 1 1 129 129 VAL N N 283 123.272 123.272 122.090 1.182 17569 3808 1 6 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.500 0.177 17569 3809 1 6 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.406 0.102 17569 3810 1 6 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.503 -0.285 17569 3811 1 6 . 1 1 129 129 VAL H H 283 7.990 7.990 7.621 0.369 17569 3812 1 6 . 1 1 130 130 PHE N N 284 118.594 118.594 119.286 -0.692 17569 3813 1 6 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.249 -0.236 17569 3814 1 6 . 1 1 130 130 PHE CA C 284 63.500 63.500 60.961 2.539 17569 3815 1 6 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.469 0.527 17569 3816 1 6 . 1 1 130 130 PHE H H 284 8.190 8.190 8.481 -0.291 17569 3817 1 6 . 1 1 131 131 GLU N N 285 120.905 120.905 120.342 0.563 17569 3818 1 6 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.999 0.206 17569 3819 1 6 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.894 -0.680 17569 3820 1 6 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.410 0.090 17569 3821 1 6 . 1 1 131 131 GLU H H 285 8.699 8.699 8.952 -0.253 17569 3822 1 6 . 1 1 132 132 ASN N N 286 117.997 117.997 118.641 -0.644 17569 3823 1 6 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.628 -0.033 17569 3824 1 6 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.367 -0.752 17569 3825 1 6 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.652 0.200 17569 3826 1 6 . 1 1 132 132 ASN H H 286 8.082 8.082 7.942 0.140 17569 3827 1 6 . 1 1 133 133 LEU N N 287 120.800 120.800 121.995 -1.195 17569 3828 1 6 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.270 -0.153 17569 3829 1 6 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.265 -0.467 17569 3830 1 6 . 1 1 133 133 LEU H H 287 7.904 7.904 8.335 -0.431 17569 3831 1 6 . 1 1 134 134 GLU N N 288 118.200 118.200 118.962 -0.762 17569 3832 1 6 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.889 0.190 17569 3833 1 6 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.744 -0.747 17569 3834 1 6 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.418 -0.175 17569 3835 1 6 . 1 1 134 134 GLU H H 288 8.157 8.157 8.407 -0.250 17569 3836 1 6 . 1 1 135 135 GLN N N 289 117.400 117.400 119.863 -2.463 17569 3837 1 6 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.060 0.114 17569 3838 1 6 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.697 -0.708 17569 3839 1 6 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.777 -0.697 17569 3840 1 6 . 1 1 135 135 GLN H H 289 7.869 7.869 7.528 0.341 17569 3841 1 6 . 1 1 136 136 LEU N N 290 121.000 121.000 121.089 -0.089 17569 3842 1 6 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.798 0.375 17569 3843 1 6 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.824 -0.686 17569 3844 1 6 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.462 0.538 17569 3845 1 6 . 1 1 136 136 LEU H H 290 7.968 7.968 7.795 0.173 17569 3846 1 6 . 1 1 137 137 LEU N N 291 118.900 118.900 117.825 1.075 17569 3847 1 6 . 1 1 137 137 LEU HA H 291 4.241 4.241 3.954 0.287 17569 3848 1 6 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.374 -1.014 17569 3849 1 6 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.164 -0.692 17569 3850 1 6 . 1 1 137 137 LEU H H 291 8.154 8.154 7.679 0.475 17569 3851 1 6 . 1 1 138 138 GLN N N 292 117.993 117.993 116.831 1.162 17569 3852 1 6 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.205 0.067 17569 3853 1 6 . 1 1 138 138 GLN CA C 292 56.632 56.632 56.949 -0.317 17569 3854 1 6 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.747 -1.163 17569 3855 1 6 . 1 1 138 138 GLN H H 292 7.896 7.896 7.694 0.202 17569 3856 1 6 . 1 1 139 139 GLN N N 293 118.889 118.889 118.433 0.456 17569 3857 1 6 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.468 -0.199 17569 3858 1 6 . 1 1 139 139 GLN CA C 293 56.454 56.454 54.829 1.625 17569 3859 1 6 . 1 1 139 139 GLN CB C 293 29.069 29.069 30.462 -1.393 17569 3860 1 6 . 1 1 139 139 GLN H H 293 8.091 8.091 8.209 -0.118 17569 3861 1 6 . 1 1 140 140 ASN N N 294 118.604 118.604 116.684 1.920 17569 3862 1 6 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.626 0.133 17569 3863 1 6 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.573 -0.352 17569 3864 1 6 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.426 -0.693 17569 3865 1 6 . 1 1 140 140 ASN H H 294 8.273 8.273 8.462 -0.189 17569 3866 1 6 . 1 1 141 141 LYS N N 295 121.685 121.685 120.155 1.530 17569 3867 1 6 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.499 -0.139 17569 3868 1 6 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.138 0.035 17569 3869 1 6 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.736 -1.201 17569 3870 1 6 . 1 1 141 141 LYS H H 295 8.089 8.089 8.097 -0.008 17569 3871 1 7 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.880 -0.493 17569 3872 1 7 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.346 0.099 17569 3873 1 7 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.794 -0.538 17569 3874 1 7 . 1 1 3 3 MET HA H 157 4.476 4.476 4.771 -0.295 17569 3875 1 7 . 1 1 3 3 MET CA C 157 55.401 55.401 55.058 0.343 17569 3876 1 7 . 1 1 4 4 ALA N N 158 124.828 124.828 124.216 0.612 17569 3877 1 7 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.651 -0.337 17569 3878 1 7 . 1 1 4 4 ALA CA C 158 52.511 52.511 52.183 0.328 17569 3879 1 7 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.805 -1.804 17569 3880 1 7 . 1 1 4 4 ALA H H 158 8.382 8.382 8.388 -0.006 17569 3881 1 7 . 1 1 5 5 ASP N N 159 119.418 119.418 120.680 -1.262 17569 3882 1 7 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.756 -0.166 17569 3883 1 7 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.780 0.356 17569 3884 1 7 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.508 -0.493 17569 3885 1 7 . 1 1 5 5 ASP H H 159 8.312 8.312 8.388 -0.076 17569 3886 1 7 . 1 1 6 6 LYS N N 160 121.604 121.604 119.828 1.776 17569 3887 1 7 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.608 -0.265 17569 3888 1 7 . 1 1 6 6 LYS H H 160 8.274 8.274 7.848 0.426 17569 3889 1 7 . 1 1 7 7 ARG N N 161 121.611 121.611 121.772 -0.161 17569 3890 1 7 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.428 -0.101 17569 3891 1 7 . 1 1 7 7 ARG H H 161 8.430 8.430 8.779 -0.349 17569 3892 1 7 . 1 1 8 8 GLY N N 162 109.606 109.606 113.324 -3.718 17569 3893 1 7 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.958 0.089 17569 3894 1 7 . 1 1 8 8 GLY H H 162 8.473 8.473 8.755 -0.282 17569 3895 1 7 . 1 1 9 9 ASP N N 163 120.187 120.187 119.685 0.502 17569 3896 1 7 . 1 1 9 9 ASP HA H 163 4.649 4.649 5.005 -0.356 17569 3897 1 7 . 1 1 9 9 ASP CA C 163 54.151 54.151 52.631 1.520 17569 3898 1 7 . 1 1 9 9 ASP H H 163 8.296 8.296 8.160 0.136 17569 3899 1 7 . 1 1 10 10 GLY N N 164 108.816 108.816 108.723 0.093 17569 3900 1 7 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.917 0.450 17569 3901 1 7 . 1 1 10 10 GLY H H 164 8.458 8.458 8.310 0.148 17569 3902 1 7 . 1 1 11 11 LEU N N 165 121.195 121.195 119.954 1.241 17569 3903 1 7 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.648 -0.332 17569 3904 1 7 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.231 0.769 17569 3905 1 7 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.580 -2.647 17569 3906 1 7 . 1 1 11 11 LEU H H 165 8.137 8.137 7.994 0.143 17569 3907 1 7 . 1 1 12 12 HIS N N 166 119.387 119.387 117.535 1.852 17569 3908 1 7 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.801 -0.146 17569 3909 1 7 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.180 1.089 17569 3910 1 7 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.057 -0.360 17569 3911 1 7 . 1 1 12 12 HIS H H 166 8.270 8.270 8.328 -0.058 17569 3912 1 7 . 1 1 13 13 GLY N N 167 109.899 109.899 109.161 0.738 17569 3913 1 7 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.578 0.527 17569 3914 1 7 . 1 1 13 13 GLY H H 167 8.276 8.276 8.561 -0.285 17569 3915 1 7 . 1 1 14 14 ILE N N 168 119.597 119.597 118.601 0.996 17569 3916 1 7 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.187 0.136 17569 3917 1 7 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.211 0.389 17569 3918 1 7 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.766 -2.816 17569 3919 1 7 . 1 1 14 14 ILE H H 168 7.962 7.962 7.887 0.075 17569 3920 1 7 . 1 1 15 15 VAL N N 169 127.578 127.578 125.406 2.172 17569 3921 1 7 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.132 0.148 17569 3922 1 7 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.228 -0.911 17569 3923 1 7 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.672 2.730 17569 3924 1 7 . 1 1 15 15 VAL H H 169 9.011 9.011 8.411 0.600 17569 3925 1 7 . 1 1 16 16 SER N N 170 118.596 118.596 119.223 -0.627 17569 3926 1 7 . 1 1 16 16 SER HA H 170 5.140 5.140 4.732 0.408 17569 3927 1 7 . 1 1 16 16 SER CA C 170 55.985 55.985 56.019 -0.034 17569 3928 1 7 . 1 1 16 16 SER CB C 170 65.261 65.261 65.697 -0.436 17569 3929 1 7 . 1 1 16 16 SER H H 170 8.242 8.242 7.718 0.524 17569 3930 1 7 . 1 1 17 17 CYS N N 171 123.783 123.783 122.938 0.845 17569 3931 1 7 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.167 0.014 17569 3932 1 7 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.379 -0.535 17569 3933 1 7 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.713 2.660 17569 3934 1 7 . 1 1 17 17 CYS H H 171 8.894 8.894 8.519 0.375 17569 3935 1 7 . 1 1 18 18 THR N N 172 121.703 121.703 117.779 3.924 17569 3936 1 7 . 1 1 18 18 THR HA H 172 4.386 4.386 4.109 0.277 17569 3937 1 7 . 1 1 18 18 THR CA C 172 64.667 64.667 64.152 0.515 17569 3938 1 7 . 1 1 18 18 THR CB C 172 69.498 69.498 68.526 0.972 17569 3939 1 7 . 1 1 18 18 THR H H 172 8.788 8.788 8.241 0.547 17569 3940 1 7 . 1 1 19 19 ALA N N 173 131.364 131.364 121.954 9.410 17569 3941 1 7 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.173 0.323 17569 3942 1 7 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.528 0.497 17569 3943 1 7 . 1 1 19 19 ALA CB C 173 22.182 22.182 19.025 3.157 17569 3944 1 7 . 1 1 19 19 ALA H H 173 9.680 9.680 7.949 1.731 17569 3945 1 7 . 1 1 20 20 CYS N N 174 115.498 115.498 113.940 1.558 17569 3946 1 7 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.384 0.584 17569 3947 1 7 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.336 -1.242 17569 3948 1 7 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.447 3.797 17569 3949 1 7 . 1 1 20 20 CYS H H 174 8.470 8.470 7.623 0.847 17569 3950 1 7 . 1 1 21 21 GLY N N 175 112.464 112.464 108.439 4.025 17569 3951 1 7 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.218 0.488 17569 3952 1 7 . 1 1 21 21 GLY H H 175 7.884 7.884 7.902 -0.018 17569 3953 1 7 . 1 1 22 22 GLN N N 176 121.784 121.784 117.799 3.985 17569 3954 1 7 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.510 -0.134 17569 3955 1 7 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.741 1.550 17569 3956 1 7 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.064 -2.723 17569 3957 1 7 . 1 1 22 22 GLN H H 176 8.723 8.723 7.960 0.763 17569 3958 1 7 . 1 1 23 23 GLN N N 177 122.900 122.900 122.521 0.379 17569 3959 1 7 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.325 0.205 17569 3960 1 7 . 1 1 23 23 GLN CA C 177 56.550 56.550 57.258 -0.709 17569 3961 1 7 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.255 -0.795 17569 3962 1 7 . 1 1 23 23 GLN H H 177 8.721 8.721 8.566 0.155 17569 3963 1 7 . 1 1 24 24 VAL N N 178 121.000 121.000 123.951 -2.951 17569 3964 1 7 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.003 0.521 17569 3965 1 7 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.495 -2.618 17569 3966 1 7 . 1 1 24 24 VAL H H 178 8.689 8.689 7.860 0.829 17569 3967 1 7 . 1 1 25 25 ASN N N 179 121.392 121.392 122.831 -1.439 17569 3968 1 7 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.345 0.531 17569 3969 1 7 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.639 -2.490 17569 3970 1 7 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.745 -0.768 17569 3971 1 7 . 1 1 25 25 ASN H H 179 8.635 8.635 8.098 0.537 17569 3972 1 7 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.035 0.425 17569 3973 1 7 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.549 -1.551 17569 3974 1 7 . 1 1 27 27 PHE CB C 181 38.393 38.393 37.416 0.977 17569 3975 1 7 . 1 1 28 28 GLN N N 182 119.300 119.300 119.541 -0.241 17569 3976 1 7 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.384 0.134 17569 3977 1 7 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.214 -1.872 17569 3978 1 7 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.380 -0.030 17569 3979 1 7 . 1 1 28 28 GLN H H 182 7.494 7.494 7.721 -0.227 17569 3980 1 7 . 1 1 29 29 LYS N N 183 124.516 124.516 125.112 -0.596 17569 3981 1 7 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.486 -0.564 17569 3982 1 7 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.472 1.840 17569 3983 1 7 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.459 -0.173 17569 3984 1 7 . 1 1 29 29 LYS H H 183 8.779 8.779 8.565 0.214 17569 3985 1 7 . 1 1 30 30 ASP N N 184 116.500 116.500 118.203 -1.703 17569 3986 1 7 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.768 -0.309 17569 3987 1 7 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.435 0.101 17569 3988 1 7 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.040 -1.069 17569 3989 1 7 . 1 1 30 30 ASP H H 184 8.556 8.556 8.170 0.386 17569 3990 1 7 . 1 1 31 31 SER N N 185 111.505 111.505 115.265 -3.760 17569 3991 1 7 . 1 1 31 31 SER HA H 185 4.695 4.695 4.703 -0.008 17569 3992 1 7 . 1 1 31 31 SER CA C 185 59.747 59.747 58.108 1.639 17569 3993 1 7 . 1 1 31 31 SER CB C 185 65.198 65.198 63.503 1.695 17569 3994 1 7 . 1 1 31 31 SER H H 185 7.933 7.933 8.455 -0.522 17569 3995 1 7 . 1 1 32 32 ILE N N 186 113.394 113.394 116.335 -2.941 17569 3996 1 7 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.104 -0.218 17569 3997 1 7 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.354 -0.775 17569 3998 1 7 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.724 1.088 17569 3999 1 7 . 1 1 32 32 ILE H H 186 7.105 7.105 7.555 -0.450 17569 4000 1 7 . 1 1 33 33 TYR N N 187 119.098 119.098 120.800 -1.702 17569 4001 1 7 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.128 -0.605 17569 4002 1 7 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.971 1.288 17569 4003 1 7 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.666 2.774 17569 4004 1 7 . 1 1 33 33 TYR H H 187 8.954 8.954 7.872 1.082 17569 4005 1 7 . 1 1 34 34 ARG N N 188 118.502 118.502 122.622 -4.120 17569 4006 1 7 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.842 -0.205 17569 4007 1 7 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.288 -1.536 17569 4008 1 7 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.119 1.132 17569 4009 1 7 . 1 1 34 34 ARG H H 188 8.412 8.412 8.552 -0.140 17569 4010 1 7 . 1 1 35 35 HIS N N 189 126.596 126.596 127.762 -1.166 17569 4011 1 7 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.920 -0.328 17569 4012 1 7 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.884 -0.163 17569 4013 1 7 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.161 1.311 17569 4014 1 7 . 1 1 35 35 HIS H H 189 9.813 9.813 9.092 0.721 17569 4015 1 7 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.619 -0.321 17569 4016 1 7 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.888 0.388 17569 4017 1 7 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.246 0.605 17569 4018 1 7 . 1 1 37 37 SER N N 191 110.003 110.003 114.003 -4.000 17569 4019 1 7 . 1 1 37 37 SER HA H 191 4.918 4.918 4.301 0.617 17569 4020 1 7 . 1 1 37 37 SER CA C 191 59.031 59.031 60.942 -1.911 17569 4021 1 7 . 1 1 37 37 SER CB C 191 65.104 65.104 63.291 1.813 17569 4022 1 7 . 1 1 37 37 SER H H 191 8.934 8.934 8.547 0.387 17569 4023 1 7 . 1 1 38 38 LEU N N 192 120.959 120.959 113.717 7.242 17569 4024 1 7 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.912 -0.783 17569 4025 1 7 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.244 1.902 17569 4026 1 7 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.493 1.503 17569 4027 1 7 . 1 1 38 38 LEU H H 192 8.649 8.649 7.034 1.615 17569 4028 1 7 . 1 1 39 39 GLN N N 193 108.600 108.600 119.233 -10.633 17569 4029 1 7 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.119 -0.214 17569 4030 1 7 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.634 0.180 17569 4031 1 7 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.967 -1.933 17569 4032 1 7 . 1 1 39 39 GLN H H 193 8.465 8.465 7.848 0.617 17569 4033 1 7 . 1 1 40 40 VAL N N 194 105.325 105.325 118.869 -13.544 17569 4034 1 7 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.468 0.082 17569 4035 1 7 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.712 -1.071 17569 4036 1 7 . 1 1 40 40 VAL H H 194 6.256 6.256 7.909 -1.653 17569 4037 1 7 . 1 1 41 41 LEU N N 195 123.100 123.100 122.543 0.557 17569 4038 1 7 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.742 0.074 17569 4039 1 7 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.562 3.620 17569 4040 1 7 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.107 0.463 17569 4041 1 7 . 1 1 41 41 LEU H H 195 9.154 9.154 8.543 0.611 17569 4042 1 7 . 1 1 42 42 ILE N N 196 124.396 124.396 117.283 7.113 17569 4043 1 7 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.838 1.514 17569 4044 1 7 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.238 0.992 17569 4045 1 7 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.857 1.413 17569 4046 1 7 . 1 1 42 42 ILE H H 196 9.766 9.766 7.824 1.942 17569 4047 1 7 . 1 1 43 43 CYS N N 197 121.500 121.500 114.831 6.669 17569 4048 1 7 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.281 -0.019 17569 4049 1 7 . 1 1 43 43 CYS CA C 197 56.703 56.703 55.884 0.819 17569 4050 1 7 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.056 2.244 17569 4051 1 7 . 1 1 43 43 CYS H H 197 9.882 9.882 8.320 1.562 17569 4052 1 7 . 1 1 44 44 LYS N N 198 117.995 117.995 121.247 -3.252 17569 4053 1 7 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.201 -0.212 17569 4054 1 7 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.881 -1.221 17569 4055 1 7 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.636 0.064 17569 4056 1 7 . 1 1 44 44 LYS H H 198 8.089 8.089 8.624 -0.535 17569 4057 1 7 . 1 1 45 45 ASN N N 199 119.200 119.200 117.451 1.749 17569 4058 1 7 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.580 -0.066 17569 4059 1 7 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.071 0.649 17569 4060 1 7 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.095 0.072 17569 4061 1 7 . 1 1 45 45 ASN H H 199 8.356 8.356 8.661 -0.305 17569 4062 1 7 . 1 1 46 46 CYS N N 200 126.600 126.600 118.440 8.160 17569 4063 1 7 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.002 0.179 17569 4064 1 7 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.064 2.431 17569 4065 1 7 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.180 2.002 17569 4066 1 7 . 1 1 46 46 CYS H H 200 9.189 9.189 7.722 1.467 17569 4067 1 7 . 1 1 47 47 PHE N N 201 121.962 121.962 120.801 1.161 17569 4068 1 7 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.112 -0.242 17569 4069 1 7 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.363 1.906 17569 4070 1 7 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.557 0.610 17569 4071 1 7 . 1 1 47 47 PHE H H 201 8.826 8.826 7.881 0.945 17569 4072 1 7 . 1 1 48 48 LYS N N 202 117.400 117.400 120.245 -2.845 17569 4073 1 7 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.875 -0.177 17569 4074 1 7 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.153 -1.201 17569 4075 1 7 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.324 -0.782 17569 4076 1 7 . 1 1 48 48 LYS H H 202 8.512 8.512 8.142 0.370 17569 4077 1 7 . 1 1 49 49 TYR N N 203 120.400 120.400 120.577 -0.177 17569 4078 1 7 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.244 0.170 17569 4079 1 7 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.431 -0.659 17569 4080 1 7 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.698 -0.252 17569 4081 1 7 . 1 1 49 49 TYR H H 203 8.133 8.133 7.797 0.336 17569 4082 1 7 . 1 1 50 50 TYR N N 204 121.783 121.783 118.386 3.397 17569 4083 1 7 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.663 -1.168 17569 4084 1 7 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.841 3.109 17569 4085 1 7 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.406 1.086 17569 4086 1 7 . 1 1 50 50 TYR H H 204 8.765 8.765 7.616 1.149 17569 4087 1 7 . 1 1 51 51 MET N N 205 110.800 110.800 115.551 -4.751 17569 4088 1 7 . 1 1 51 51 MET HA H 205 4.349 4.349 4.167 0.182 17569 4089 1 7 . 1 1 51 51 MET CA C 205 53.505 53.505 57.452 -3.946 17569 4090 1 7 . 1 1 51 51 MET CB C 205 30.384 30.384 33.023 -2.639 17569 4091 1 7 . 1 1 51 51 MET H H 205 7.771 7.771 8.498 -0.727 17569 4092 1 7 . 1 1 52 52 SER N N 206 116.800 116.800 113.048 3.752 17569 4093 1 7 . 1 1 52 52 SER HA H 206 3.919 3.919 4.368 -0.449 17569 4094 1 7 . 1 1 52 52 SER CA C 206 61.621 61.621 60.061 1.560 17569 4095 1 7 . 1 1 52 52 SER CB C 206 62.611 62.611 64.318 -1.707 17569 4096 1 7 . 1 1 52 52 SER H H 206 7.581 7.581 8.238 -0.657 17569 4097 1 7 . 1 1 53 53 ASP N N 207 117.400 117.400 121.595 -4.195 17569 4098 1 7 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.816 -0.244 17569 4099 1 7 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.516 -0.417 17569 4100 1 7 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.295 -0.107 17569 4101 1 7 . 1 1 53 53 ASP H H 207 7.085 7.085 8.113 -1.028 17569 4102 1 7 . 1 1 54 54 ASP N N 208 119.405 119.405 122.931 -3.526 17569 4103 1 7 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.949 -0.560 17569 4104 1 7 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.590 0.310 17569 4105 1 7 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.501 -1.152 17569 4106 1 7 . 1 1 54 54 ASP H H 208 8.439 8.439 8.389 0.050 17569 4107 1 7 . 1 1 55 55 ILE N N 209 124.698 124.698 121.251 3.447 17569 4108 1 7 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.297 -0.297 17569 4109 1 7 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.551 1.727 17569 4110 1 7 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.948 1.343 17569 4111 1 7 . 1 1 55 55 ILE H H 209 8.128 8.128 8.466 -0.338 17569 4112 1 7 . 1 1 56 56 SER N N 210 126.703 126.703 121.298 5.405 17569 4113 1 7 . 1 1 56 56 SER HA H 210 4.365 4.365 4.821 -0.456 17569 4114 1 7 . 1 1 56 56 SER CA C 210 57.769 57.769 56.790 0.979 17569 4115 1 7 . 1 1 56 56 SER CB C 210 64.991 64.991 64.519 0.472 17569 4116 1 7 . 1 1 56 56 SER H H 210 8.815 8.815 8.507 0.308 17569 4117 1 7 . 1 1 57 57 ARG N N 211 116.885 116.885 119.900 -3.015 17569 4118 1 7 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.795 0.247 17569 4119 1 7 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.861 -1.461 17569 4120 1 7 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.450 2.834 17569 4121 1 7 . 1 1 57 57 ARG H H 211 8.365 8.365 8.542 -0.177 17569 4122 1 7 . 1 1 58 58 ASP N N 212 121.982 121.982 123.295 -1.313 17569 4123 1 7 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.888 -0.273 17569 4124 1 7 . 1 1 58 58 ASP CA C 212 52.222 52.222 52.946 -0.724 17569 4125 1 7 . 1 1 58 58 ASP CB C 212 41.502 41.502 44.113 -2.611 17569 4126 1 7 . 1 1 58 58 ASP H H 212 8.706 8.706 8.694 0.012 17569 4127 1 7 . 1 1 59 59 SER N N 213 114.164 114.164 114.236 -0.072 17569 4128 1 7 . 1 1 59 59 SER HA H 213 4.212 4.212 4.125 0.087 17569 4129 1 7 . 1 1 59 59 SER CA C 213 60.840 60.840 60.851 -0.011 17569 4130 1 7 . 1 1 59 59 SER CB C 213 62.714 62.714 62.864 -0.150 17569 4131 1 7 . 1 1 59 59 SER H H 213 8.687 8.687 8.511 0.176 17569 4132 1 7 . 1 1 60 60 ASP N N 214 120.899 120.899 122.397 -1.498 17569 4133 1 7 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.802 0.023 17569 4134 1 7 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.898 0.313 17569 4135 1 7 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.995 0.562 17569 4136 1 7 . 1 1 60 60 ASP H H 214 8.193 8.193 8.202 -0.009 17569 4137 1 7 . 1 1 61 61 GLY N N 215 108.300 108.300 108.340 -0.040 17569 4138 1 7 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.641 -0.244 17569 4139 1 7 . 1 1 61 61 GLY H H 215 8.234 8.234 8.537 -0.303 17569 4140 1 7 . 1 1 62 62 MET N N 216 120.002 120.002 117.521 2.481 17569 4141 1 7 . 1 1 62 62 MET HA H 216 4.972 4.972 4.753 0.219 17569 4142 1 7 . 1 1 62 62 MET CA C 216 53.151 53.151 54.087 -0.936 17569 4143 1 7 . 1 1 62 62 MET CB C 216 32.311 32.311 35.835 -3.524 17569 4144 1 7 . 1 1 62 62 MET H H 216 8.376 8.376 7.450 0.926 17569 4145 1 7 . 1 1 63 63 ASP N N 217 127.300 127.300 122.917 4.383 17569 4146 1 7 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.867 0.099 17569 4147 1 7 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.645 -0.076 17569 4148 1 7 . 1 1 63 63 ASP H H 217 9.368 9.368 8.669 0.699 17569 4149 1 7 . 1 1 64 64 GLU N N 218 114.400 114.400 123.263 -8.863 17569 4150 1 7 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.552 -0.396 17569 4151 1 7 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.528 0.322 17569 4152 1 7 . 1 1 64 64 GLU H H 218 8.583 8.583 8.341 0.242 17569 4153 1 7 . 1 1 65 65 GLN N N 219 115.500 115.500 117.264 -1.764 17569 4154 1 7 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.574 -0.263 17569 4155 1 7 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.031 0.316 17569 4156 1 7 . 1 1 65 65 GLN H H 219 7.158 7.158 7.865 -0.707 17569 4157 1 7 . 1 1 66 66 CYS N N 220 122.600 122.600 118.497 4.103 17569 4158 1 7 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.189 -1.112 17569 4159 1 7 . 1 1 66 66 CYS CA C 220 57.529 57.529 57.186 0.343 17569 4160 1 7 . 1 1 66 66 CYS CB C 220 31.972 31.972 29.331 2.642 17569 4161 1 7 . 1 1 66 66 CYS H H 220 8.248 8.248 8.713 -0.465 17569 4162 1 7 . 1 1 67 67 ARG N N 221 130.363 130.363 124.117 6.246 17569 4163 1 7 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.381 -0.314 17569 4164 1 7 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.118 -3.102 17569 4165 1 7 . 1 1 67 67 ARG H H 221 9.145 9.145 8.552 0.593 17569 4166 1 7 . 1 1 68 68 TRP N N 222 124.200 124.200 120.480 3.720 17569 4167 1 7 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.680 -0.244 17569 4168 1 7 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.286 0.794 17569 4169 1 7 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.551 0.643 17569 4170 1 7 . 1 1 68 68 TRP H H 222 9.689 9.689 8.192 1.497 17569 4171 1 7 . 1 1 69 69 CYS N N 223 116.297 116.297 110.623 5.674 17569 4172 1 7 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.043 0.048 17569 4173 1 7 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.907 3.195 17569 4174 1 7 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.522 4.816 17569 4175 1 7 . 1 1 69 69 CYS H H 223 8.822 8.822 7.691 1.131 17569 4176 1 7 . 1 1 70 70 ALA N N 224 123.112 123.112 124.428 -1.316 17569 4177 1 7 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.281 0.125 17569 4178 1 7 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.015 -0.164 17569 4179 1 7 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.882 -0.162 17569 4180 1 7 . 1 1 70 70 ALA H H 224 8.787 8.787 8.225 0.562 17569 4181 1 7 . 1 1 71 71 GLU N N 225 118.300 118.300 119.315 -1.015 17569 4182 1 7 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.450 0.858 17569 4183 1 7 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.638 -2.339 17569 4184 1 7 . 1 1 71 71 GLU H H 225 8.541 8.541 8.245 0.296 17569 4185 1 7 . 1 1 72 72 GLY N N 226 111.995 111.995 110.436 1.559 17569 4186 1 7 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.513 -1.110 17569 4187 1 7 . 1 1 72 72 GLY H H 226 9.837 9.837 8.489 1.348 17569 4188 1 7 . 1 1 73 73 GLY N N 227 106.600 106.600 106.346 0.254 17569 4189 1 7 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.962 1.009 17569 4190 1 7 . 1 1 73 73 GLY H H 227 7.772 7.772 8.411 -0.639 17569 4191 1 7 . 1 1 74 74 ASN N N 228 124.277 124.277 118.780 5.497 17569 4192 1 7 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.444 0.637 17569 4193 1 7 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.660 -0.560 17569 4194 1 7 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.523 -0.439 17569 4195 1 7 . 1 1 74 74 ASN H H 228 8.876 8.876 8.440 0.436 17569 4196 1 7 . 1 1 75 75 LEU N N 229 123.050 123.050 123.833 -0.783 17569 4197 1 7 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.899 -0.299 17569 4198 1 7 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.608 0.754 17569 4199 1 7 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.831 -0.331 17569 4200 1 7 . 1 1 75 75 LEU H H 229 8.901 8.901 8.145 0.756 17569 4201 1 7 . 1 1 76 76 ILE N N 230 123.552 123.552 123.138 0.414 17569 4202 1 7 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.036 0.449 17569 4203 1 7 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.472 -0.772 17569 4204 1 7 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.470 -1.071 17569 4205 1 7 . 1 1 76 76 ILE H H 230 9.406 9.406 9.063 0.343 17569 4206 1 7 . 1 1 77 77 CYS N N 231 124.637 124.637 126.832 -2.195 17569 4207 1 7 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.421 -0.546 17569 4208 1 7 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.356 0.003 17569 4209 1 7 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.145 0.288 17569 4210 1 7 . 1 1 77 77 CYS H H 231 8.809 8.809 8.441 0.368 17569 4211 1 7 . 1 1 78 78 CYS N N 232 125.697 125.697 125.613 0.084 17569 4212 1 7 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.892 -0.608 17569 4213 1 7 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.028 3.857 17569 4214 1 7 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.954 1.216 17569 4215 1 7 . 1 1 78 78 CYS H H 232 8.579 8.579 8.744 -0.165 17569 4216 1 7 . 1 1 79 79 ASP N N 233 123.600 123.600 124.880 -1.280 17569 4217 1 7 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.571 0.186 17569 4218 1 7 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.197 2.792 17569 4219 1 7 . 1 1 79 79 ASP CB C 233 41.629 41.629 39.804 1.825 17569 4220 1 7 . 1 1 79 79 ASP H H 233 8.577 8.577 8.541 0.036 17569 4221 1 7 . 1 1 80 80 PHE N N 234 122.100 122.100 117.702 4.398 17569 4222 1 7 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.632 -0.106 17569 4223 1 7 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.547 1.361 17569 4224 1 7 . 1 1 80 80 PHE CB C 234 41.849 41.849 39.635 2.214 17569 4225 1 7 . 1 1 80 80 PHE H H 234 10.432 10.432 7.517 2.915 17569 4226 1 7 . 1 1 81 81 CYS N N 235 124.300 124.300 117.836 6.464 17569 4227 1 7 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.833 0.323 17569 4228 1 7 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.267 -0.222 17569 4229 1 7 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.948 3.459 17569 4230 1 7 . 1 1 81 81 CYS H H 235 8.476 8.476 8.139 0.337 17569 4231 1 7 . 1 1 82 82 HIS N N 236 112.598 112.598 119.166 -6.568 17569 4232 1 7 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.178 0.805 17569 4233 1 7 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.032 -1.634 17569 4234 1 7 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.688 2.569 17569 4235 1 7 . 1 1 82 82 HIS H H 236 6.699 6.699 8.266 -1.567 17569 4236 1 7 . 1 1 83 83 ASN N N 237 123.600 123.600 119.265 4.335 17569 4237 1 7 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.834 -0.033 17569 4238 1 7 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.998 2.618 17569 4239 1 7 . 1 1 83 83 ASN H H 237 9.097 9.097 7.870 1.226 17569 4240 1 7 . 1 1 84 84 ALA N N 238 122.000 122.000 124.191 -2.191 17569 4241 1 7 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.285 0.124 17569 4242 1 7 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.290 0.074 17569 4243 1 7 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.066 3.004 17569 4244 1 7 . 1 1 84 84 ALA H H 238 9.885 9.885 8.615 1.270 17569 4245 1 7 . 1 1 85 85 PHE N N 239 116.707 116.707 121.896 -5.189 17569 4246 1 7 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.151 0.877 17569 4247 1 7 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.603 -0.386 17569 4248 1 7 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.835 1.829 17569 4249 1 7 . 1 1 85 85 PHE H H 239 9.450 9.450 9.307 0.143 17569 4250 1 7 . 1 1 86 86 CYS N N 240 126.682 126.682 124.659 2.023 17569 4251 1 7 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.717 0.905 17569 4252 1 7 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.762 -0.420 17569 4253 1 7 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.002 3.255 17569 4254 1 7 . 1 1 86 86 CYS H H 240 11.309 11.309 9.466 1.843 17569 4255 1 7 . 1 1 87 87 LYS N N 241 117.865 117.865 124.359 -6.494 17569 4256 1 7 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.913 -0.065 17569 4257 1 7 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.044 0.026 17569 4258 1 7 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.455 0.343 17569 4259 1 7 . 1 1 87 87 LYS H H 241 8.230 8.230 8.823 -0.593 17569 4260 1 7 . 1 1 88 88 LYS N N 242 117.949 117.949 118.551 -0.602 17569 4261 1 7 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.117 -0.139 17569 4262 1 7 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.013 1.357 17569 4263 1 7 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.093 0.223 17569 4264 1 7 . 1 1 88 88 LYS H H 242 7.945 7.945 8.470 -0.525 17569 4265 1 7 . 1 1 89 89 CYS N N 243 125.305 125.305 117.481 7.824 17569 4266 1 7 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.261 -0.519 17569 4267 1 7 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.650 2.177 17569 4268 1 7 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.366 0.875 17569 4269 1 7 . 1 1 89 89 CYS H H 243 9.297 9.297 7.702 1.595 17569 4270 1 7 . 1 1 90 90 ILE N N 244 119.687 119.687 121.430 -1.743 17569 4271 1 7 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.941 -0.334 17569 4272 1 7 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.833 0.117 17569 4273 1 7 . 1 1 90 90 ILE H H 244 7.997 7.997 7.646 0.351 17569 4274 1 7 . 1 1 91 91 LEU N N 245 120.280 120.280 121.358 -1.078 17569 4275 1 7 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.447 -0.762 17569 4276 1 7 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.608 0.627 17569 4277 1 7 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.885 0.073 17569 4278 1 7 . 1 1 91 91 LEU H H 245 8.810 8.810 8.796 0.014 17569 4279 1 7 . 1 1 92 92 ARG N N 246 116.901 116.901 117.463 -0.562 17569 4280 1 7 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.133 -0.316 17569 4281 1 7 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.849 1.131 17569 4282 1 7 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.022 0.578 17569 4283 1 7 . 1 1 92 92 ARG H H 246 8.086 8.086 7.642 0.444 17569 4284 1 7 . 1 1 93 93 ASN N N 247 111.200 111.200 116.006 -4.806 17569 4285 1 7 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.483 0.120 17569 4286 1 7 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.706 1.101 17569 4287 1 7 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.855 3.629 17569 4288 1 7 . 1 1 93 93 ASN H H 247 7.136 7.136 8.146 -1.010 17569 4289 1 7 . 1 1 94 94 LEU N N 248 118.807 118.807 117.606 1.201 17569 4290 1 7 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.574 0.240 17569 4291 1 7 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.225 -0.036 17569 4292 1 7 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.621 0.077 17569 4293 1 7 . 1 1 94 94 LEU H H 248 8.515 8.515 7.964 0.551 17569 4294 1 7 . 1 1 95 95 GLY N N 249 108.000 108.000 106.329 1.671 17569 4295 1 7 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.619 0.009 17569 4296 1 7 . 1 1 95 95 GLY H H 249 7.955 7.955 7.619 0.336 17569 4297 1 7 . 1 1 96 96 ARG N N 250 117.797 117.797 121.004 -3.207 17569 4298 1 7 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.349 -0.506 17569 4299 1 7 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.324 0.358 17569 4300 1 7 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.185 -0.325 17569 4301 1 7 . 1 1 96 96 ARG H H 250 8.559 8.559 8.729 -0.170 17569 4302 1 7 . 1 1 97 97 LYS N N 251 120.900 120.900 119.510 1.390 17569 4303 1 7 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.041 0.115 17569 4304 1 7 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.504 -0.348 17569 4305 1 7 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.485 -0.125 17569 4306 1 7 . 1 1 97 97 LYS H H 251 8.655 8.655 8.560 0.095 17569 4307 1 7 . 1 1 98 98 GLU N N 252 122.000 122.000 119.260 2.740 17569 4308 1 7 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.083 0.268 17569 4309 1 7 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.230 -0.648 17569 4310 1 7 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.608 -1.208 17569 4311 1 7 . 1 1 98 98 GLU H H 252 7.705 7.705 8.287 -0.582 17569 4312 1 7 . 1 1 99 99 LEU N N 253 117.400 117.400 120.827 -3.427 17569 4313 1 7 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.845 0.072 17569 4314 1 7 . 1 1 99 99 LEU CA C 253 57.998 57.998 57.958 0.040 17569 4315 1 7 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.867 -0.385 17569 4316 1 7 . 1 1 99 99 LEU H H 253 7.285 7.285 7.615 -0.330 17569 4317 1 7 . 1 1 100 100 SER N N 254 112.100 112.100 113.565 -1.465 17569 4318 1 7 . 1 1 100 100 SER HA H 254 4.107 4.107 4.146 -0.039 17569 4319 1 7 . 1 1 100 100 SER CA C 254 61.603 61.603 61.973 -0.370 17569 4320 1 7 . 1 1 100 100 SER CB C 254 62.622 62.622 63.088 -0.466 17569 4321 1 7 . 1 1 100 100 SER H H 254 8.326 8.326 8.251 0.075 17569 4322 1 7 . 1 1 101 101 THR N N 255 118.151 118.151 118.201 -0.050 17569 4323 1 7 . 1 1 101 101 THR HA H 255 4.026 4.026 4.042 -0.016 17569 4324 1 7 . 1 1 101 101 THR CA C 255 66.261 66.261 66.196 0.065 17569 4325 1 7 . 1 1 101 101 THR CB C 255 68.735 68.735 68.647 0.088 17569 4326 1 7 . 1 1 101 101 THR H H 255 7.972 7.972 7.721 0.251 17569 4327 1 7 . 1 1 102 102 ILE N N 256 120.100 120.100 121.978 -1.878 17569 4328 1 7 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.613 -0.150 17569 4329 1 7 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.384 0.390 17569 4330 1 7 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.325 0.416 17569 4331 1 7 . 1 1 102 102 ILE H H 256 7.868 7.868 8.551 -0.683 17569 4332 1 7 . 1 1 103 103 MET N N 257 114.876 114.876 117.260 -2.384 17569 4333 1 7 . 1 1 103 103 MET HA H 257 4.211 4.211 4.082 0.129 17569 4334 1 7 . 1 1 103 103 MET CA C 257 55.691 55.691 58.090 -2.400 17569 4335 1 7 . 1 1 103 103 MET CB C 257 32.000 32.000 32.845 -0.845 17569 4336 1 7 . 1 1 103 103 MET H H 257 7.606 7.606 7.319 0.287 17569 4337 1 7 . 1 1 104 104 ASP N N 258 119.976 119.976 119.166 0.810 17569 4338 1 7 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.777 -0.239 17569 4339 1 7 . 1 1 104 104 ASP CA C 258 54.912 54.912 54.110 0.802 17569 4340 1 7 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.270 1.230 17569 4341 1 7 . 1 1 104 104 ASP H H 258 7.444 7.444 7.671 -0.227 17569 4342 1 7 . 1 1 105 105 GLU N N 259 124.388 124.388 120.659 3.729 17569 4343 1 7 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.558 -0.271 17569 4344 1 7 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.320 2.251 17569 4345 1 7 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.282 -0.740 17569 4346 1 7 . 1 1 105 105 GLU H H 259 8.559 8.559 8.116 0.443 17569 4347 1 7 . 1 1 106 106 ASN N N 260 117.201 117.201 117.872 -0.671 17569 4348 1 7 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.416 0.326 17569 4349 1 7 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.939 -0.196 17569 4350 1 7 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.920 0.998 17569 4351 1 7 . 1 1 106 106 ASN H H 260 8.673 8.673 8.507 0.166 17569 4352 1 7 . 1 1 107 107 ASN N N 261 117.900 117.900 113.700 4.200 17569 4353 1 7 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.315 0.670 17569 4354 1 7 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.809 -2.507 17569 4355 1 7 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.618 2.996 17569 4356 1 7 . 1 1 107 107 ASN H H 261 7.956 7.956 8.738 -0.782 17569 4357 1 7 . 1 1 108 108 GLN N N 262 121.500 121.500 115.404 6.096 17569 4358 1 7 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.040 0.568 17569 4359 1 7 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.788 0.988 17569 4360 1 7 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.812 0.746 17569 4361 1 7 . 1 1 108 108 GLN H H 262 8.493 8.493 7.527 0.966 17569 4362 1 7 . 1 1 109 109 TRP N N 263 128.056 128.056 123.277 4.779 17569 4363 1 7 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.867 0.104 17569 4364 1 7 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.338 0.759 17569 4365 1 7 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.614 0.879 17569 4366 1 7 . 1 1 109 109 TRP H H 263 10.497 10.497 8.035 2.462 17569 4367 1 7 . 1 1 110 110 TYR N N 264 126.600 126.600 125.484 1.116 17569 4368 1 7 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.281 0.121 17569 4369 1 7 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.471 -2.800 17569 4370 1 7 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.821 -0.813 17569 4371 1 7 . 1 1 110 110 TYR H H 264 7.545 7.545 8.055 -0.510 17569 4372 1 7 . 1 1 111 111 CYS N N 265 124.622 124.622 114.195 10.427 17569 4373 1 7 . 1 1 111 111 CYS H H 265 8.586 8.586 8.078 0.508 17569 4374 1 7 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.791 -0.599 17569 4375 1 7 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.785 0.930 17569 4376 1 7 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.628 1.292 17569 4377 1 7 . 1 1 113 113 ILE N N 267 119.504 119.504 119.684 -0.180 17569 4378 1 7 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.537 -0.587 17569 4379 1 7 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.986 0.263 17569 4380 1 7 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.597 -3.064 17569 4381 1 7 . 1 1 113 113 ILE H H 267 9.160 9.160 7.498 1.662 17569 4382 1 7 . 1 1 114 114 CYS N N 268 124.100 124.100 118.354 5.746 17569 4383 1 7 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.182 -0.368 17569 4384 1 7 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.689 3.611 17569 4385 1 7 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.105 2.616 17569 4386 1 7 . 1 1 114 114 CYS H H 268 7.818 7.818 8.263 -0.445 17569 4387 1 7 . 1 1 115 115 HIS N N 269 117.127 117.127 111.180 5.947 17569 4388 1 7 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.659 0.470 17569 4389 1 7 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.040 -0.879 17569 4390 1 7 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.795 2.397 17569 4391 1 7 . 1 1 115 115 HIS H H 269 8.953 8.953 7.802 1.151 17569 4392 1 7 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.430 0.512 17569 4393 1 7 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.483 -0.175 17569 4394 1 7 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.544 1.099 17569 4395 1 7 . 1 1 117 117 GLU N N 271 123.504 123.504 122.818 0.686 17569 4396 1 7 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.380 -0.360 17569 4397 1 7 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.808 4.061 17569 4398 1 7 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.865 -1.814 17569 4399 1 7 . 1 1 117 117 GLU H H 271 8.402 8.402 8.147 0.255 17569 4400 1 7 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.536 0.006 17569 4401 1 7 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.504 1.855 17569 4402 1 7 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.326 0.816 17569 4403 1 7 . 1 1 119 119 LEU N N 273 112.296 112.296 114.348 -2.052 17569 4404 1 7 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.910 -0.436 17569 4405 1 7 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.490 0.052 17569 4406 1 7 . 1 1 119 119 LEU H H 273 8.090 8.090 7.438 0.652 17569 4407 1 7 . 1 1 120 120 LEU N N 274 121.388 121.388 123.848 -2.460 17569 4408 1 7 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.937 0.090 17569 4409 1 7 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.916 -0.615 17569 4410 1 7 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.436 0.664 17569 4411 1 7 . 1 1 120 120 LEU H H 274 7.823 7.823 8.297 -0.474 17569 4412 1 7 . 1 1 121 121 ASP N N 275 118.600 118.600 118.799 -0.199 17569 4413 1 7 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.352 0.189 17569 4414 1 7 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.381 0.322 17569 4415 1 7 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.493 -1.050 17569 4416 1 7 . 1 1 121 121 ASP H H 275 8.694 8.694 8.496 0.198 17569 4417 1 7 . 1 1 122 122 LEU N N 276 123.192 123.192 120.257 2.935 17569 4418 1 7 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.026 0.366 17569 4419 1 7 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.533 0.438 17569 4420 1 7 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.066 0.476 17569 4421 1 7 . 1 1 122 122 LEU H H 276 8.013 8.013 7.254 0.759 17569 4422 1 7 . 1 1 123 123 VAL N N 277 126.898 126.898 118.309 8.589 17569 4423 1 7 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.685 0.170 17569 4424 1 7 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.459 0.204 17569 4425 1 7 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.801 1.257 17569 4426 1 7 . 1 1 123 123 VAL H H 277 8.781 8.781 7.871 0.910 17569 4427 1 7 . 1 1 124 124 THR N N 278 117.500 117.500 116.094 1.406 17569 4428 1 7 . 1 1 124 124 THR HA H 278 4.030 4.030 3.936 0.094 17569 4429 1 7 . 1 1 124 124 THR CA C 278 66.589 66.589 66.542 0.047 17569 4430 1 7 . 1 1 124 124 THR CB C 278 68.410 68.410 67.912 0.498 17569 4431 1 7 . 1 1 124 124 THR H H 278 8.722 8.722 8.275 0.447 17569 4432 1 7 . 1 1 125 125 ALA N N 279 124.700 124.700 124.749 -0.049 17569 4433 1 7 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.089 0.172 17569 4434 1 7 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.841 0.455 17569 4435 1 7 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.888 0.061 17569 4436 1 7 . 1 1 125 125 ALA H H 279 8.239 8.239 7.705 0.534 17569 4437 1 7 . 1 1 126 126 CYS N N 280 119.276 119.276 117.944 1.332 17569 4438 1 7 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.944 0.170 17569 4439 1 7 . 1 1 126 126 CYS CA C 280 62.103 62.103 62.163 -0.060 17569 4440 1 7 . 1 1 126 126 CYS CB C 280 26.496 26.496 26.598 -0.102 17569 4441 1 7 . 1 1 126 126 CYS H H 280 8.128 8.128 7.756 0.372 17569 4442 1 7 . 1 1 127 127 ASN N N 281 118.000 118.000 118.518 -0.518 17569 4443 1 7 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.592 -0.032 17569 4444 1 7 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.363 -0.224 17569 4445 1 7 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.101 -1.136 17569 4446 1 7 . 1 1 127 127 ASN H H 281 8.725 8.725 7.952 0.773 17569 4447 1 7 . 1 1 128 128 SER N N 282 116.601 116.601 117.590 -0.989 17569 4448 1 7 . 1 1 128 128 SER HA H 282 4.363 4.363 4.130 0.233 17569 4449 1 7 . 1 1 128 128 SER CA C 282 61.899 61.899 61.836 0.063 17569 4450 1 7 . 1 1 128 128 SER CB C 282 62.630 62.630 63.052 -0.422 17569 4451 1 7 . 1 1 128 128 SER H H 282 8.542 8.542 7.720 0.822 17569 4452 1 7 . 1 1 129 129 VAL N N 283 123.272 123.272 122.285 0.987 17569 4453 1 7 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.472 0.205 17569 4454 1 7 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.505 0.003 17569 4455 1 7 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.396 -0.178 17569 4456 1 7 . 1 1 129 129 VAL H H 283 7.990 7.990 7.969 0.021 17569 4457 1 7 . 1 1 130 130 PHE N N 284 118.594 118.594 119.210 -0.616 17569 4458 1 7 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.265 -0.252 17569 4459 1 7 . 1 1 130 130 PHE CA C 284 63.500 63.500 60.896 2.604 17569 4460 1 7 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.152 0.844 17569 4461 1 7 . 1 1 130 130 PHE H H 284 8.190 8.190 8.000 0.190 17569 4462 1 7 . 1 1 131 131 GLU N N 285 120.905 120.905 120.455 0.450 17569 4463 1 7 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.003 0.202 17569 4464 1 7 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.584 -0.370 17569 4465 1 7 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.260 0.240 17569 4466 1 7 . 1 1 131 131 GLU H H 285 8.699 8.699 8.918 -0.219 17569 4467 1 7 . 1 1 132 132 ASN N N 286 117.997 117.997 117.861 0.136 17569 4468 1 7 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.654 -0.059 17569 4469 1 7 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.762 -0.147 17569 4470 1 7 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.885 -0.032 17569 4471 1 7 . 1 1 132 132 ASN H H 286 8.082 8.082 7.912 0.170 17569 4472 1 7 . 1 1 133 133 LEU N N 287 120.800 120.800 122.112 -1.312 17569 4473 1 7 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.363 -0.246 17569 4474 1 7 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.466 -0.668 17569 4475 1 7 . 1 1 133 133 LEU H H 287 7.904 7.904 8.557 -0.653 17569 4476 1 7 . 1 1 134 134 GLU N N 288 118.200 118.200 118.964 -0.764 17569 4477 1 7 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.915 0.164 17569 4478 1 7 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.960 -0.963 17569 4479 1 7 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.444 -0.202 17569 4480 1 7 . 1 1 134 134 GLU H H 288 8.157 8.157 8.833 -0.676 17569 4481 1 7 . 1 1 135 135 GLN N N 289 117.400 117.400 118.068 -0.668 17569 4482 1 7 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.079 0.095 17569 4483 1 7 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.555 -0.566 17569 4484 1 7 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.763 -0.683 17569 4485 1 7 . 1 1 135 135 GLN H H 289 7.869 7.869 7.634 0.235 17569 4486 1 7 . 1 1 136 136 LEU N N 290 121.000 121.000 121.980 -0.980 17569 4487 1 7 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.865 0.308 17569 4488 1 7 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.886 -0.748 17569 4489 1 7 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.792 0.208 17569 4490 1 7 . 1 1 136 136 LEU H H 290 7.968 7.968 7.765 0.203 17569 4491 1 7 . 1 1 137 137 LEU N N 291 118.900 118.900 119.945 -1.045 17569 4492 1 7 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.013 0.228 17569 4493 1 7 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.504 -1.143 17569 4494 1 7 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.307 -0.835 17569 4495 1 7 . 1 1 137 137 LEU H H 291 8.154 8.154 8.110 0.044 17569 4496 1 7 . 1 1 138 138 GLN N N 292 117.993 117.993 114.913 3.080 17569 4497 1 7 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.502 -0.230 17569 4498 1 7 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.793 1.839 17569 4499 1 7 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.124 -0.540 17569 4500 1 7 . 1 1 138 138 GLN H H 292 7.896 7.896 7.577 0.319 17569 4501 1 7 . 1 1 139 139 GLN N N 293 118.889 118.889 120.574 -1.685 17569 4502 1 7 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.456 -0.187 17569 4503 1 7 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.217 1.237 17569 4504 1 7 . 1 1 139 139 GLN CB C 293 29.069 29.069 28.204 0.865 17569 4505 1 7 . 1 1 139 139 GLN H H 293 8.091 8.091 7.481 0.610 17569 4506 1 7 . 1 1 140 140 ASN N N 294 118.604 118.604 121.643 -3.039 17569 4507 1 7 . 1 1 140 140 ASN HA H 294 4.759 4.759 5.060 -0.301 17569 4508 1 7 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.682 0.539 17569 4509 1 7 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.201 -1.468 17569 4510 1 7 . 1 1 140 140 ASN H H 294 8.273 8.273 8.411 -0.138 17569 4511 1 7 . 1 1 141 141 LYS N N 295 121.685 121.685 120.164 1.521 17569 4512 1 7 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.771 -0.411 17569 4513 1 7 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.562 0.611 17569 4514 1 7 . 1 1 141 141 LYS CB C 295 32.535 32.535 34.839 -2.304 17569 4515 1 7 . 1 1 141 141 LYS H H 295 8.089 8.089 8.336 -0.247 17569 4516 1 8 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.711 -0.324 17569 4517 1 8 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.055 0.390 17569 4518 1 8 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.220 0.036 17569 4519 1 8 . 1 1 3 3 MET HA H 157 4.476 4.476 4.514 -0.038 17569 4520 1 8 . 1 1 3 3 MET CA C 157 55.401 55.401 55.726 -0.325 17569 4521 1 8 . 1 1 4 4 ALA N N 158 124.828 124.828 122.151 2.677 17569 4522 1 8 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.528 -0.214 17569 4523 1 8 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.908 0.603 17569 4524 1 8 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.344 -1.343 17569 4525 1 8 . 1 1 4 4 ALA H H 158 8.382 8.382 8.049 0.333 17569 4526 1 8 . 1 1 5 5 ASP N N 159 119.418 119.418 121.076 -1.658 17569 4527 1 8 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.720 -0.130 17569 4528 1 8 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.761 -0.625 17569 4529 1 8 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.783 -0.768 17569 4530 1 8 . 1 1 5 5 ASP H H 159 8.312 8.312 8.581 -0.269 17569 4531 1 8 . 1 1 6 6 LYS N N 160 121.604 121.604 120.654 0.950 17569 4532 1 8 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.551 -0.208 17569 4533 1 8 . 1 1 6 6 LYS H H 160 8.274 8.274 7.827 0.447 17569 4534 1 8 . 1 1 7 7 ARG N N 161 121.611 121.611 120.710 0.901 17569 4535 1 8 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.495 -0.168 17569 4536 1 8 . 1 1 7 7 ARG H H 161 8.430 8.430 8.980 -0.550 17569 4537 1 8 . 1 1 8 8 GLY N N 162 109.606 109.606 109.068 0.538 17569 4538 1 8 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.493 0.554 17569 4539 1 8 . 1 1 8 8 GLY H H 162 8.473 8.473 8.055 0.418 17569 4540 1 8 . 1 1 9 9 ASP N N 163 120.187 120.187 120.036 0.151 17569 4541 1 8 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.767 -0.118 17569 4542 1 8 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.827 0.324 17569 4543 1 8 . 1 1 9 9 ASP H H 163 8.296 8.296 8.099 0.197 17569 4544 1 8 . 1 1 10 10 GLY N N 164 108.816 108.816 109.622 -0.806 17569 4545 1 8 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.015 0.352 17569 4546 1 8 . 1 1 10 10 GLY H H 164 8.458 8.458 8.386 0.072 17569 4547 1 8 . 1 1 11 11 LEU N N 165 121.195 121.195 124.513 -3.318 17569 4548 1 8 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.643 -0.327 17569 4549 1 8 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.650 0.350 17569 4550 1 8 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.194 -0.262 17569 4551 1 8 . 1 1 11 11 LEU H H 165 8.137 8.137 8.125 0.012 17569 4552 1 8 . 1 1 12 12 HIS N N 166 119.387 119.387 120.343 -0.956 17569 4553 1 8 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.759 -0.104 17569 4554 1 8 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.819 0.450 17569 4555 1 8 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.890 -1.193 17569 4556 1 8 . 1 1 12 12 HIS H H 166 8.270 8.270 8.000 0.270 17569 4557 1 8 . 1 1 13 13 GLY N N 167 109.899 109.899 112.473 -2.574 17569 4558 1 8 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.835 0.270 17569 4559 1 8 . 1 1 13 13 GLY H H 167 8.276 8.276 8.291 -0.015 17569 4560 1 8 . 1 1 14 14 ILE N N 168 119.597 119.597 120.664 -1.067 17569 4561 1 8 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.338 -0.015 17569 4562 1 8 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.550 1.050 17569 4563 1 8 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.691 -2.741 17569 4564 1 8 . 1 1 14 14 ILE H H 168 7.962 7.962 8.155 -0.193 17569 4565 1 8 . 1 1 15 15 VAL N N 169 127.578 127.578 126.160 1.418 17569 4566 1 8 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.105 0.175 17569 4567 1 8 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.297 -0.980 17569 4568 1 8 . 1 1 15 15 VAL CB C 169 33.402 33.402 29.869 3.533 17569 4569 1 8 . 1 1 15 15 VAL H H 169 9.011 9.011 8.493 0.518 17569 4570 1 8 . 1 1 16 16 SER N N 170 118.596 118.596 120.417 -1.821 17569 4571 1 8 . 1 1 16 16 SER HA H 170 5.140 5.140 4.748 0.392 17569 4572 1 8 . 1 1 16 16 SER CA C 170 55.985 55.985 56.375 -0.390 17569 4573 1 8 . 1 1 16 16 SER CB C 170 65.261 65.261 65.579 -0.318 17569 4574 1 8 . 1 1 16 16 SER H H 170 8.242 8.242 7.772 0.470 17569 4575 1 8 . 1 1 17 17 CYS N N 171 123.783 123.783 122.698 1.085 17569 4576 1 8 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.219 -0.038 17569 4577 1 8 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.541 -0.697 17569 4578 1 8 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.712 2.661 17569 4579 1 8 . 1 1 17 17 CYS H H 171 8.894 8.894 8.446 0.448 17569 4580 1 8 . 1 1 18 18 THR N N 172 121.703 121.703 118.132 3.571 17569 4581 1 8 . 1 1 18 18 THR HA H 172 4.386 4.386 4.119 0.267 17569 4582 1 8 . 1 1 18 18 THR CA C 172 64.667 64.667 64.182 0.485 17569 4583 1 8 . 1 1 18 18 THR CB C 172 69.498 69.498 68.566 0.932 17569 4584 1 8 . 1 1 18 18 THR H H 172 8.788 8.788 8.287 0.501 17569 4585 1 8 . 1 1 19 19 ALA N N 173 131.364 131.364 121.328 10.036 17569 4586 1 8 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.066 0.430 17569 4587 1 8 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.554 0.471 17569 4588 1 8 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.743 3.439 17569 4589 1 8 . 1 1 19 19 ALA H H 173 9.680 9.680 8.237 1.443 17569 4590 1 8 . 1 1 20 20 CYS N N 174 115.498 115.498 115.161 0.337 17569 4591 1 8 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.466 0.502 17569 4592 1 8 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.950 -1.856 17569 4593 1 8 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.952 4.292 17569 4594 1 8 . 1 1 20 20 CYS H H 174 8.470 8.470 7.847 0.623 17569 4595 1 8 . 1 1 21 21 GLY N N 175 112.464 112.464 109.512 2.952 17569 4596 1 8 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.035 0.671 17569 4597 1 8 . 1 1 21 21 GLY H H 175 7.884 7.884 7.920 -0.036 17569 4598 1 8 . 1 1 22 22 GLN N N 176 121.784 121.784 117.723 4.061 17569 4599 1 8 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.488 -0.112 17569 4600 1 8 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.231 2.060 17569 4601 1 8 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.157 -2.816 17569 4602 1 8 . 1 1 22 22 GLN H H 176 8.723 8.723 7.928 0.795 17569 4603 1 8 . 1 1 23 23 GLN N N 177 122.900 122.900 122.644 0.256 17569 4604 1 8 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.164 0.366 17569 4605 1 8 . 1 1 23 23 GLN CA C 177 56.550 56.550 57.011 -0.461 17569 4606 1 8 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.181 -0.722 17569 4607 1 8 . 1 1 23 23 GLN H H 177 8.721 8.721 8.547 0.174 17569 4608 1 8 . 1 1 24 24 VAL N N 178 121.000 121.000 123.107 -2.107 17569 4609 1 8 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.112 0.412 17569 4610 1 8 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.711 -1.834 17569 4611 1 8 . 1 1 24 24 VAL H H 178 8.689 8.689 7.767 0.922 17569 4612 1 8 . 1 1 25 25 ASN N N 179 121.392 121.392 123.864 -2.472 17569 4613 1 8 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.301 0.575 17569 4614 1 8 . 1 1 25 25 ASN CA C 179 52.149 52.149 53.747 -1.598 17569 4615 1 8 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.249 -0.272 17569 4616 1 8 . 1 1 25 25 ASN H H 179 8.635 8.635 8.521 0.114 17569 4617 1 8 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.704 -0.244 17569 4618 1 8 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.856 0.142 17569 4619 1 8 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.863 -1.470 17569 4620 1 8 . 1 1 28 28 GLN N N 182 119.300 119.300 121.745 -2.445 17569 4621 1 8 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.425 0.093 17569 4622 1 8 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.170 -1.828 17569 4623 1 8 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.273 0.077 17569 4624 1 8 . 1 1 28 28 GLN H H 182 7.494 7.494 7.625 -0.131 17569 4625 1 8 . 1 1 29 29 LYS N N 183 124.516 124.516 126.115 -1.599 17569 4626 1 8 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.488 -0.566 17569 4627 1 8 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.675 1.637 17569 4628 1 8 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.047 0.239 17569 4629 1 8 . 1 1 29 29 LYS H H 183 8.779 8.779 8.602 0.177 17569 4630 1 8 . 1 1 30 30 ASP N N 184 116.500 116.500 118.504 -2.004 17569 4631 1 8 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.769 -0.310 17569 4632 1 8 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.583 -0.047 17569 4633 1 8 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.489 -1.518 17569 4634 1 8 . 1 1 30 30 ASP H H 184 8.556 8.556 8.265 0.291 17569 4635 1 8 . 1 1 31 31 SER N N 185 111.505 111.505 114.019 -2.514 17569 4636 1 8 . 1 1 31 31 SER HA H 185 4.695 4.695 4.678 0.017 17569 4637 1 8 . 1 1 31 31 SER CA C 185 59.747 59.747 58.635 1.112 17569 4638 1 8 . 1 1 31 31 SER CB C 185 65.198 65.198 63.820 1.378 17569 4639 1 8 . 1 1 31 31 SER H H 185 7.933 7.933 8.232 -0.299 17569 4640 1 8 . 1 1 32 32 ILE N N 186 113.394 113.394 116.163 -2.769 17569 4641 1 8 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.870 0.016 17569 4642 1 8 . 1 1 32 32 ILE CA C 186 59.579 59.579 59.735 -0.156 17569 4643 1 8 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.909 0.903 17569 4644 1 8 . 1 1 32 32 ILE H H 186 7.105 7.105 7.305 -0.200 17569 4645 1 8 . 1 1 33 33 TYR N N 187 119.098 119.098 122.453 -3.355 17569 4646 1 8 . 1 1 33 33 TYR HA H 187 4.523 4.523 4.706 -0.183 17569 4647 1 8 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.847 0.413 17569 4648 1 8 . 1 1 33 33 TYR CB C 187 43.440 43.440 42.476 0.964 17569 4649 1 8 . 1 1 33 33 TYR H H 187 8.954 8.954 8.166 0.788 17569 4650 1 8 . 1 1 34 34 ARG N N 188 118.502 118.502 125.030 -6.528 17569 4651 1 8 . 1 1 34 34 ARG HA H 188 4.637 4.637 5.003 -0.366 17569 4652 1 8 . 1 1 34 34 ARG CA C 188 54.752 54.752 55.795 -1.043 17569 4653 1 8 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.488 0.763 17569 4654 1 8 . 1 1 34 34 ARG H H 188 8.412 8.412 8.723 -0.311 17569 4655 1 8 . 1 1 35 35 HIS N N 189 126.596 126.596 128.889 -2.293 17569 4656 1 8 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.873 -0.281 17569 4657 1 8 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.914 -0.193 17569 4658 1 8 . 1 1 35 35 HIS CB C 189 32.472 32.472 30.981 1.491 17569 4659 1 8 . 1 1 35 35 HIS H H 189 9.813 9.813 8.866 0.947 17569 4660 1 8 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.520 -0.222 17569 4661 1 8 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.718 0.558 17569 4662 1 8 . 1 1 36 36 PRO CB C 190 32.851 32.851 31.988 0.864 17569 4663 1 8 . 1 1 37 37 SER N N 191 110.003 110.003 113.192 -3.189 17569 4664 1 8 . 1 1 37 37 SER HA H 191 4.918 4.918 4.284 0.634 17569 4665 1 8 . 1 1 37 37 SER CA C 191 59.031 59.031 61.506 -2.475 17569 4666 1 8 . 1 1 37 37 SER CB C 191 65.104 65.104 63.259 1.845 17569 4667 1 8 . 1 1 37 37 SER H H 191 8.934 8.934 8.580 0.354 17569 4668 1 8 . 1 1 38 38 LEU N N 192 120.959 120.959 114.441 6.518 17569 4669 1 8 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.905 -0.776 17569 4670 1 8 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.322 1.824 17569 4671 1 8 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.358 1.638 17569 4672 1 8 . 1 1 38 38 LEU H H 192 8.649 8.649 6.937 1.712 17569 4673 1 8 . 1 1 39 39 GLN N N 193 108.600 108.600 119.300 -10.700 17569 4674 1 8 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.077 -0.172 17569 4675 1 8 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.561 0.253 17569 4676 1 8 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.062 -2.028 17569 4677 1 8 . 1 1 39 39 GLN H H 193 8.465 8.465 7.922 0.543 17569 4678 1 8 . 1 1 40 40 VAL N N 194 105.325 105.325 118.788 -13.463 17569 4679 1 8 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.472 0.078 17569 4680 1 8 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.550 -1.909 17569 4681 1 8 . 1 1 40 40 VAL H H 194 6.256 6.256 7.938 -1.682 17569 4682 1 8 . 1 1 41 41 LEU N N 195 123.100 123.100 121.934 1.166 17569 4683 1 8 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.912 -0.096 17569 4684 1 8 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.694 3.488 17569 4685 1 8 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.805 -0.235 17569 4686 1 8 . 1 1 41 41 LEU H H 195 9.154 9.154 8.537 0.617 17569 4687 1 8 . 1 1 42 42 ILE N N 196 124.396 124.396 117.024 7.372 17569 4688 1 8 . 1 1 42 42 ILE HA H 196 6.352 6.352 5.030 1.321 17569 4689 1 8 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.638 0.592 17569 4690 1 8 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.896 1.374 17569 4691 1 8 . 1 1 42 42 ILE H H 196 9.766 9.766 8.529 1.237 17569 4692 1 8 . 1 1 43 43 CYS N N 197 121.500 121.500 115.566 5.934 17569 4693 1 8 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.371 -0.109 17569 4694 1 8 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.299 0.404 17569 4695 1 8 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.012 2.288 17569 4696 1 8 . 1 1 43 43 CYS H H 197 9.882 9.882 8.506 1.376 17569 4697 1 8 . 1 1 44 44 LYS N N 198 117.995 117.995 122.511 -4.516 17569 4698 1 8 . 1 1 44 44 LYS HA H 198 3.989 3.989 3.737 0.252 17569 4699 1 8 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.215 -0.555 17569 4700 1 8 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.524 0.176 17569 4701 1 8 . 1 1 44 44 LYS H H 198 8.089 8.089 8.279 -0.190 17569 4702 1 8 . 1 1 45 45 ASN N N 199 119.200 119.200 117.203 1.997 17569 4703 1 8 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.505 0.009 17569 4704 1 8 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.124 0.596 17569 4705 1 8 . 1 1 45 45 ASN CB C 199 38.167 38.167 37.999 0.168 17569 4706 1 8 . 1 1 45 45 ASN H H 199 8.356 8.356 8.569 -0.213 17569 4707 1 8 . 1 1 46 46 CYS N N 200 126.600 126.600 118.684 7.916 17569 4708 1 8 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.918 0.263 17569 4709 1 8 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.562 1.933 17569 4710 1 8 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.221 1.961 17569 4711 1 8 . 1 1 46 46 CYS H H 200 9.189 9.189 7.917 1.272 17569 4712 1 8 . 1 1 47 47 PHE N N 201 121.962 121.962 120.235 1.727 17569 4713 1 8 . 1 1 47 47 PHE HA H 201 3.870 3.870 3.967 -0.097 17569 4714 1 8 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.658 1.611 17569 4715 1 8 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.206 0.961 17569 4716 1 8 . 1 1 47 47 PHE H H 201 8.826 8.826 7.314 1.512 17569 4717 1 8 . 1 1 48 48 LYS N N 202 117.400 117.400 119.703 -2.303 17569 4718 1 8 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.885 -0.187 17569 4719 1 8 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.657 -0.705 17569 4720 1 8 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.340 -0.798 17569 4721 1 8 . 1 1 48 48 LYS H H 202 8.512 8.512 8.307 0.205 17569 4722 1 8 . 1 1 49 49 TYR N N 203 120.400 120.400 120.520 -0.120 17569 4723 1 8 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.127 0.287 17569 4724 1 8 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.872 -1.100 17569 4725 1 8 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.620 -0.174 17569 4726 1 8 . 1 1 49 49 TYR H H 203 8.133 8.133 7.803 0.330 17569 4727 1 8 . 1 1 50 50 TYR N N 204 121.783 121.783 117.373 4.410 17569 4728 1 8 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.643 -1.148 17569 4729 1 8 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.042 2.908 17569 4730 1 8 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.645 0.847 17569 4731 1 8 . 1 1 50 50 TYR H H 204 8.765 8.765 7.539 1.226 17569 4732 1 8 . 1 1 51 51 MET N N 205 110.800 110.800 115.794 -4.994 17569 4733 1 8 . 1 1 51 51 MET HA H 205 4.349 4.349 4.133 0.216 17569 4734 1 8 . 1 1 51 51 MET CA C 205 53.505 53.505 58.229 -4.724 17569 4735 1 8 . 1 1 51 51 MET CB C 205 30.384 30.384 32.986 -2.602 17569 4736 1 8 . 1 1 51 51 MET H H 205 7.771 7.771 7.983 -0.212 17569 4737 1 8 . 1 1 52 52 SER N N 206 116.800 116.800 112.626 4.174 17569 4738 1 8 . 1 1 52 52 SER HA H 206 3.919 3.919 4.325 -0.406 17569 4739 1 8 . 1 1 52 52 SER CA C 206 61.621 61.621 59.608 2.013 17569 4740 1 8 . 1 1 52 52 SER CB C 206 62.611 62.611 64.028 -1.417 17569 4741 1 8 . 1 1 52 52 SER H H 206 7.581 7.581 8.287 -0.706 17569 4742 1 8 . 1 1 53 53 ASP N N 207 117.400 117.400 120.806 -3.406 17569 4743 1 8 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.738 -0.166 17569 4744 1 8 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.435 -0.336 17569 4745 1 8 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.850 0.338 17569 4746 1 8 . 1 1 53 53 ASP H H 207 7.085 7.085 7.944 -0.859 17569 4747 1 8 . 1 1 54 54 ASP N N 208 119.405 119.405 123.118 -3.713 17569 4748 1 8 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.981 -0.592 17569 4749 1 8 . 1 1 54 54 ASP CA C 208 53.900 53.900 52.898 1.002 17569 4750 1 8 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.800 -2.451 17569 4751 1 8 . 1 1 54 54 ASP H H 208 8.439 8.439 8.485 -0.046 17569 4752 1 8 . 1 1 55 55 ILE N N 209 124.698 124.698 122.919 1.779 17569 4753 1 8 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.116 -0.116 17569 4754 1 8 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.017 2.261 17569 4755 1 8 . 1 1 55 55 ILE CB C 209 39.291 39.291 36.884 2.407 17569 4756 1 8 . 1 1 55 55 ILE H H 209 8.128 8.128 8.513 -0.385 17569 4757 1 8 . 1 1 56 56 SER N N 210 126.703 126.703 123.064 3.639 17569 4758 1 8 . 1 1 56 56 SER HA H 210 4.365 4.365 4.161 0.204 17569 4759 1 8 . 1 1 56 56 SER CA C 210 57.769 57.769 60.816 -3.047 17569 4760 1 8 . 1 1 56 56 SER CB C 210 64.991 64.991 63.396 1.595 17569 4761 1 8 . 1 1 56 56 SER H H 210 8.815 8.815 8.858 -0.043 17569 4762 1 8 . 1 1 57 57 ARG N N 211 116.885 116.885 118.334 -1.449 17569 4763 1 8 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.500 0.542 17569 4764 1 8 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.464 -1.064 17569 4765 1 8 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.214 3.070 17569 4766 1 8 . 1 1 57 57 ARG H H 211 8.365 8.365 7.851 0.513 17569 4767 1 8 . 1 1 58 58 ASP N N 212 121.982 121.982 117.244 4.738 17569 4768 1 8 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.338 0.277 17569 4769 1 8 . 1 1 58 58 ASP CA C 212 52.222 52.222 57.159 -4.937 17569 4770 1 8 . 1 1 58 58 ASP CB C 212 41.502 41.502 39.548 1.954 17569 4771 1 8 . 1 1 58 58 ASP H H 212 8.706 8.706 8.575 0.131 17569 4772 1 8 . 1 1 59 59 SER N N 213 114.164 114.164 116.490 -2.326 17569 4773 1 8 . 1 1 59 59 SER HA H 213 4.212 4.212 4.193 0.019 17569 4774 1 8 . 1 1 59 59 SER CA C 213 60.840 60.840 60.859 -0.019 17569 4775 1 8 . 1 1 59 59 SER CB C 213 62.714 62.714 63.039 -0.325 17569 4776 1 8 . 1 1 59 59 SER H H 213 8.687 8.687 8.126 0.561 17569 4777 1 8 . 1 1 60 60 ASP N N 214 120.899 120.899 119.620 1.279 17569 4778 1 8 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.728 0.097 17569 4779 1 8 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.251 0.960 17569 4780 1 8 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.084 1.474 17569 4781 1 8 . 1 1 60 60 ASP H H 214 8.193 8.193 7.563 0.630 17569 4782 1 8 . 1 1 61 61 GLY N N 215 108.300 108.300 108.790 -0.490 17569 4783 1 8 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.862 -0.465 17569 4784 1 8 . 1 1 61 61 GLY H H 215 8.234 8.234 8.183 0.051 17569 4785 1 8 . 1 1 62 62 MET N N 216 120.002 120.002 117.701 2.301 17569 4786 1 8 . 1 1 62 62 MET HA H 216 4.972 4.972 4.620 0.352 17569 4787 1 8 . 1 1 62 62 MET CA C 216 53.151 53.151 54.049 -0.898 17569 4788 1 8 . 1 1 62 62 MET CB C 216 32.311 32.311 32.984 -0.673 17569 4789 1 8 . 1 1 62 62 MET H H 216 8.376 8.376 7.436 0.940 17569 4790 1 8 . 1 1 63 63 ASP N N 217 127.300 127.300 122.940 4.360 17569 4791 1 8 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.511 0.455 17569 4792 1 8 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.823 -0.254 17569 4793 1 8 . 1 1 63 63 ASP H H 217 9.368 9.368 8.327 1.041 17569 4794 1 8 . 1 1 64 64 GLU N N 218 114.400 114.400 124.612 -10.212 17569 4795 1 8 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.515 -0.359 17569 4796 1 8 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.625 0.225 17569 4797 1 8 . 1 1 64 64 GLU H H 218 8.583 8.583 8.492 0.091 17569 4798 1 8 . 1 1 65 65 GLN N N 219 115.500 115.500 117.076 -1.576 17569 4799 1 8 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.523 -0.212 17569 4800 1 8 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.103 0.242 17569 4801 1 8 . 1 1 65 65 GLN H H 219 7.158 7.158 7.646 -0.488 17569 4802 1 8 . 1 1 66 66 CYS N N 220 122.600 122.600 117.984 4.616 17569 4803 1 8 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.157 -1.080 17569 4804 1 8 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.844 0.684 17569 4805 1 8 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.162 1.810 17569 4806 1 8 . 1 1 66 66 CYS H H 220 8.248 8.248 8.360 -0.112 17569 4807 1 8 . 1 1 67 67 ARG N N 221 130.363 130.363 125.159 5.204 17569 4808 1 8 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.350 -0.283 17569 4809 1 8 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.317 -2.301 17569 4810 1 8 . 1 1 67 67 ARG H H 221 9.145 9.145 8.551 0.594 17569 4811 1 8 . 1 1 68 68 TRP N N 222 124.200 124.200 120.409 3.791 17569 4812 1 8 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.760 -0.324 17569 4813 1 8 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.311 0.769 17569 4814 1 8 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.639 0.555 17569 4815 1 8 . 1 1 68 68 TRP H H 222 9.689 9.689 8.129 1.560 17569 4816 1 8 . 1 1 69 69 CYS N N 223 116.297 116.297 111.317 4.980 17569 4817 1 8 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.076 0.015 17569 4818 1 8 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.639 2.463 17569 4819 1 8 . 1 1 69 69 CYS CB C 223 32.338 32.338 26.807 5.531 17569 4820 1 8 . 1 1 69 69 CYS H H 223 8.822 8.822 7.830 0.992 17569 4821 1 8 . 1 1 70 70 ALA N N 224 123.112 123.112 123.396 -0.284 17569 4822 1 8 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.290 0.116 17569 4823 1 8 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.483 -0.632 17569 4824 1 8 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.753 -0.034 17569 4825 1 8 . 1 1 70 70 ALA H H 224 8.787 8.787 8.077 0.710 17569 4826 1 8 . 1 1 71 71 GLU N N 225 118.300 118.300 120.618 -2.318 17569 4827 1 8 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.472 0.836 17569 4828 1 8 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.766 -2.467 17569 4829 1 8 . 1 1 71 71 GLU H H 225 8.541 8.541 8.204 0.337 17569 4830 1 8 . 1 1 72 72 GLY N N 226 111.995 111.995 109.691 2.304 17569 4831 1 8 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.397 0.006 17569 4832 1 8 . 1 1 72 72 GLY H H 226 9.837 9.837 8.454 1.383 17569 4833 1 8 . 1 1 73 73 GLY N N 227 106.600 106.600 107.592 -0.992 17569 4834 1 8 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.032 0.939 17569 4835 1 8 . 1 1 73 73 GLY H H 227 7.772 7.772 8.361 -0.589 17569 4836 1 8 . 1 1 74 74 ASN N N 228 124.277 124.277 119.208 5.069 17569 4837 1 8 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.465 0.616 17569 4838 1 8 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.861 -0.761 17569 4839 1 8 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.428 -0.344 17569 4840 1 8 . 1 1 74 74 ASN H H 228 8.876 8.876 8.502 0.374 17569 4841 1 8 . 1 1 75 75 LEU N N 229 123.050 123.050 122.243 0.807 17569 4842 1 8 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.886 -0.286 17569 4843 1 8 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.403 0.959 17569 4844 1 8 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.344 -0.844 17569 4845 1 8 . 1 1 75 75 LEU H H 229 8.901 8.901 7.995 0.906 17569 4846 1 8 . 1 1 76 76 ILE N N 230 123.552 123.552 123.618 -0.066 17569 4847 1 8 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.168 0.317 17569 4848 1 8 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.164 -0.464 17569 4849 1 8 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.380 -0.981 17569 4850 1 8 . 1 1 76 76 ILE H H 230 9.406 9.406 9.304 0.102 17569 4851 1 8 . 1 1 77 77 CYS N N 231 124.637 124.637 125.134 -0.497 17569 4852 1 8 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.647 -0.772 17569 4853 1 8 . 1 1 77 77 CYS CA C 231 58.359 58.359 56.178 2.181 17569 4854 1 8 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.581 0.853 17569 4855 1 8 . 1 1 77 77 CYS H H 231 8.809 8.809 8.396 0.413 17569 4856 1 8 . 1 1 78 78 CYS N N 232 125.697 125.697 122.411 3.286 17569 4857 1 8 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.818 -0.534 17569 4858 1 8 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.929 3.955 17569 4859 1 8 . 1 1 78 78 CYS CB C 232 31.170 31.170 30.014 1.156 17569 4860 1 8 . 1 1 78 78 CYS H H 232 8.579 8.579 8.826 -0.247 17569 4861 1 8 . 1 1 79 79 ASP N N 233 123.600 123.600 126.480 -2.880 17569 4862 1 8 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.708 0.049 17569 4863 1 8 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.328 2.661 17569 4864 1 8 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.195 1.434 17569 4865 1 8 . 1 1 79 79 ASP H H 233 8.577 8.577 8.078 0.499 17569 4866 1 8 . 1 1 80 80 PHE N N 234 122.100 122.100 117.197 4.903 17569 4867 1 8 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.575 -0.049 17569 4868 1 8 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.274 1.635 17569 4869 1 8 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.107 1.742 17569 4870 1 8 . 1 1 80 80 PHE H H 234 10.432 10.432 7.380 3.052 17569 4871 1 8 . 1 1 81 81 CYS N N 235 124.300 124.300 117.686 6.614 17569 4872 1 8 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.653 0.503 17569 4873 1 8 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.994 0.051 17569 4874 1 8 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.703 3.704 17569 4875 1 8 . 1 1 81 81 CYS H H 235 8.476 8.476 8.022 0.454 17569 4876 1 8 . 1 1 82 82 HIS N N 236 112.598 112.598 118.906 -6.308 17569 4877 1 8 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.160 0.823 17569 4878 1 8 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.777 -1.379 17569 4879 1 8 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.720 2.537 17569 4880 1 8 . 1 1 82 82 HIS H H 236 6.699 6.699 8.069 -1.370 17569 4881 1 8 . 1 1 83 83 ASN N N 237 123.600 123.600 118.209 5.391 17569 4882 1 8 . 1 1 83 83 ASN HA H 237 4.801 4.801 5.257 -0.456 17569 4883 1 8 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.963 2.653 17569 4884 1 8 . 1 1 83 83 ASN H H 237 9.097 9.097 7.955 1.142 17569 4885 1 8 . 1 1 84 84 ALA N N 238 122.000 122.000 123.789 -1.789 17569 4886 1 8 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.417 -0.008 17569 4887 1 8 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.029 0.335 17569 4888 1 8 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.555 2.515 17569 4889 1 8 . 1 1 84 84 ALA H H 238 9.885 9.885 9.481 0.404 17569 4890 1 8 . 1 1 85 85 PHE N N 239 116.707 116.707 120.502 -3.795 17569 4891 1 8 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.126 0.902 17569 4892 1 8 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.815 -0.598 17569 4893 1 8 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.226 1.438 17569 4894 1 8 . 1 1 85 85 PHE H H 239 9.450 9.450 9.143 0.307 17569 4895 1 8 . 1 1 86 86 CYS N N 240 126.682 126.682 124.819 1.863 17569 4896 1 8 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.792 0.830 17569 4897 1 8 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.885 -0.543 17569 4898 1 8 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.160 3.097 17569 4899 1 8 . 1 1 86 86 CYS H H 240 11.309 11.309 9.414 1.895 17569 4900 1 8 . 1 1 87 87 LYS N N 241 117.865 117.865 123.824 -5.959 17569 4901 1 8 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.930 -0.081 17569 4902 1 8 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.175 -0.105 17569 4903 1 8 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.487 0.311 17569 4904 1 8 . 1 1 87 87 LYS H H 241 8.230 8.230 8.826 -0.596 17569 4905 1 8 . 1 1 88 88 LYS N N 242 117.949 117.949 118.502 -0.553 17569 4906 1 8 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.121 -0.143 17569 4907 1 8 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.937 1.433 17569 4908 1 8 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.999 0.317 17569 4909 1 8 . 1 1 88 88 LYS H H 242 7.945 7.945 8.540 -0.595 17569 4910 1 8 . 1 1 89 89 CYS N N 243 125.305 125.305 117.551 7.754 17569 4911 1 8 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.272 -0.530 17569 4912 1 8 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.899 1.928 17569 4913 1 8 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.068 1.173 17569 4914 1 8 . 1 1 89 89 CYS H H 243 9.297 9.297 7.669 1.628 17569 4915 1 8 . 1 1 90 90 ILE N N 244 119.687 119.687 121.503 -1.816 17569 4916 1 8 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.909 -0.302 17569 4917 1 8 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.672 0.278 17569 4918 1 8 . 1 1 90 90 ILE H H 244 7.997 7.997 7.634 0.363 17569 4919 1 8 . 1 1 91 91 LEU N N 245 120.280 120.280 120.635 -0.355 17569 4920 1 8 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.274 -0.589 17569 4921 1 8 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.590 0.645 17569 4922 1 8 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.056 -0.098 17569 4923 1 8 . 1 1 91 91 LEU H H 245 8.810 8.810 8.772 0.038 17569 4924 1 8 . 1 1 92 92 ARG N N 246 116.901 116.901 117.488 -0.587 17569 4925 1 8 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.093 -0.276 17569 4926 1 8 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.349 0.631 17569 4927 1 8 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.225 0.375 17569 4928 1 8 . 1 1 92 92 ARG H H 246 8.086 8.086 7.704 0.382 17569 4929 1 8 . 1 1 93 93 ASN N N 247 111.200 111.200 115.927 -4.727 17569 4930 1 8 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.531 0.072 17569 4931 1 8 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.842 0.966 17569 4932 1 8 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.070 3.414 17569 4933 1 8 . 1 1 93 93 ASN H H 247 7.136 7.136 8.177 -1.041 17569 4934 1 8 . 1 1 94 94 LEU N N 248 118.807 118.807 117.589 1.218 17569 4935 1 8 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.391 0.423 17569 4936 1 8 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.196 -0.007 17569 4937 1 8 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.623 0.075 17569 4938 1 8 . 1 1 94 94 LEU H H 248 8.515 8.515 7.924 0.591 17569 4939 1 8 . 1 1 95 95 GLY N N 249 108.000 108.000 106.094 1.906 17569 4940 1 8 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.606 0.022 17569 4941 1 8 . 1 1 95 95 GLY H H 249 7.955 7.955 7.778 0.177 17569 4942 1 8 . 1 1 96 96 ARG N N 250 117.797 117.797 121.645 -3.848 17569 4943 1 8 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.242 -0.399 17569 4944 1 8 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.183 0.499 17569 4945 1 8 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.319 -0.459 17569 4946 1 8 . 1 1 96 96 ARG H H 250 8.559 8.559 8.615 -0.056 17569 4947 1 8 . 1 1 97 97 LYS N N 251 120.900 120.900 118.876 2.024 17569 4948 1 8 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.028 0.128 17569 4949 1 8 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.730 -0.575 17569 4950 1 8 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.739 -0.379 17569 4951 1 8 . 1 1 97 97 LYS H H 251 8.655 8.655 8.436 0.219 17569 4952 1 8 . 1 1 98 98 GLU N N 252 122.000 122.000 118.939 3.061 17569 4953 1 8 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.109 0.242 17569 4954 1 8 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.300 -0.718 17569 4955 1 8 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.121 -0.721 17569 4956 1 8 . 1 1 98 98 GLU H H 252 7.705 7.705 8.373 -0.668 17569 4957 1 8 . 1 1 99 99 LEU N N 253 117.400 117.400 119.839 -2.439 17569 4958 1 8 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.836 0.081 17569 4959 1 8 . 1 1 99 99 LEU CA C 253 57.998 57.998 57.700 0.298 17569 4960 1 8 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.932 -0.450 17569 4961 1 8 . 1 1 99 99 LEU H H 253 7.285 7.285 7.556 -0.271 17569 4962 1 8 . 1 1 100 100 SER N N 254 112.100 112.100 114.779 -2.679 17569 4963 1 8 . 1 1 100 100 SER HA H 254 4.107 4.107 4.167 -0.060 17569 4964 1 8 . 1 1 100 100 SER CA C 254 61.603 61.603 61.590 0.013 17569 4965 1 8 . 1 1 100 100 SER CB C 254 62.622 62.622 62.937 -0.315 17569 4966 1 8 . 1 1 100 100 SER H H 254 8.326 8.326 7.925 0.401 17569 4967 1 8 . 1 1 101 101 THR N N 255 118.151 118.151 119.268 -1.117 17569 4968 1 8 . 1 1 101 101 THR HA H 255 4.026 4.026 4.066 -0.040 17569 4969 1 8 . 1 1 101 101 THR CA C 255 66.261 66.261 66.930 -0.669 17569 4970 1 8 . 1 1 101 101 THR CB C 255 68.735 68.735 68.723 0.012 17569 4971 1 8 . 1 1 101 101 THR H H 255 7.972 7.972 7.712 0.260 17569 4972 1 8 . 1 1 102 102 ILE N N 256 120.100 120.100 122.521 -2.421 17569 4973 1 8 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.570 -0.107 17569 4974 1 8 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.701 0.073 17569 4975 1 8 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.466 0.275 17569 4976 1 8 . 1 1 102 102 ILE H H 256 7.868 7.868 8.603 -0.735 17569 4977 1 8 . 1 1 103 103 MET N N 257 114.876 114.876 117.109 -2.233 17569 4978 1 8 . 1 1 103 103 MET HA H 257 4.211 4.211 4.065 0.146 17569 4979 1 8 . 1 1 103 103 MET CA C 257 55.691 55.691 58.217 -2.526 17569 4980 1 8 . 1 1 103 103 MET CB C 257 32.000 32.000 32.884 -0.884 17569 4981 1 8 . 1 1 103 103 MET H H 257 7.606 7.606 7.397 0.209 17569 4982 1 8 . 1 1 104 104 ASP N N 258 119.976 119.976 118.823 1.153 17569 4983 1 8 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.771 -0.233 17569 4984 1 8 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.702 1.210 17569 4985 1 8 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.760 0.740 17569 4986 1 8 . 1 1 104 104 ASP H H 258 7.444 7.444 7.596 -0.152 17569 4987 1 8 . 1 1 105 105 GLU N N 259 124.388 124.388 122.193 2.195 17569 4988 1 8 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.482 -0.195 17569 4989 1 8 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.897 2.674 17569 4990 1 8 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.631 -0.089 17569 4991 1 8 . 1 1 105 105 GLU H H 259 8.559 8.559 8.268 0.291 17569 4992 1 8 . 1 1 106 106 ASN N N 260 117.201 117.201 118.639 -1.438 17569 4993 1 8 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.403 0.339 17569 4994 1 8 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.810 -0.067 17569 4995 1 8 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.283 1.635 17569 4996 1 8 . 1 1 106 106 ASN H H 260 8.673 8.673 8.609 0.064 17569 4997 1 8 . 1 1 107 107 ASN N N 261 117.900 117.900 113.220 4.680 17569 4998 1 8 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.252 0.733 17569 4999 1 8 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.730 -2.428 17569 5000 1 8 . 1 1 107 107 ASN CB C 261 40.614 40.614 38.034 2.580 17569 5001 1 8 . 1 1 107 107 ASN H H 261 7.956 7.956 8.763 -0.807 17569 5002 1 8 . 1 1 108 108 GLN N N 262 121.500 121.500 115.414 6.086 17569 5003 1 8 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.050 0.558 17569 5004 1 8 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.449 1.327 17569 5005 1 8 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.847 0.711 17569 5006 1 8 . 1 1 108 108 GLN H H 262 8.493 8.493 7.745 0.748 17569 5007 1 8 . 1 1 109 109 TRP N N 263 128.056 128.056 123.001 5.055 17569 5008 1 8 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.711 0.260 17569 5009 1 8 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.961 0.136 17569 5010 1 8 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.082 0.411 17569 5011 1 8 . 1 1 109 109 TRP H H 263 10.497 10.497 8.216 2.281 17569 5012 1 8 . 1 1 110 110 TYR N N 264 126.600 126.600 125.290 1.310 17569 5013 1 8 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.345 0.057 17569 5014 1 8 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.713 -2.042 17569 5015 1 8 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.376 -1.368 17569 5016 1 8 . 1 1 110 110 TYR H H 264 7.545 7.545 8.140 -0.595 17569 5017 1 8 . 1 1 111 111 CYS N N 265 124.622 124.622 114.493 10.129 17569 5018 1 8 . 1 1 111 111 CYS H H 265 8.586 8.586 8.406 0.180 17569 5019 1 8 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.805 -0.613 17569 5020 1 8 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.472 1.243 17569 5021 1 8 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.587 1.333 17569 5022 1 8 . 1 1 113 113 ILE N N 267 119.504 119.504 119.732 -0.228 17569 5023 1 8 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.704 -0.754 17569 5024 1 8 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.962 0.286 17569 5025 1 8 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.555 -3.022 17569 5026 1 8 . 1 1 113 113 ILE H H 267 9.160 9.160 7.484 1.676 17569 5027 1 8 . 1 1 114 114 CYS N N 268 124.100 124.100 118.345 5.755 17569 5028 1 8 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.158 -0.344 17569 5029 1 8 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.635 3.665 17569 5030 1 8 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.071 2.650 17569 5031 1 8 . 1 1 114 114 CYS H H 268 7.818 7.818 8.236 -0.418 17569 5032 1 8 . 1 1 115 115 HIS N N 269 117.127 117.127 111.214 5.913 17569 5033 1 8 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.653 0.476 17569 5034 1 8 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.043 -0.882 17569 5035 1 8 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.771 2.421 17569 5036 1 8 . 1 1 115 115 HIS H H 269 8.953 8.953 7.794 1.159 17569 5037 1 8 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.447 0.495 17569 5038 1 8 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.479 -0.171 17569 5039 1 8 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.610 1.032 17569 5040 1 8 . 1 1 117 117 GLU N N 271 123.504 123.504 122.918 0.586 17569 5041 1 8 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.365 -0.345 17569 5042 1 8 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.193 3.676 17569 5043 1 8 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.808 -1.758 17569 5044 1 8 . 1 1 117 117 GLU H H 271 8.402 8.402 8.129 0.273 17569 5045 1 8 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.498 0.044 17569 5046 1 8 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.660 1.699 17569 5047 1 8 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.392 0.750 17569 5048 1 8 . 1 1 119 119 LEU N N 273 112.296 112.296 114.331 -2.035 17569 5049 1 8 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.894 -0.420 17569 5050 1 8 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.342 0.200 17569 5051 1 8 . 1 1 119 119 LEU H H 273 8.090 8.090 7.471 0.619 17569 5052 1 8 . 1 1 120 120 LEU N N 274 121.388 121.388 122.582 -1.194 17569 5053 1 8 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.915 0.112 17569 5054 1 8 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.003 0.298 17569 5055 1 8 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.767 0.333 17569 5056 1 8 . 1 1 120 120 LEU H H 274 7.823 7.823 7.884 -0.061 17569 5057 1 8 . 1 1 121 121 ASP N N 275 118.600 118.600 119.065 -0.465 17569 5058 1 8 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.329 0.212 17569 5059 1 8 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.221 0.481 17569 5060 1 8 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.538 -1.095 17569 5061 1 8 . 1 1 121 121 ASP H H 275 8.694 8.694 8.416 0.278 17569 5062 1 8 . 1 1 122 122 LEU N N 276 123.192 123.192 120.680 2.512 17569 5063 1 8 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.948 0.444 17569 5064 1 8 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.106 -0.135 17569 5065 1 8 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.191 0.351 17569 5066 1 8 . 1 1 122 122 LEU H H 276 8.013 8.013 7.384 0.629 17569 5067 1 8 . 1 1 123 123 VAL N N 277 126.898 126.898 118.853 8.045 17569 5068 1 8 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.580 0.275 17569 5069 1 8 . 1 1 123 123 VAL CA C 277 66.663 66.663 67.019 -0.356 17569 5070 1 8 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.452 0.606 17569 5071 1 8 . 1 1 123 123 VAL H H 277 8.781 8.781 7.795 0.986 17569 5072 1 8 . 1 1 124 124 THR N N 278 117.500 117.500 116.093 1.407 17569 5073 1 8 . 1 1 124 124 THR HA H 278 4.030 4.030 3.919 0.111 17569 5074 1 8 . 1 1 124 124 THR CA C 278 66.589 66.589 66.656 -0.068 17569 5075 1 8 . 1 1 124 124 THR CB C 278 68.410 68.410 68.135 0.275 17569 5076 1 8 . 1 1 124 124 THR H H 278 8.722 8.722 8.190 0.532 17569 5077 1 8 . 1 1 125 125 ALA N N 279 124.700 124.700 123.709 0.991 17569 5078 1 8 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.146 0.115 17569 5079 1 8 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.014 0.282 17569 5080 1 8 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.895 0.054 17569 5081 1 8 . 1 1 125 125 ALA H H 279 8.239 8.239 7.878 0.361 17569 5082 1 8 . 1 1 126 126 CYS N N 280 119.276 119.276 117.852 1.424 17569 5083 1 8 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.931 0.183 17569 5084 1 8 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.227 -1.124 17569 5085 1 8 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.488 -0.992 17569 5086 1 8 . 1 1 126 126 CYS H H 280 8.128 8.128 7.795 0.333 17569 5087 1 8 . 1 1 127 127 ASN N N 281 118.000 118.000 118.407 -0.407 17569 5088 1 8 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.561 -0.001 17569 5089 1 8 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.455 -0.316 17569 5090 1 8 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.774 -0.809 17569 5091 1 8 . 1 1 127 127 ASN H H 281 8.725 8.725 8.037 0.688 17569 5092 1 8 . 1 1 128 128 SER N N 282 116.601 116.601 116.957 -0.356 17569 5093 1 8 . 1 1 128 128 SER HA H 282 4.363 4.363 4.290 0.073 17569 5094 1 8 . 1 1 128 128 SER CA C 282 61.899 61.899 61.802 0.097 17569 5095 1 8 . 1 1 128 128 SER CB C 282 62.630 62.630 62.898 -0.268 17569 5096 1 8 . 1 1 128 128 SER H H 282 8.542 8.542 7.578 0.964 17569 5097 1 8 . 1 1 129 129 VAL N N 283 123.272 123.272 122.136 1.136 17569 5098 1 8 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.534 0.143 17569 5099 1 8 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.597 -0.089 17569 5100 1 8 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.579 -0.361 17569 5101 1 8 . 1 1 129 129 VAL H H 283 7.990 7.990 8.225 -0.235 17569 5102 1 8 . 1 1 130 130 PHE N N 284 118.594 118.594 119.270 -0.676 17569 5103 1 8 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.267 -0.254 17569 5104 1 8 . 1 1 130 130 PHE CA C 284 63.500 63.500 60.857 2.643 17569 5105 1 8 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.645 0.351 17569 5106 1 8 . 1 1 130 130 PHE H H 284 8.190 8.190 8.562 -0.372 17569 5107 1 8 . 1 1 131 131 GLU N N 285 120.905 120.905 120.145 0.760 17569 5108 1 8 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.003 0.202 17569 5109 1 8 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.981 -0.767 17569 5110 1 8 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.583 -0.083 17569 5111 1 8 . 1 1 131 131 GLU H H 285 8.699 8.699 8.903 -0.204 17569 5112 1 8 . 1 1 132 132 ASN N N 286 117.997 117.997 118.076 -0.079 17569 5113 1 8 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.648 -0.053 17569 5114 1 8 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.651 -0.036 17569 5115 1 8 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.545 0.307 17569 5116 1 8 . 1 1 132 132 ASN H H 286 8.082 8.082 8.286 -0.204 17569 5117 1 8 . 1 1 133 133 LEU N N 287 120.800 120.800 122.423 -1.623 17569 5118 1 8 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.311 -0.194 17569 5119 1 8 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.365 -0.567 17569 5120 1 8 . 1 1 133 133 LEU H H 287 7.904 7.904 8.344 -0.440 17569 5121 1 8 . 1 1 134 134 GLU N N 288 118.200 118.200 118.881 -0.681 17569 5122 1 8 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.910 0.169 17569 5123 1 8 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.131 -1.134 17569 5124 1 8 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.360 -0.118 17569 5125 1 8 . 1 1 134 134 GLU H H 288 8.157 8.157 8.012 0.145 17569 5126 1 8 . 1 1 135 135 GLN N N 289 117.400 117.400 118.352 -0.952 17569 5127 1 8 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.092 0.082 17569 5128 1 8 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.429 -0.440 17569 5129 1 8 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.387 -0.307 17569 5130 1 8 . 1 1 135 135 GLN H H 289 7.869 7.869 7.624 0.245 17569 5131 1 8 . 1 1 136 136 LEU N N 290 121.000 121.000 120.510 0.490 17569 5132 1 8 . 1 1 136 136 LEU HA H 290 4.173 4.173 4.013 0.160 17569 5133 1 8 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.641 -0.503 17569 5134 1 8 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.595 0.405 17569 5135 1 8 . 1 1 136 136 LEU H H 290 7.968 7.968 7.645 0.323 17569 5136 1 8 . 1 1 137 137 LEU N N 291 118.900 118.900 116.148 2.752 17569 5137 1 8 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.041 0.200 17569 5138 1 8 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.317 -0.957 17569 5139 1 8 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.069 -0.597 17569 5140 1 8 . 1 1 137 137 LEU H H 291 8.154 8.154 7.553 0.601 17569 5141 1 8 . 1 1 138 138 GLN N N 292 117.993 117.993 115.485 2.508 17569 5142 1 8 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.253 0.019 17569 5143 1 8 . 1 1 138 138 GLN CA C 292 56.632 56.632 57.060 -0.428 17569 5144 1 8 . 1 1 138 138 GLN CB C 292 28.584 28.584 30.044 -1.460 17569 5145 1 8 . 1 1 138 138 GLN H H 292 7.896 7.896 7.473 0.423 17569 5146 1 8 . 1 1 139 139 GLN N N 293 118.889 118.889 119.584 -0.695 17569 5147 1 8 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.448 -0.179 17569 5148 1 8 . 1 1 139 139 GLN CA C 293 56.454 56.454 54.902 1.552 17569 5149 1 8 . 1 1 139 139 GLN CB C 293 29.069 29.069 28.519 0.550 17569 5150 1 8 . 1 1 139 139 GLN H H 293 8.091 8.091 8.527 -0.436 17569 5151 1 8 . 1 1 140 140 ASN N N 294 118.604 118.604 123.375 -4.771 17569 5152 1 8 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.701 0.058 17569 5153 1 8 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.871 -0.650 17569 5154 1 8 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.687 -0.954 17569 5155 1 8 . 1 1 140 140 ASN H H 294 8.273 8.273 8.676 -0.403 17569 5156 1 8 . 1 1 141 141 LYS N N 295 121.685 121.685 120.611 1.074 17569 5157 1 8 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.609 -0.249 17569 5158 1 8 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.792 0.381 17569 5159 1 8 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.731 -1.196 17569 5160 1 8 . 1 1 141 141 LYS H H 295 8.089 8.089 8.306 -0.217 17569 5161 1 9 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.445 -0.058 17569 5162 1 9 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.170 0.275 17569 5163 1 9 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.291 -0.035 17569 5164 1 9 . 1 1 3 3 MET HA H 157 4.476 4.476 4.141 0.335 17569 5165 1 9 . 1 1 3 3 MET CA C 157 55.401 55.401 55.630 -0.229 17569 5166 1 9 . 1 1 4 4 ALA N N 158 124.828 124.828 123.644 1.184 17569 5167 1 9 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.538 -0.224 17569 5168 1 9 . 1 1 4 4 ALA CA C 158 52.511 52.511 52.399 0.112 17569 5169 1 9 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.163 -1.162 17569 5170 1 9 . 1 1 4 4 ALA H H 158 8.382 8.382 8.290 0.092 17569 5171 1 9 . 1 1 5 5 ASP N N 159 119.418 119.418 122.306 -2.888 17569 5172 1 9 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.665 -0.075 17569 5173 1 9 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.619 -0.483 17569 5174 1 9 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.130 -0.115 17569 5175 1 9 . 1 1 5 5 ASP H H 159 8.312 8.312 8.353 -0.041 17569 5176 1 9 . 1 1 6 6 LYS N N 160 121.604 121.604 119.699 1.905 17569 5177 1 9 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.593 -0.250 17569 5178 1 9 . 1 1 6 6 LYS H H 160 8.274 8.274 8.201 0.073 17569 5179 1 9 . 1 1 7 7 ARG N N 161 121.611 121.611 121.754 -0.143 17569 5180 1 9 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.413 -0.086 17569 5181 1 9 . 1 1 7 7 ARG H H 161 8.430 8.430 8.718 -0.288 17569 5182 1 9 . 1 1 8 8 GLY N N 162 109.606 109.606 113.547 -3.941 17569 5183 1 9 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.514 0.533 17569 5184 1 9 . 1 1 8 8 GLY H H 162 8.473 8.473 8.611 -0.138 17569 5185 1 9 . 1 1 9 9 ASP N N 163 120.187 120.187 119.229 0.958 17569 5186 1 9 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.410 0.239 17569 5187 1 9 . 1 1 9 9 ASP CA C 163 54.151 54.151 55.342 -1.191 17569 5188 1 9 . 1 1 9 9 ASP H H 163 8.296 8.296 8.115 0.181 17569 5189 1 9 . 1 1 10 10 GLY N N 164 108.816 108.816 106.912 1.904 17569 5190 1 9 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.952 0.415 17569 5191 1 9 . 1 1 10 10 GLY H H 164 8.458 8.458 8.423 0.035 17569 5192 1 9 . 1 1 11 11 LEU N N 165 121.195 121.195 120.734 0.461 17569 5193 1 9 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.658 -0.342 17569 5194 1 9 . 1 1 11 11 LEU CA C 165 55.000 55.000 55.068 -0.068 17569 5195 1 9 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.414 -0.482 17569 5196 1 9 . 1 1 11 11 LEU H H 165 8.137 8.137 8.050 0.087 17569 5197 1 9 . 1 1 12 12 HIS N N 166 119.387 119.387 121.964 -2.577 17569 5198 1 9 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.876 -0.221 17569 5199 1 9 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.407 0.862 17569 5200 1 9 . 1 1 12 12 HIS CB C 166 30.697 30.697 32.267 -1.570 17569 5201 1 9 . 1 1 12 12 HIS H H 166 8.270 8.270 8.251 0.019 17569 5202 1 9 . 1 1 13 13 GLY N N 167 109.899 109.899 112.216 -2.317 17569 5203 1 9 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.505 0.600 17569 5204 1 9 . 1 1 13 13 GLY H H 167 8.276 8.276 8.134 0.142 17569 5205 1 9 . 1 1 14 14 ILE N N 168 119.597 119.597 123.073 -3.476 17569 5206 1 9 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.235 0.088 17569 5207 1 9 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.640 0.960 17569 5208 1 9 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.569 -2.619 17569 5209 1 9 . 1 1 14 14 ILE H H 168 7.962 7.962 7.572 0.390 17569 5210 1 9 . 1 1 15 15 VAL N N 169 127.578 127.578 125.308 2.270 17569 5211 1 9 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.003 0.277 17569 5212 1 9 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.330 -1.013 17569 5213 1 9 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.844 2.558 17569 5214 1 9 . 1 1 15 15 VAL H H 169 9.011 9.011 8.378 0.633 17569 5215 1 9 . 1 1 16 16 SER N N 170 118.596 118.596 120.099 -1.503 17569 5216 1 9 . 1 1 16 16 SER HA H 170 5.140 5.140 4.634 0.506 17569 5217 1 9 . 1 1 16 16 SER CA C 170 55.985 55.985 56.442 -0.457 17569 5218 1 9 . 1 1 16 16 SER CB C 170 65.261 65.261 66.064 -0.803 17569 5219 1 9 . 1 1 16 16 SER H H 170 8.242 8.242 7.646 0.596 17569 5220 1 9 . 1 1 17 17 CYS N N 171 123.783 123.783 122.729 1.054 17569 5221 1 9 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.167 0.014 17569 5222 1 9 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.231 -0.387 17569 5223 1 9 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.851 2.522 17569 5224 1 9 . 1 1 17 17 CYS H H 171 8.894 8.894 8.562 0.332 17569 5225 1 9 . 1 1 18 18 THR N N 172 121.703 121.703 118.071 3.632 17569 5226 1 9 . 1 1 18 18 THR HA H 172 4.386 4.386 4.112 0.274 17569 5227 1 9 . 1 1 18 18 THR CA C 172 64.667 64.667 64.457 0.210 17569 5228 1 9 . 1 1 18 18 THR CB C 172 69.498 69.498 68.680 0.818 17569 5229 1 9 . 1 1 18 18 THR H H 172 8.788 8.788 8.254 0.534 17569 5230 1 9 . 1 1 19 19 ALA N N 173 131.364 131.364 122.074 9.290 17569 5231 1 9 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.073 0.423 17569 5232 1 9 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.456 0.569 17569 5233 1 9 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.696 3.486 17569 5234 1 9 . 1 1 19 19 ALA H H 173 9.680 9.680 8.148 1.532 17569 5235 1 9 . 1 1 20 20 CYS N N 174 115.498 115.498 114.894 0.604 17569 5236 1 9 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.654 0.314 17569 5237 1 9 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.612 -1.518 17569 5238 1 9 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.482 4.762 17569 5239 1 9 . 1 1 20 20 CYS H H 174 8.470 8.470 7.992 0.478 17569 5240 1 9 . 1 1 21 21 GLY N N 175 112.464 112.464 109.203 3.261 17569 5241 1 9 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.009 0.697 17569 5242 1 9 . 1 1 21 21 GLY H H 175 7.884 7.884 7.992 -0.108 17569 5243 1 9 . 1 1 22 22 GLN N N 176 121.784 121.784 118.458 3.326 17569 5244 1 9 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.435 -0.059 17569 5245 1 9 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.474 1.817 17569 5246 1 9 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.388 -2.047 17569 5247 1 9 . 1 1 22 22 GLN H H 176 8.723 8.723 7.927 0.796 17569 5248 1 9 . 1 1 23 23 GLN N N 177 122.900 122.900 124.034 -1.134 17569 5249 1 9 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.135 0.395 17569 5250 1 9 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.939 -0.389 17569 5251 1 9 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.279 -0.819 17569 5252 1 9 . 1 1 23 23 GLN H H 177 8.721 8.721 8.575 0.146 17569 5253 1 9 . 1 1 24 24 VAL N N 178 121.000 121.000 124.183 -3.183 17569 5254 1 9 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.063 0.461 17569 5255 1 9 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.876 -1.999 17569 5256 1 9 . 1 1 24 24 VAL H H 178 8.689 8.689 7.814 0.875 17569 5257 1 9 . 1 1 25 25 ASN N N 179 121.392 121.392 123.771 -2.379 17569 5258 1 9 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.390 0.486 17569 5259 1 9 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.338 -2.189 17569 5260 1 9 . 1 1 25 25 ASN CB C 179 37.977 37.977 39.157 -1.179 17569 5261 1 9 . 1 1 25 25 ASN H H 179 8.635 8.635 8.082 0.553 17569 5262 1 9 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.690 -0.230 17569 5263 1 9 . 1 1 27 27 PHE CA C 181 56.998 56.998 57.218 -0.220 17569 5264 1 9 . 1 1 27 27 PHE CB C 181 38.393 38.393 40.186 -1.793 17569 5265 1 9 . 1 1 28 28 GLN N N 182 119.300 119.300 121.819 -2.519 17569 5266 1 9 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.440 0.078 17569 5267 1 9 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.910 -2.568 17569 5268 1 9 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.028 0.322 17569 5269 1 9 . 1 1 28 28 GLN H H 182 7.494 7.494 8.310 -0.816 17569 5270 1 9 . 1 1 29 29 LYS N N 183 124.516 124.516 124.955 -0.439 17569 5271 1 9 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.572 -0.650 17569 5272 1 9 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.185 2.127 17569 5273 1 9 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.682 -0.396 17569 5274 1 9 . 1 1 29 29 LYS H H 183 8.779 8.779 8.512 0.267 17569 5275 1 9 . 1 1 30 30 ASP N N 184 116.500 116.500 119.166 -2.666 17569 5276 1 9 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.866 -0.407 17569 5277 1 9 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.694 -0.158 17569 5278 1 9 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.217 -1.246 17569 5279 1 9 . 1 1 30 30 ASP H H 184 8.556 8.556 8.173 0.383 17569 5280 1 9 . 1 1 31 31 SER N N 185 111.505 111.505 113.527 -2.022 17569 5281 1 9 . 1 1 31 31 SER HA H 185 4.695 4.695 4.711 -0.016 17569 5282 1 9 . 1 1 31 31 SER CA C 185 59.747 59.747 57.975 1.772 17569 5283 1 9 . 1 1 31 31 SER CB C 185 65.198 65.198 63.704 1.494 17569 5284 1 9 . 1 1 31 31 SER H H 185 7.933 7.933 8.346 -0.413 17569 5285 1 9 . 1 1 32 32 ILE N N 186 113.394 113.394 116.368 -2.974 17569 5286 1 9 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.045 -0.159 17569 5287 1 9 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.691 -1.111 17569 5288 1 9 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.699 1.113 17569 5289 1 9 . 1 1 32 32 ILE H H 186 7.105 7.105 7.517 -0.412 17569 5290 1 9 . 1 1 33 33 TYR N N 187 119.098 119.098 121.043 -1.945 17569 5291 1 9 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.091 -0.568 17569 5292 1 9 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.783 1.477 17569 5293 1 9 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.841 2.599 17569 5294 1 9 . 1 1 33 33 TYR H H 187 8.954 8.954 7.785 1.169 17569 5295 1 9 . 1 1 34 34 ARG N N 188 118.502 118.502 123.456 -4.954 17569 5296 1 9 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.762 -0.125 17569 5297 1 9 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.337 -1.585 17569 5298 1 9 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.003 1.248 17569 5299 1 9 . 1 1 34 34 ARG H H 188 8.412 8.412 8.511 -0.099 17569 5300 1 9 . 1 1 35 35 HIS N N 189 126.596 126.596 128.890 -2.294 17569 5301 1 9 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.897 -0.305 17569 5302 1 9 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.116 -0.395 17569 5303 1 9 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.150 1.322 17569 5304 1 9 . 1 1 35 35 HIS H H 189 9.813 9.813 9.108 0.705 17569 5305 1 9 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.517 -0.219 17569 5306 1 9 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.895 0.381 17569 5307 1 9 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.126 0.726 17569 5308 1 9 . 1 1 37 37 SER N N 191 110.003 110.003 113.527 -3.524 17569 5309 1 9 . 1 1 37 37 SER HA H 191 4.918 4.918 4.320 0.598 17569 5310 1 9 . 1 1 37 37 SER CA C 191 59.031 59.031 60.477 -1.446 17569 5311 1 9 . 1 1 37 37 SER CB C 191 65.104 65.104 63.330 1.774 17569 5312 1 9 . 1 1 37 37 SER H H 191 8.934 8.934 8.435 0.499 17569 5313 1 9 . 1 1 38 38 LEU N N 192 120.959 120.959 114.067 6.892 17569 5314 1 9 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.917 -0.788 17569 5315 1 9 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.242 1.904 17569 5316 1 9 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.480 1.516 17569 5317 1 9 . 1 1 38 38 LEU H H 192 8.649 8.649 7.003 1.646 17569 5318 1 9 . 1 1 39 39 GLN N N 193 108.600 108.600 119.644 -11.044 17569 5319 1 9 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.093 -0.188 17569 5320 1 9 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.605 0.209 17569 5321 1 9 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.263 -2.229 17569 5322 1 9 . 1 1 39 39 GLN H H 193 8.465 8.465 7.909 0.556 17569 5323 1 9 . 1 1 40 40 VAL N N 194 105.325 105.325 118.249 -12.924 17569 5324 1 9 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.496 0.054 17569 5325 1 9 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.760 -1.119 17569 5326 1 9 . 1 1 40 40 VAL H H 194 6.256 6.256 7.870 -1.614 17569 5327 1 9 . 1 1 41 41 LEU N N 195 123.100 123.100 122.648 0.452 17569 5328 1 9 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.741 0.075 17569 5329 1 9 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.580 3.602 17569 5330 1 9 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.977 0.593 17569 5331 1 9 . 1 1 41 41 LEU H H 195 9.154 9.154 8.552 0.602 17569 5332 1 9 . 1 1 42 42 ILE N N 196 124.396 124.396 117.476 6.920 17569 5333 1 9 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.839 1.513 17569 5334 1 9 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.142 1.088 17569 5335 1 9 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.914 1.356 17569 5336 1 9 . 1 1 42 42 ILE H H 196 9.766 9.766 7.846 1.920 17569 5337 1 9 . 1 1 43 43 CYS N N 197 121.500 121.500 114.898 6.602 17569 5338 1 9 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.245 0.017 17569 5339 1 9 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.212 0.492 17569 5340 1 9 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.168 2.132 17569 5341 1 9 . 1 1 43 43 CYS H H 197 9.882 9.882 8.301 1.581 17569 5342 1 9 . 1 1 44 44 LYS N N 198 117.995 117.995 122.842 -4.847 17569 5343 1 9 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.173 -0.184 17569 5344 1 9 . 1 1 44 44 LYS CA C 198 59.660 59.660 59.855 -0.195 17569 5345 1 9 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.235 0.465 17569 5346 1 9 . 1 1 44 44 LYS H H 198 8.089 8.089 8.632 -0.543 17569 5347 1 9 . 1 1 45 45 ASN N N 199 119.200 119.200 117.664 1.536 17569 5348 1 9 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.594 -0.080 17569 5349 1 9 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.983 0.737 17569 5350 1 9 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.159 0.008 17569 5351 1 9 . 1 1 45 45 ASN H H 199 8.356 8.356 8.534 -0.178 17569 5352 1 9 . 1 1 46 46 CYS N N 200 126.600 126.600 118.220 8.380 17569 5353 1 9 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.017 0.164 17569 5354 1 9 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.136 2.359 17569 5355 1 9 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.189 1.993 17569 5356 1 9 . 1 1 46 46 CYS H H 200 9.189 9.189 7.990 1.199 17569 5357 1 9 . 1 1 47 47 PHE N N 201 121.962 121.962 120.299 1.663 17569 5358 1 9 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.151 -0.281 17569 5359 1 9 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.575 1.694 17569 5360 1 9 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.558 0.609 17569 5361 1 9 . 1 1 47 47 PHE H H 201 8.826 8.826 7.956 0.870 17569 5362 1 9 . 1 1 48 48 LYS N N 202 117.400 117.400 120.650 -3.250 17569 5363 1 9 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.896 -0.198 17569 5364 1 9 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.113 -1.161 17569 5365 1 9 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.280 -0.738 17569 5366 1 9 . 1 1 48 48 LYS H H 202 8.512 8.512 8.074 0.438 17569 5367 1 9 . 1 1 49 49 TYR N N 203 120.400 120.400 120.520 -0.120 17569 5368 1 9 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.227 0.187 17569 5369 1 9 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.450 -0.678 17569 5370 1 9 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.744 -0.298 17569 5371 1 9 . 1 1 49 49 TYR H H 203 8.133 8.133 7.702 0.431 17569 5372 1 9 . 1 1 50 50 TYR N N 204 121.783 121.783 118.116 3.667 17569 5373 1 9 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.679 -1.184 17569 5374 1 9 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.957 2.993 17569 5375 1 9 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.579 0.913 17569 5376 1 9 . 1 1 50 50 TYR H H 204 8.765 8.765 7.506 1.259 17569 5377 1 9 . 1 1 51 51 MET N N 205 110.800 110.800 115.891 -5.091 17569 5378 1 9 . 1 1 51 51 MET HA H 205 4.349 4.349 4.111 0.238 17569 5379 1 9 . 1 1 51 51 MET CA C 205 53.505 53.505 58.117 -4.612 17569 5380 1 9 . 1 1 51 51 MET CB C 205 30.384 30.384 33.158 -2.774 17569 5381 1 9 . 1 1 51 51 MET H H 205 7.771 7.771 8.431 -0.660 17569 5382 1 9 . 1 1 52 52 SER N N 206 116.800 116.800 113.377 3.423 17569 5383 1 9 . 1 1 52 52 SER HA H 206 3.919 3.919 4.395 -0.476 17569 5384 1 9 . 1 1 52 52 SER CA C 206 61.621 61.621 60.329 1.292 17569 5385 1 9 . 1 1 52 52 SER CB C 206 62.611 62.611 64.334 -1.723 17569 5386 1 9 . 1 1 52 52 SER H H 206 7.581 7.581 8.246 -0.665 17569 5387 1 9 . 1 1 53 53 ASP N N 207 117.400 117.400 122.024 -4.624 17569 5388 1 9 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.766 -0.194 17569 5389 1 9 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.908 -0.809 17569 5390 1 9 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.365 -0.177 17569 5391 1 9 . 1 1 53 53 ASP H H 207 7.085 7.085 8.083 -0.998 17569 5392 1 9 . 1 1 54 54 ASP N N 208 119.405 119.405 122.332 -2.927 17569 5393 1 9 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.950 -0.561 17569 5394 1 9 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.548 0.352 17569 5395 1 9 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.790 -1.441 17569 5396 1 9 . 1 1 54 54 ASP H H 208 8.439 8.439 8.430 0.009 17569 5397 1 9 . 1 1 55 55 ILE N N 209 124.698 124.698 120.965 3.733 17569 5398 1 9 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.351 -0.351 17569 5399 1 9 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.127 2.151 17569 5400 1 9 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.720 1.571 17569 5401 1 9 . 1 1 55 55 ILE H H 209 8.128 8.128 8.416 -0.288 17569 5402 1 9 . 1 1 56 56 SER N N 210 126.703 126.703 120.638 6.065 17569 5403 1 9 . 1 1 56 56 SER HA H 210 4.365 4.365 4.810 -0.445 17569 5404 1 9 . 1 1 56 56 SER CA C 210 57.769 57.769 56.903 0.866 17569 5405 1 9 . 1 1 56 56 SER CB C 210 64.991 64.991 65.385 -0.394 17569 5406 1 9 . 1 1 56 56 SER H H 210 8.815 8.815 8.634 0.181 17569 5407 1 9 . 1 1 57 57 ARG N N 211 116.885 116.885 119.942 -3.057 17569 5408 1 9 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.723 0.319 17569 5409 1 9 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.973 -1.573 17569 5410 1 9 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.570 2.714 17569 5411 1 9 . 1 1 57 57 ARG H H 211 8.365 8.365 8.461 -0.096 17569 5412 1 9 . 1 1 58 58 ASP N N 212 121.982 121.982 122.873 -0.891 17569 5413 1 9 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.955 -0.340 17569 5414 1 9 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.497 -1.275 17569 5415 1 9 . 1 1 58 58 ASP CB C 212 41.502 41.502 45.297 -3.795 17569 5416 1 9 . 1 1 58 58 ASP H H 212 8.706 8.706 8.829 -0.123 17569 5417 1 9 . 1 1 59 59 SER N N 213 114.164 114.164 114.465 -0.301 17569 5418 1 9 . 1 1 59 59 SER HA H 213 4.212 4.212 4.019 0.193 17569 5419 1 9 . 1 1 59 59 SER CA C 213 60.840 60.840 60.950 -0.110 17569 5420 1 9 . 1 1 59 59 SER CB C 213 62.714 62.714 63.003 -0.289 17569 5421 1 9 . 1 1 59 59 SER H H 213 8.687 8.687 8.568 0.119 17569 5422 1 9 . 1 1 60 60 ASP N N 214 120.899 120.899 122.504 -1.605 17569 5423 1 9 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.862 -0.037 17569 5424 1 9 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.257 0.954 17569 5425 1 9 . 1 1 60 60 ASP CB C 214 41.558 41.558 41.032 0.525 17569 5426 1 9 . 1 1 60 60 ASP H H 214 8.193 8.193 8.194 -0.001 17569 5427 1 9 . 1 1 61 61 GLY N N 215 108.300 108.300 108.228 0.072 17569 5428 1 9 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.821 -0.424 17569 5429 1 9 . 1 1 61 61 GLY H H 215 8.234 8.234 8.197 0.037 17569 5430 1 9 . 1 1 62 62 MET N N 216 120.002 120.002 118.343 1.659 17569 5431 1 9 . 1 1 62 62 MET HA H 216 4.972 4.972 4.820 0.152 17569 5432 1 9 . 1 1 62 62 MET CA C 216 53.151 53.151 53.333 -0.182 17569 5433 1 9 . 1 1 62 62 MET CB C 216 32.311 32.311 36.491 -4.180 17569 5434 1 9 . 1 1 62 62 MET H H 216 8.376 8.376 7.358 1.018 17569 5435 1 9 . 1 1 63 63 ASP N N 217 127.300 127.300 121.430 5.870 17569 5436 1 9 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.799 0.167 17569 5437 1 9 . 1 1 63 63 ASP CA C 217 55.569 55.569 54.434 1.135 17569 5438 1 9 . 1 1 63 63 ASP H H 217 9.368 9.368 8.727 0.641 17569 5439 1 9 . 1 1 64 64 GLU N N 218 114.400 114.400 122.676 -8.276 17569 5440 1 9 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.546 -0.390 17569 5441 1 9 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.533 0.317 17569 5442 1 9 . 1 1 64 64 GLU H H 218 8.583 8.583 8.339 0.244 17569 5443 1 9 . 1 1 65 65 GLN N N 219 115.500 115.500 117.035 -1.535 17569 5444 1 9 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.529 -0.218 17569 5445 1 9 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.271 0.075 17569 5446 1 9 . 1 1 65 65 GLN H H 219 7.158 7.158 7.680 -0.522 17569 5447 1 9 . 1 1 66 66 CYS N N 220 122.600 122.600 117.344 5.256 17569 5448 1 9 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.211 -1.134 17569 5449 1 9 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.520 1.009 17569 5450 1 9 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.062 1.910 17569 5451 1 9 . 1 1 66 66 CYS H H 220 8.248 8.248 8.356 -0.108 17569 5452 1 9 . 1 1 67 67 ARG N N 221 130.363 130.363 123.802 6.561 17569 5453 1 9 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.434 -0.367 17569 5454 1 9 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.128 -3.112 17569 5455 1 9 . 1 1 67 67 ARG H H 221 9.145 9.145 8.566 0.579 17569 5456 1 9 . 1 1 68 68 TRP N N 222 124.200 124.200 120.622 3.578 17569 5457 1 9 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.786 -0.350 17569 5458 1 9 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.263 0.817 17569 5459 1 9 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.513 0.681 17569 5460 1 9 . 1 1 68 68 TRP H H 222 9.689 9.689 8.155 1.534 17569 5461 1 9 . 1 1 69 69 CYS N N 223 116.297 116.297 111.388 4.909 17569 5462 1 9 . 1 1 69 69 CYS HA H 223 5.091 5.091 4.932 0.159 17569 5463 1 9 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.206 2.896 17569 5464 1 9 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.076 5.263 17569 5465 1 9 . 1 1 69 69 CYS H H 223 8.822 8.822 7.831 0.991 17569 5466 1 9 . 1 1 70 70 ALA N N 224 123.112 123.112 123.635 -0.523 17569 5467 1 9 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.318 0.088 17569 5468 1 9 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.218 -0.367 17569 5469 1 9 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.698 0.022 17569 5470 1 9 . 1 1 70 70 ALA H H 224 8.787 8.787 8.145 0.642 17569 5471 1 9 . 1 1 71 71 GLU N N 225 118.300 118.300 120.930 -2.630 17569 5472 1 9 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.538 0.770 17569 5473 1 9 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.906 -2.607 17569 5474 1 9 . 1 1 71 71 GLU H H 225 8.541 8.541 7.896 0.645 17569 5475 1 9 . 1 1 72 72 GLY N N 226 111.995 111.995 109.962 2.033 17569 5476 1 9 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.096 -0.693 17569 5477 1 9 . 1 1 72 72 GLY H H 226 9.837 9.837 8.581 1.256 17569 5478 1 9 . 1 1 73 73 GLY N N 227 106.600 106.600 107.061 -0.461 17569 5479 1 9 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.996 0.975 17569 5480 1 9 . 1 1 73 73 GLY H H 227 7.772 7.772 8.402 -0.630 17569 5481 1 9 . 1 1 74 74 ASN N N 228 124.277 124.277 119.184 5.093 17569 5482 1 9 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.459 0.622 17569 5483 1 9 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.889 -0.789 17569 5484 1 9 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.377 -0.293 17569 5485 1 9 . 1 1 74 74 ASN H H 228 8.876 8.876 8.532 0.344 17569 5486 1 9 . 1 1 75 75 LEU N N 229 123.050 123.050 122.217 0.833 17569 5487 1 9 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.873 -0.273 17569 5488 1 9 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.370 0.992 17569 5489 1 9 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.431 0.070 17569 5490 1 9 . 1 1 75 75 LEU H H 229 8.901 8.901 8.050 0.851 17569 5491 1 9 . 1 1 76 76 ILE N N 230 123.552 123.552 123.713 -0.161 17569 5492 1 9 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.050 0.435 17569 5493 1 9 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.770 -1.070 17569 5494 1 9 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.015 -0.616 17569 5495 1 9 . 1 1 76 76 ILE H H 230 9.406 9.406 9.273 0.133 17569 5496 1 9 . 1 1 77 77 CYS N N 231 124.637 124.637 124.704 -0.067 17569 5497 1 9 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.552 -0.677 17569 5498 1 9 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.473 0.886 17569 5499 1 9 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.314 0.120 17569 5500 1 9 . 1 1 77 77 CYS H H 231 8.809 8.809 8.282 0.527 17569 5501 1 9 . 1 1 78 78 CYS N N 232 125.697 125.697 122.696 3.001 17569 5502 1 9 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.749 -0.465 17569 5503 1 9 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.105 3.779 17569 5504 1 9 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.524 1.646 17569 5505 1 9 . 1 1 78 78 CYS H H 232 8.579 8.579 8.753 -0.174 17569 5506 1 9 . 1 1 79 79 ASP N N 233 123.600 123.600 126.376 -2.776 17569 5507 1 9 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.566 0.191 17569 5508 1 9 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.235 2.754 17569 5509 1 9 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.019 1.611 17569 5510 1 9 . 1 1 79 79 ASP H H 233 8.577 8.577 8.062 0.515 17569 5511 1 9 . 1 1 80 80 PHE N N 234 122.100 122.100 117.033 5.067 17569 5512 1 9 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.668 -0.142 17569 5513 1 9 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.393 1.516 17569 5514 1 9 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.128 1.721 17569 5515 1 9 . 1 1 80 80 PHE H H 234 10.432 10.432 7.376 3.056 17569 5516 1 9 . 1 1 81 81 CYS N N 235 124.300 124.300 117.272 7.028 17569 5517 1 9 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.922 0.234 17569 5518 1 9 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.409 0.636 17569 5519 1 9 . 1 1 81 81 CYS CB C 235 31.407 31.407 28.084 3.323 17569 5520 1 9 . 1 1 81 81 CYS H H 235 8.476 8.476 8.131 0.345 17569 5521 1 9 . 1 1 82 82 HIS N N 236 112.598 112.598 117.986 -5.388 17569 5522 1 9 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.116 0.867 17569 5523 1 9 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.936 -1.538 17569 5524 1 9 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.524 2.733 17569 5525 1 9 . 1 1 82 82 HIS H H 236 6.699 6.699 8.274 -1.575 17569 5526 1 9 . 1 1 83 83 ASN N N 237 123.600 123.600 116.944 6.656 17569 5527 1 9 . 1 1 83 83 ASN HA H 237 4.801 4.801 5.338 -0.537 17569 5528 1 9 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.192 2.424 17569 5529 1 9 . 1 1 83 83 ASN H H 237 9.097 9.097 7.839 1.258 17569 5530 1 9 . 1 1 84 84 ALA N N 238 122.000 122.000 124.008 -2.008 17569 5531 1 9 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.338 0.071 17569 5532 1 9 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.026 0.338 17569 5533 1 9 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.994 3.076 17569 5534 1 9 . 1 1 84 84 ALA H H 238 9.885 9.885 8.672 1.213 17569 5535 1 9 . 1 1 85 85 PHE N N 239 116.707 116.707 121.925 -5.218 17569 5536 1 9 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.139 0.889 17569 5537 1 9 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.595 -0.378 17569 5538 1 9 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.870 1.794 17569 5539 1 9 . 1 1 85 85 PHE H H 239 9.450 9.450 9.221 0.229 17569 5540 1 9 . 1 1 86 86 CYS N N 240 126.682 126.682 124.714 1.968 17569 5541 1 9 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.716 0.906 17569 5542 1 9 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.802 -0.460 17569 5543 1 9 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.168 3.089 17569 5544 1 9 . 1 1 86 86 CYS H H 240 11.309 11.309 9.475 1.834 17569 5545 1 9 . 1 1 87 87 LYS N N 241 117.865 117.865 124.025 -6.160 17569 5546 1 9 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.917 -0.068 17569 5547 1 9 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.221 -0.151 17569 5548 1 9 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.475 0.323 17569 5549 1 9 . 1 1 87 87 LYS H H 241 8.230 8.230 8.769 -0.539 17569 5550 1 9 . 1 1 88 88 LYS N N 242 117.949 117.949 118.449 -0.500 17569 5551 1 9 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.125 -0.147 17569 5552 1 9 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.925 1.445 17569 5553 1 9 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.999 0.317 17569 5554 1 9 . 1 1 88 88 LYS H H 242 7.945 7.945 8.521 -0.576 17569 5555 1 9 . 1 1 89 89 CYS N N 243 125.305 125.305 117.614 7.691 17569 5556 1 9 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.272 -0.530 17569 5557 1 9 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.915 1.912 17569 5558 1 9 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.129 1.112 17569 5559 1 9 . 1 1 89 89 CYS H H 243 9.297 9.297 7.613 1.684 17569 5560 1 9 . 1 1 90 90 ILE N N 244 119.687 119.687 121.454 -1.767 17569 5561 1 9 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.986 -0.379 17569 5562 1 9 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.854 0.096 17569 5563 1 9 . 1 1 90 90 ILE H H 244 7.997 7.997 7.657 0.340 17569 5564 1 9 . 1 1 91 91 LEU N N 245 120.280 120.280 121.181 -0.901 17569 5565 1 9 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.466 -0.781 17569 5566 1 9 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.534 0.701 17569 5567 1 9 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.919 0.039 17569 5568 1 9 . 1 1 91 91 LEU H H 245 8.810 8.810 8.781 0.029 17569 5569 1 9 . 1 1 92 92 ARG N N 246 116.901 116.901 117.460 -0.559 17569 5570 1 9 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.162 -0.345 17569 5571 1 9 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.818 1.162 17569 5572 1 9 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.098 0.502 17569 5573 1 9 . 1 1 92 92 ARG H H 246 8.086 8.086 7.573 0.513 17569 5574 1 9 . 1 1 93 93 ASN N N 247 111.200 111.200 115.697 -4.497 17569 5575 1 9 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.531 0.072 17569 5576 1 9 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.726 1.082 17569 5577 1 9 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.055 3.429 17569 5578 1 9 . 1 1 93 93 ASN H H 247 7.136 7.136 8.170 -1.034 17569 5579 1 9 . 1 1 94 94 LEU N N 248 118.807 118.807 117.607 1.200 17569 5580 1 9 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.574 0.240 17569 5581 1 9 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.194 -0.005 17569 5582 1 9 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.565 0.133 17569 5583 1 9 . 1 1 94 94 LEU H H 248 8.515 8.515 7.926 0.589 17569 5584 1 9 . 1 1 95 95 GLY N N 249 108.000 108.000 106.229 1.771 17569 5585 1 9 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.583 0.045 17569 5586 1 9 . 1 1 95 95 GLY H H 249 7.955 7.955 7.691 0.264 17569 5587 1 9 . 1 1 96 96 ARG N N 250 117.797 117.797 121.371 -3.574 17569 5588 1 9 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.338 -0.495 17569 5589 1 9 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.092 0.590 17569 5590 1 9 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.272 -0.412 17569 5591 1 9 . 1 1 96 96 ARG H H 250 8.559 8.559 8.714 -0.155 17569 5592 1 9 . 1 1 97 97 LYS N N 251 120.900 120.900 119.506 1.394 17569 5593 1 9 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.020 0.136 17569 5594 1 9 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.785 -0.629 17569 5595 1 9 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.606 -0.246 17569 5596 1 9 . 1 1 97 97 LYS H H 251 8.655 8.655 8.578 0.077 17569 5597 1 9 . 1 1 98 98 GLU N N 252 122.000 122.000 119.069 2.931 17569 5598 1 9 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.043 0.308 17569 5599 1 9 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.500 -0.918 17569 5600 1 9 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.380 -0.980 17569 5601 1 9 . 1 1 98 98 GLU H H 252 7.705 7.705 8.354 -0.649 17569 5602 1 9 . 1 1 99 99 LEU N N 253 117.400 117.400 120.807 -3.407 17569 5603 1 9 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.798 0.119 17569 5604 1 9 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.072 -0.074 17569 5605 1 9 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.843 -0.361 17569 5606 1 9 . 1 1 99 99 LEU H H 253 7.285 7.285 7.581 -0.296 17569 5607 1 9 . 1 1 100 100 SER N N 254 112.100 112.100 114.468 -2.368 17569 5608 1 9 . 1 1 100 100 SER HA H 254 4.107 4.107 4.148 -0.041 17569 5609 1 9 . 1 1 100 100 SER CA C 254 61.603 61.603 62.121 -0.518 17569 5610 1 9 . 1 1 100 100 SER CB C 254 62.622 62.622 62.975 -0.353 17569 5611 1 9 . 1 1 100 100 SER H H 254 8.326 8.326 8.216 0.110 17569 5612 1 9 . 1 1 101 101 THR N N 255 118.151 118.151 118.787 -0.636 17569 5613 1 9 . 1 1 101 101 THR HA H 255 4.026 4.026 4.104 -0.078 17569 5614 1 9 . 1 1 101 101 THR CA C 255 66.261 66.261 66.611 -0.350 17569 5615 1 9 . 1 1 101 101 THR CB C 255 68.735 68.735 68.639 0.096 17569 5616 1 9 . 1 1 101 101 THR H H 255 7.972 7.972 8.018 -0.046 17569 5617 1 9 . 1 1 102 102 ILE N N 256 120.100 120.100 123.193 -3.093 17569 5618 1 9 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.852 -0.389 17569 5619 1 9 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.686 0.088 17569 5620 1 9 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.515 0.226 17569 5621 1 9 . 1 1 102 102 ILE H H 256 7.868 7.868 8.591 -0.723 17569 5622 1 9 . 1 1 103 103 MET N N 257 114.876 114.876 116.860 -1.984 17569 5623 1 9 . 1 1 103 103 MET HA H 257 4.211 4.211 4.052 0.159 17569 5624 1 9 . 1 1 103 103 MET CA C 257 55.691 55.691 58.335 -2.644 17569 5625 1 9 . 1 1 103 103 MET CB C 257 32.000 32.000 32.943 -0.943 17569 5626 1 9 . 1 1 103 103 MET H H 257 7.606 7.606 7.356 0.250 17569 5627 1 9 . 1 1 104 104 ASP N N 258 119.976 119.976 119.081 0.895 17569 5628 1 9 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.758 -0.220 17569 5629 1 9 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.885 1.027 17569 5630 1 9 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.361 1.139 17569 5631 1 9 . 1 1 104 104 ASP H H 258 7.444 7.444 7.616 -0.172 17569 5632 1 9 . 1 1 105 105 GLU N N 259 124.388 124.388 122.333 2.055 17569 5633 1 9 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.514 -0.227 17569 5634 1 9 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.407 2.164 17569 5635 1 9 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.747 -0.205 17569 5636 1 9 . 1 1 105 105 GLU H H 259 8.559 8.559 8.214 0.345 17569 5637 1 9 . 1 1 106 106 ASN N N 260 117.201 117.201 118.636 -1.435 17569 5638 1 9 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.439 0.303 17569 5639 1 9 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.178 -0.435 17569 5640 1 9 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.609 1.309 17569 5641 1 9 . 1 1 106 106 ASN H H 260 8.673 8.673 8.773 -0.100 17569 5642 1 9 . 1 1 107 107 ASN N N 261 117.900 117.900 112.503 5.397 17569 5643 1 9 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.281 0.704 17569 5644 1 9 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.677 -2.375 17569 5645 1 9 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.422 3.192 17569 5646 1 9 . 1 1 107 107 ASN H H 261 7.956 7.956 8.731 -0.775 17569 5647 1 9 . 1 1 108 108 GLN N N 262 121.500 121.500 115.841 5.659 17569 5648 1 9 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.063 0.545 17569 5649 1 9 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.550 1.226 17569 5650 1 9 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.699 0.859 17569 5651 1 9 . 1 1 108 108 GLN H H 262 8.493 8.493 7.741 0.752 17569 5652 1 9 . 1 1 109 109 TRP N N 263 128.056 128.056 122.979 5.077 17569 5653 1 9 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.936 0.035 17569 5654 1 9 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.382 0.715 17569 5655 1 9 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.285 0.208 17569 5656 1 9 . 1 1 109 109 TRP H H 263 10.497 10.497 7.679 2.818 17569 5657 1 9 . 1 1 110 110 TYR N N 264 126.600 126.600 125.392 1.208 17569 5658 1 9 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.510 -0.108 17569 5659 1 9 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.764 -2.093 17569 5660 1 9 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.679 -1.671 17569 5661 1 9 . 1 1 110 110 TYR H H 264 7.545 7.545 8.010 -0.465 17569 5662 1 9 . 1 1 111 111 CYS N N 265 124.622 124.622 114.403 10.219 17569 5663 1 9 . 1 1 111 111 CYS H H 265 8.586 8.586 8.069 0.517 17569 5664 1 9 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.799 -0.607 17569 5665 1 9 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.559 1.157 17569 5666 1 9 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.567 1.353 17569 5667 1 9 . 1 1 113 113 ILE N N 267 119.504 119.504 119.710 -0.206 17569 5668 1 9 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.699 -0.749 17569 5669 1 9 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.969 0.280 17569 5670 1 9 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.565 -3.032 17569 5671 1 9 . 1 1 113 113 ILE H H 267 9.160 9.160 7.487 1.673 17569 5672 1 9 . 1 1 114 114 CYS N N 268 124.100 124.100 118.374 5.726 17569 5673 1 9 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.180 -0.366 17569 5674 1 9 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.671 3.629 17569 5675 1 9 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.105 2.616 17569 5676 1 9 . 1 1 114 114 CYS H H 268 7.818 7.818 8.249 -0.431 17569 5677 1 9 . 1 1 115 115 HIS N N 269 117.127 117.127 111.221 5.906 17569 5678 1 9 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.662 0.467 17569 5679 1 9 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.036 -0.875 17569 5680 1 9 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.804 2.388 17569 5681 1 9 . 1 1 115 115 HIS H H 269 8.953 8.953 7.803 1.150 17569 5682 1 9 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.463 0.479 17569 5683 1 9 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.562 -0.254 17569 5684 1 9 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.510 1.132 17569 5685 1 9 . 1 1 117 117 GLU N N 271 123.504 123.504 123.126 0.378 17569 5686 1 9 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.334 -0.314 17569 5687 1 9 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.246 3.623 17569 5688 1 9 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.004 -1.953 17569 5689 1 9 . 1 1 117 117 GLU H H 271 8.402 8.402 8.083 0.319 17569 5690 1 9 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.525 0.017 17569 5691 1 9 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.550 1.810 17569 5692 1 9 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.492 0.650 17569 5693 1 9 . 1 1 119 119 LEU N N 273 112.296 112.296 114.184 -1.888 17569 5694 1 9 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.904 -0.430 17569 5695 1 9 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.412 0.130 17569 5696 1 9 . 1 1 119 119 LEU H H 273 8.090 8.090 7.427 0.663 17569 5697 1 9 . 1 1 120 120 LEU N N 274 121.388 121.388 123.007 -1.619 17569 5698 1 9 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.911 0.116 17569 5699 1 9 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.364 -0.062 17569 5700 1 9 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.738 0.362 17569 5701 1 9 . 1 1 120 120 LEU H H 274 7.823 7.823 7.995 -0.172 17569 5702 1 9 . 1 1 121 121 ASP N N 275 118.600 118.600 118.435 0.165 17569 5703 1 9 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.322 0.219 17569 5704 1 9 . 1 1 121 121 ASP CA C 275 57.703 57.703 58.002 -0.299 17569 5705 1 9 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.308 -0.865 17569 5706 1 9 . 1 1 121 121 ASP H H 275 8.694 8.694 8.482 0.212 17569 5707 1 9 . 1 1 122 122 LEU N N 276 123.192 123.192 120.429 2.763 17569 5708 1 9 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.951 0.441 17569 5709 1 9 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.212 -0.241 17569 5710 1 9 . 1 1 122 122 LEU CB C 276 42.542 42.542 41.963 0.579 17569 5711 1 9 . 1 1 122 122 LEU H H 276 8.013 8.013 7.361 0.652 17569 5712 1 9 . 1 1 123 123 VAL N N 277 126.898 126.898 118.594 8.304 17569 5713 1 9 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.652 0.203 17569 5714 1 9 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.726 -0.063 17569 5715 1 9 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.811 1.247 17569 5716 1 9 . 1 1 123 123 VAL H H 277 8.781 8.781 7.788 0.993 17569 5717 1 9 . 1 1 124 124 THR N N 278 117.500 117.500 116.285 1.215 17569 5718 1 9 . 1 1 124 124 THR HA H 278 4.030 4.030 3.911 0.119 17569 5719 1 9 . 1 1 124 124 THR CA C 278 66.589 66.589 67.176 -0.587 17569 5720 1 9 . 1 1 124 124 THR CB C 278 68.410 68.410 68.548 -0.138 17569 5721 1 9 . 1 1 124 124 THR H H 278 8.722 8.722 8.382 0.340 17569 5722 1 9 . 1 1 125 125 ALA N N 279 124.700 124.700 123.951 0.749 17569 5723 1 9 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.086 0.175 17569 5724 1 9 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.970 0.326 17569 5725 1 9 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.014 -0.065 17569 5726 1 9 . 1 1 125 125 ALA H H 279 8.239 8.239 7.961 0.278 17569 5727 1 9 . 1 1 126 126 CYS N N 280 119.276 119.276 117.629 1.647 17569 5728 1 9 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.851 0.263 17569 5729 1 9 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.754 -1.651 17569 5730 1 9 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.888 -1.392 17569 5731 1 9 . 1 1 126 126 CYS H H 280 8.128 8.128 7.796 0.332 17569 5732 1 9 . 1 1 127 127 ASN N N 281 118.000 118.000 118.006 -0.006 17569 5733 1 9 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.617 -0.057 17569 5734 1 9 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.535 -0.396 17569 5735 1 9 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.115 -1.150 17569 5736 1 9 . 1 1 127 127 ASN H H 281 8.725 8.725 7.928 0.797 17569 5737 1 9 . 1 1 128 128 SER N N 282 116.601 116.601 116.834 -0.233 17569 5738 1 9 . 1 1 128 128 SER HA H 282 4.363 4.363 4.226 0.137 17569 5739 1 9 . 1 1 128 128 SER CA C 282 61.899 61.899 62.234 -0.335 17569 5740 1 9 . 1 1 128 128 SER CB C 282 62.630 62.630 63.056 -0.426 17569 5741 1 9 . 1 1 128 128 SER H H 282 8.542 8.542 7.645 0.897 17569 5742 1 9 . 1 1 129 129 VAL N N 283 123.272 123.272 121.517 1.755 17569 5743 1 9 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.599 0.078 17569 5744 1 9 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.442 0.066 17569 5745 1 9 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.066 0.152 17569 5746 1 9 . 1 1 129 129 VAL H H 283 7.990 7.990 8.073 -0.083 17569 5747 1 9 . 1 1 130 130 PHE N N 284 118.594 118.594 119.409 -0.815 17569 5748 1 9 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.332 -0.319 17569 5749 1 9 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.257 2.244 17569 5750 1 9 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.221 0.775 17569 5751 1 9 . 1 1 130 130 PHE H H 284 8.190 8.190 8.075 0.115 17569 5752 1 9 . 1 1 131 131 GLU N N 285 120.905 120.905 120.277 0.628 17569 5753 1 9 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.014 0.191 17569 5754 1 9 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.992 -0.778 17569 5755 1 9 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.370 0.130 17569 5756 1 9 . 1 1 131 131 GLU H H 285 8.699 8.699 8.910 -0.211 17569 5757 1 9 . 1 1 132 132 ASN N N 286 117.997 117.997 118.204 -0.207 17569 5758 1 9 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.664 -0.069 17569 5759 1 9 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.811 -0.196 17569 5760 1 9 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.766 0.086 17569 5761 1 9 . 1 1 132 132 ASN H H 286 8.082 8.082 7.982 0.100 17569 5762 1 9 . 1 1 133 133 LEU N N 287 120.800 120.800 122.493 -1.693 17569 5763 1 9 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.354 -0.237 17569 5764 1 9 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.281 -0.483 17569 5765 1 9 . 1 1 133 133 LEU H H 287 7.904 7.904 8.581 -0.677 17569 5766 1 9 . 1 1 134 134 GLU N N 288 118.200 118.200 118.222 -0.022 17569 5767 1 9 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.965 0.114 17569 5768 1 9 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.129 -1.132 17569 5769 1 9 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.153 0.089 17569 5770 1 9 . 1 1 134 134 GLU H H 288 8.157 8.157 8.866 -0.709 17569 5771 1 9 . 1 1 135 135 GLN N N 289 117.400 117.400 118.338 -0.938 17569 5772 1 9 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.108 0.066 17569 5773 1 9 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.533 -0.544 17569 5774 1 9 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.663 -0.583 17569 5775 1 9 . 1 1 135 135 GLN H H 289 7.869 7.869 7.556 0.313 17569 5776 1 9 . 1 1 136 136 LEU N N 290 121.000 121.000 121.716 -0.716 17569 5777 1 9 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.995 0.178 17569 5778 1 9 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.911 -0.773 17569 5779 1 9 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.648 0.352 17569 5780 1 9 . 1 1 136 136 LEU H H 290 7.968 7.968 7.557 0.411 17569 5781 1 9 . 1 1 137 137 LEU N N 291 118.900 118.900 118.497 0.403 17569 5782 1 9 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.057 0.184 17569 5783 1 9 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.435 -1.075 17569 5784 1 9 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.142 -0.670 17569 5785 1 9 . 1 1 137 137 LEU H H 291 8.154 8.154 7.744 0.410 17569 5786 1 9 . 1 1 138 138 GLN N N 292 117.993 117.993 116.084 1.909 17569 5787 1 9 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.207 0.065 17569 5788 1 9 . 1 1 138 138 GLN CA C 292 56.632 56.632 57.355 -0.723 17569 5789 1 9 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.492 -0.909 17569 5790 1 9 . 1 1 138 138 GLN H H 292 7.896 7.896 7.633 0.263 17569 5791 1 9 . 1 1 139 139 GLN N N 293 118.889 118.889 119.140 -0.251 17569 5792 1 9 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.438 -0.169 17569 5793 1 9 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.028 1.426 17569 5794 1 9 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.410 -0.341 17569 5795 1 9 . 1 1 139 139 GLN H H 293 8.091 8.091 8.378 -0.287 17569 5796 1 9 . 1 1 140 140 ASN N N 294 118.604 118.604 123.921 -5.317 17569 5797 1 9 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.683 0.076 17569 5798 1 9 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.092 0.129 17569 5799 1 9 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.453 -0.719 17569 5800 1 9 . 1 1 140 140 ASN H H 294 8.273 8.273 8.738 -0.465 17569 5801 1 9 . 1 1 141 141 LYS N N 295 121.685 121.685 119.910 1.775 17569 5802 1 9 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.103 0.257 17569 5803 1 9 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.858 -0.685 17569 5804 1 9 . 1 1 141 141 LYS CB C 295 32.535 32.535 31.417 1.118 17569 5805 1 9 . 1 1 141 141 LYS H H 295 8.089 8.089 8.226 -0.137 17569 5806 1 10 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.941 -0.554 17569 5807 1 10 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.165 0.280 17569 5808 1 10 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.268 -0.012 17569 5809 1 10 . 1 1 3 3 MET HA H 157 4.476 4.476 4.850 -0.374 17569 5810 1 10 . 1 1 3 3 MET CA C 157 55.401 55.401 56.544 -1.143 17569 5811 1 10 . 1 1 4 4 ALA N N 158 124.828 124.828 123.291 1.537 17569 5812 1 10 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.904 -0.590 17569 5813 1 10 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.843 0.668 17569 5814 1 10 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.677 -1.676 17569 5815 1 10 . 1 1 4 4 ALA H H 158 8.382 8.382 8.286 0.096 17569 5816 1 10 . 1 1 5 5 ASP N N 159 119.418 119.418 121.382 -1.964 17569 5817 1 10 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.818 -0.228 17569 5818 1 10 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.757 0.379 17569 5819 1 10 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.503 -1.488 17569 5820 1 10 . 1 1 5 5 ASP H H 159 8.312 8.312 8.250 0.062 17569 5821 1 10 . 1 1 6 6 LYS N N 160 121.604 121.604 121.354 0.250 17569 5822 1 10 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.700 -0.357 17569 5823 1 10 . 1 1 6 6 LYS H H 160 8.274 8.274 8.446 -0.172 17569 5824 1 10 . 1 1 7 7 ARG N N 161 121.611 121.611 120.975 0.636 17569 5825 1 10 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.505 -0.178 17569 5826 1 10 . 1 1 7 7 ARG H H 161 8.430 8.430 8.473 -0.043 17569 5827 1 10 . 1 1 8 8 GLY N N 162 109.606 109.606 109.600 0.006 17569 5828 1 10 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.722 0.325 17569 5829 1 10 . 1 1 8 8 GLY H H 162 8.473 8.473 8.163 0.310 17569 5830 1 10 . 1 1 9 9 ASP N N 163 120.187 120.187 120.078 0.109 17569 5831 1 10 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.814 -0.165 17569 5832 1 10 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.333 0.818 17569 5833 1 10 . 1 1 9 9 ASP H H 163 8.296 8.296 7.916 0.380 17569 5834 1 10 . 1 1 10 10 GLY N N 164 108.816 108.816 108.874 -0.058 17569 5835 1 10 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.458 0.909 17569 5836 1 10 . 1 1 10 10 GLY H H 164 8.458 8.458 8.265 0.193 17569 5837 1 10 . 1 1 11 11 LEU N N 165 121.195 121.195 121.124 0.071 17569 5838 1 10 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.550 -0.234 17569 5839 1 10 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.256 0.744 17569 5840 1 10 . 1 1 11 11 LEU CB C 165 41.932 41.932 43.515 -1.583 17569 5841 1 10 . 1 1 11 11 LEU H H 165 8.137 8.137 7.927 0.210 17569 5842 1 10 . 1 1 12 12 HIS N N 166 119.387 119.387 121.928 -2.541 17569 5843 1 10 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.600 0.055 17569 5844 1 10 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.513 0.756 17569 5845 1 10 . 1 1 12 12 HIS CB C 166 30.697 30.697 30.204 0.493 17569 5846 1 10 . 1 1 12 12 HIS H H 166 8.270 8.270 8.643 -0.373 17569 5847 1 10 . 1 1 13 13 GLY N N 167 109.899 109.899 110.121 -0.222 17569 5848 1 10 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.728 0.377 17569 5849 1 10 . 1 1 13 13 GLY H H 167 8.276 8.276 7.998 0.278 17569 5850 1 10 . 1 1 14 14 ILE N N 168 119.597 119.597 122.837 -3.240 17569 5851 1 10 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.510 -0.187 17569 5852 1 10 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.161 0.438 17569 5853 1 10 . 1 1 14 14 ILE CB C 168 38.950 38.950 39.459 -0.509 17569 5854 1 10 . 1 1 14 14 ILE H H 168 7.962 7.962 8.299 -0.337 17569 5855 1 10 . 1 1 15 15 VAL N N 169 127.578 127.578 128.942 -1.364 17569 5856 1 10 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.210 0.070 17569 5857 1 10 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.233 -0.916 17569 5858 1 10 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.168 2.234 17569 5859 1 10 . 1 1 15 15 VAL H H 169 9.011 9.011 8.729 0.282 17569 5860 1 10 . 1 1 16 16 SER N N 170 118.596 118.596 120.238 -1.642 17569 5861 1 10 . 1 1 16 16 SER HA H 170 5.140 5.140 4.985 0.155 17569 5862 1 10 . 1 1 16 16 SER CA C 170 55.985 55.985 55.974 0.011 17569 5863 1 10 . 1 1 16 16 SER CB C 170 65.261 65.261 65.652 -0.391 17569 5864 1 10 . 1 1 16 16 SER H H 170 8.242 8.242 7.848 0.394 17569 5865 1 10 . 1 1 17 17 CYS N N 171 123.783 123.783 123.895 -0.112 17569 5866 1 10 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.502 -0.321 17569 5867 1 10 . 1 1 17 17 CYS CA C 171 59.844 59.844 59.635 0.209 17569 5868 1 10 . 1 1 17 17 CYS CB C 171 31.373 31.373 29.108 2.265 17569 5869 1 10 . 1 1 17 17 CYS H H 171 8.894 8.894 8.365 0.529 17569 5870 1 10 . 1 1 18 18 THR N N 172 121.703 121.703 118.289 3.414 17569 5871 1 10 . 1 1 18 18 THR HA H 172 4.386 4.386 4.072 0.314 17569 5872 1 10 . 1 1 18 18 THR CA C 172 64.667 64.667 64.422 0.245 17569 5873 1 10 . 1 1 18 18 THR CB C 172 69.498 69.498 68.484 1.014 17569 5874 1 10 . 1 1 18 18 THR H H 172 8.788 8.788 8.304 0.484 17569 5875 1 10 . 1 1 19 19 ALA N N 173 131.364 131.364 121.858 9.506 17569 5876 1 10 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.115 0.381 17569 5877 1 10 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.874 0.151 17569 5878 1 10 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.583 3.599 17569 5879 1 10 . 1 1 19 19 ALA H H 173 9.680 9.680 7.985 1.695 17569 5880 1 10 . 1 1 20 20 CYS N N 174 115.498 115.498 113.844 1.654 17569 5881 1 10 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.391 0.577 17569 5882 1 10 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.551 -1.457 17569 5883 1 10 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.077 4.167 17569 5884 1 10 . 1 1 20 20 CYS H H 174 8.470 8.470 7.647 0.823 17569 5885 1 10 . 1 1 21 21 GLY N N 175 112.464 112.464 108.522 3.942 17569 5886 1 10 . 1 1 21 21 GLY CA C 175 45.706 45.706 44.986 0.720 17569 5887 1 10 . 1 1 21 21 GLY H H 175 7.884 7.884 7.970 -0.086 17569 5888 1 10 . 1 1 22 22 GLN N N 176 121.784 121.784 118.327 3.457 17569 5889 1 10 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.475 -0.099 17569 5890 1 10 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.712 1.579 17569 5891 1 10 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.732 -2.391 17569 5892 1 10 . 1 1 22 22 GLN H H 176 8.723 8.723 7.995 0.728 17569 5893 1 10 . 1 1 23 23 GLN N N 177 122.900 122.900 123.756 -0.856 17569 5894 1 10 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.150 0.380 17569 5895 1 10 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.957 -0.407 17569 5896 1 10 . 1 1 23 23 GLN CB C 177 28.460 28.460 28.855 -0.395 17569 5897 1 10 . 1 1 23 23 GLN H H 177 8.721 8.721 8.648 0.073 17569 5898 1 10 . 1 1 24 24 VAL N N 178 121.000 121.000 126.006 -5.006 17569 5899 1 10 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.896 0.628 17569 5900 1 10 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.845 -1.968 17569 5901 1 10 . 1 1 24 24 VAL H H 178 8.689 8.689 8.947 -0.258 17569 5902 1 10 . 1 1 25 25 ASN N N 179 121.392 121.392 122.462 -1.070 17569 5903 1 10 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.176 0.700 17569 5904 1 10 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.247 -2.098 17569 5905 1 10 . 1 1 25 25 ASN CB C 179 37.977 37.977 37.420 0.556 17569 5906 1 10 . 1 1 25 25 ASN H H 179 8.635 8.635 8.664 -0.029 17569 5907 1 10 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.788 -0.328 17569 5908 1 10 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.737 0.261 17569 5909 1 10 . 1 1 27 27 PHE CB C 181 38.393 38.393 40.760 -2.367 17569 5910 1 10 . 1 1 28 28 GLN N N 182 119.300 119.300 126.204 -6.904 17569 5911 1 10 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.009 0.509 17569 5912 1 10 . 1 1 28 28 GLN CA C 182 54.342 54.342 54.917 -0.575 17569 5913 1 10 . 1 1 28 28 GLN CB C 182 30.350 30.350 31.107 -0.757 17569 5914 1 10 . 1 1 28 28 GLN H H 182 7.494 7.494 8.566 -1.072 17569 5915 1 10 . 1 1 29 29 LYS N N 183 124.516 124.516 124.783 -0.267 17569 5916 1 10 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.327 -0.405 17569 5917 1 10 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.575 1.737 17569 5918 1 10 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.963 -0.677 17569 5919 1 10 . 1 1 29 29 LYS H H 183 8.779 8.779 8.173 0.606 17569 5920 1 10 . 1 1 30 30 ASP N N 184 116.500 116.500 123.284 -6.784 17569 5921 1 10 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.362 0.097 17569 5922 1 10 . 1 1 30 30 ASP CA C 184 54.536 54.536 55.524 -0.988 17569 5923 1 10 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.130 -0.159 17569 5924 1 10 . 1 1 30 30 ASP H H 184 8.556 8.556 8.764 -0.208 17569 5925 1 10 . 1 1 31 31 SER N N 185 111.505 111.505 111.940 -0.435 17569 5926 1 10 . 1 1 31 31 SER HA H 185 4.695 4.695 4.638 0.057 17569 5927 1 10 . 1 1 31 31 SER CA C 185 59.747 59.747 57.697 2.050 17569 5928 1 10 . 1 1 31 31 SER CB C 185 65.198 65.198 63.705 1.493 17569 5929 1 10 . 1 1 31 31 SER H H 185 7.933 7.933 7.963 -0.030 17569 5930 1 10 . 1 1 32 32 ILE N N 186 113.394 113.394 115.272 -1.878 17569 5931 1 10 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.430 0.456 17569 5932 1 10 . 1 1 32 32 ILE CA C 186 59.579 59.579 59.782 -0.203 17569 5933 1 10 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.488 1.324 17569 5934 1 10 . 1 1 32 32 ILE H H 186 7.105 7.105 7.184 -0.079 17569 5935 1 10 . 1 1 33 33 TYR N N 187 119.098 119.098 121.394 -2.296 17569 5936 1 10 . 1 1 33 33 TYR HA H 187 4.523 4.523 4.732 -0.209 17569 5937 1 10 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.707 0.553 17569 5938 1 10 . 1 1 33 33 TYR CB C 187 43.440 43.440 42.445 0.995 17569 5939 1 10 . 1 1 33 33 TYR H H 187 8.954 8.954 8.221 0.733 17569 5940 1 10 . 1 1 34 34 ARG N N 188 118.502 118.502 124.703 -6.201 17569 5941 1 10 . 1 1 34 34 ARG HA H 188 4.637 4.637 5.148 -0.511 17569 5942 1 10 . 1 1 34 34 ARG CA C 188 54.752 54.752 55.517 -0.765 17569 5943 1 10 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.892 0.358 17569 5944 1 10 . 1 1 34 34 ARG H H 188 8.412 8.412 8.767 -0.355 17569 5945 1 10 . 1 1 35 35 HIS N N 189 126.596 126.596 128.982 -2.386 17569 5946 1 10 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.870 -0.278 17569 5947 1 10 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.289 -0.568 17569 5948 1 10 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.043 1.429 17569 5949 1 10 . 1 1 35 35 HIS H H 189 9.813 9.813 9.108 0.705 17569 5950 1 10 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.631 -0.333 17569 5951 1 10 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.496 0.780 17569 5952 1 10 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.530 0.321 17569 5953 1 10 . 1 1 37 37 SER N N 191 110.003 110.003 113.437 -3.434 17569 5954 1 10 . 1 1 37 37 SER HA H 191 4.918 4.918 4.260 0.658 17569 5955 1 10 . 1 1 37 37 SER CA C 191 59.031 59.031 60.655 -1.624 17569 5956 1 10 . 1 1 37 37 SER CB C 191 65.104 65.104 63.312 1.792 17569 5957 1 10 . 1 1 37 37 SER H H 191 8.934 8.934 8.229 0.705 17569 5958 1 10 . 1 1 38 38 LEU N N 192 120.959 120.959 113.971 6.988 17569 5959 1 10 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.881 -0.752 17569 5960 1 10 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.442 1.704 17569 5961 1 10 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.524 1.472 17569 5962 1 10 . 1 1 38 38 LEU H H 192 8.649 8.649 7.019 1.630 17569 5963 1 10 . 1 1 39 39 GLN N N 193 108.600 108.600 118.825 -10.225 17569 5964 1 10 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.142 -0.237 17569 5965 1 10 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.622 0.192 17569 5966 1 10 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.016 -1.982 17569 5967 1 10 . 1 1 39 39 GLN H H 193 8.465 8.465 7.955 0.510 17569 5968 1 10 . 1 1 40 40 VAL N N 194 105.325 105.325 118.237 -12.912 17569 5969 1 10 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.512 0.038 17569 5970 1 10 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.671 -1.030 17569 5971 1 10 . 1 1 40 40 VAL H H 194 6.256 6.256 8.009 -1.753 17569 5972 1 10 . 1 1 41 41 LEU N N 195 123.100 123.100 123.391 -0.291 17569 5973 1 10 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.845 -0.029 17569 5974 1 10 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.939 3.243 17569 5975 1 10 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.950 0.620 17569 5976 1 10 . 1 1 41 41 LEU H H 195 9.154 9.154 8.690 0.464 17569 5977 1 10 . 1 1 42 42 ILE N N 196 124.396 124.396 117.637 6.759 17569 5978 1 10 . 1 1 42 42 ILE HA H 196 6.352 6.352 5.051 1.301 17569 5979 1 10 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.515 0.715 17569 5980 1 10 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.983 1.286 17569 5981 1 10 . 1 1 42 42 ILE H H 196 9.766 9.766 9.256 0.510 17569 5982 1 10 . 1 1 43 43 CYS N N 197 121.500 121.500 115.693 5.807 17569 5983 1 10 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.047 0.215 17569 5984 1 10 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.328 0.375 17569 5985 1 10 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.095 2.205 17569 5986 1 10 . 1 1 43 43 CYS H H 197 9.882 9.882 8.487 1.395 17569 5987 1 10 . 1 1 44 44 LYS N N 198 117.995 117.995 122.452 -4.457 17569 5988 1 10 . 1 1 44 44 LYS HA H 198 3.989 3.989 3.659 0.330 17569 5989 1 10 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.216 -0.556 17569 5990 1 10 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.549 0.151 17569 5991 1 10 . 1 1 44 44 LYS H H 198 8.089 8.089 8.710 -0.621 17569 5992 1 10 . 1 1 45 45 ASN N N 199 119.200 119.200 116.955 2.245 17569 5993 1 10 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.486 0.028 17569 5994 1 10 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.227 0.492 17569 5995 1 10 . 1 1 45 45 ASN CB C 199 38.167 38.167 37.967 0.200 17569 5996 1 10 . 1 1 45 45 ASN H H 199 8.356 8.356 8.425 -0.069 17569 5997 1 10 . 1 1 46 46 CYS N N 200 126.600 126.600 118.931 7.669 17569 5998 1 10 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.870 0.311 17569 5999 1 10 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.079 2.416 17569 6000 1 10 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.041 2.142 17569 6001 1 10 . 1 1 46 46 CYS H H 200 9.189 9.189 7.897 1.292 17569 6002 1 10 . 1 1 47 47 PHE N N 201 121.962 121.962 119.936 2.026 17569 6003 1 10 . 1 1 47 47 PHE HA H 201 3.870 3.870 3.956 -0.086 17569 6004 1 10 . 1 1 47 47 PHE CA C 201 62.269 62.269 61.088 1.181 17569 6005 1 10 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.175 0.992 17569 6006 1 10 . 1 1 47 47 PHE H H 201 8.826 8.826 7.627 1.199 17569 6007 1 10 . 1 1 48 48 LYS N N 202 117.400 117.400 118.918 -1.518 17569 6008 1 10 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.940 -0.242 17569 6009 1 10 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.013 -0.061 17569 6010 1 10 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.116 -0.574 17569 6011 1 10 . 1 1 48 48 LYS H H 202 8.512 8.512 8.441 0.071 17569 6012 1 10 . 1 1 49 49 TYR N N 203 120.400 120.400 121.737 -1.337 17569 6013 1 10 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.163 0.251 17569 6014 1 10 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.843 -1.071 17569 6015 1 10 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.520 -0.074 17569 6016 1 10 . 1 1 49 49 TYR H H 203 8.133 8.133 7.888 0.245 17569 6017 1 10 . 1 1 50 50 TYR N N 204 121.783 121.783 117.649 4.134 17569 6018 1 10 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.510 -1.015 17569 6019 1 10 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.290 2.660 17569 6020 1 10 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.469 1.023 17569 6021 1 10 . 1 1 50 50 TYR H H 204 8.765 8.765 7.690 1.075 17569 6022 1 10 . 1 1 51 51 MET N N 205 110.800 110.800 116.307 -5.507 17569 6023 1 10 . 1 1 51 51 MET HA H 205 4.349 4.349 4.135 0.214 17569 6024 1 10 . 1 1 51 51 MET CA C 205 53.505 53.505 58.152 -4.647 17569 6025 1 10 . 1 1 51 51 MET CB C 205 30.384 30.384 33.136 -2.752 17569 6026 1 10 . 1 1 51 51 MET H H 205 7.771 7.771 7.727 0.044 17569 6027 1 10 . 1 1 52 52 SER N N 206 116.800 116.800 113.295 3.505 17569 6028 1 10 . 1 1 52 52 SER HA H 206 3.919 3.919 4.326 -0.407 17569 6029 1 10 . 1 1 52 52 SER CA C 206 61.621 61.621 59.124 2.497 17569 6030 1 10 . 1 1 52 52 SER CB C 206 62.611 62.611 64.391 -1.780 17569 6031 1 10 . 1 1 52 52 SER H H 206 7.581 7.581 8.185 -0.604 17569 6032 1 10 . 1 1 53 53 ASP N N 207 117.400 117.400 122.926 -5.526 17569 6033 1 10 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.764 -0.192 17569 6034 1 10 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.729 -0.630 17569 6035 1 10 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.223 -0.035 17569 6036 1 10 . 1 1 53 53 ASP H H 207 7.085 7.085 7.982 -0.897 17569 6037 1 10 . 1 1 54 54 ASP N N 208 119.405 119.405 121.746 -2.341 17569 6038 1 10 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.917 -0.528 17569 6039 1 10 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.525 0.375 17569 6040 1 10 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.567 -1.218 17569 6041 1 10 . 1 1 54 54 ASP H H 208 8.439 8.439 8.301 0.138 17569 6042 1 10 . 1 1 55 55 ILE N N 209 124.698 124.698 120.772 3.926 17569 6043 1 10 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.487 -0.487 17569 6044 1 10 . 1 1 55 55 ILE CA C 209 62.278 62.278 59.755 2.523 17569 6045 1 10 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.557 0.734 17569 6046 1 10 . 1 1 55 55 ILE H H 209 8.128 8.128 8.458 -0.330 17569 6047 1 10 . 1 1 56 56 SER N N 210 126.703 126.703 118.522 8.181 17569 6048 1 10 . 1 1 56 56 SER HA H 210 4.365 4.365 4.793 -0.428 17569 6049 1 10 . 1 1 56 56 SER CA C 210 57.769 57.769 57.563 0.206 17569 6050 1 10 . 1 1 56 56 SER CB C 210 64.991 64.991 65.062 -0.071 17569 6051 1 10 . 1 1 56 56 SER H H 210 8.815 8.815 8.450 0.365 17569 6052 1 10 . 1 1 57 57 ARG N N 211 116.885 116.885 119.385 -2.500 17569 6053 1 10 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.535 0.507 17569 6054 1 10 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.416 -1.016 17569 6055 1 10 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.779 2.505 17569 6056 1 10 . 1 1 57 57 ARG H H 211 8.365 8.365 8.438 -0.073 17569 6057 1 10 . 1 1 58 58 ASP N N 212 121.982 121.982 120.477 1.505 17569 6058 1 10 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.626 -0.011 17569 6059 1 10 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.288 -2.066 17569 6060 1 10 . 1 1 58 58 ASP CB C 212 41.502 41.502 41.978 -0.476 17569 6061 1 10 . 1 1 58 58 ASP H H 212 8.706 8.706 8.492 0.214 17569 6062 1 10 . 1 1 59 59 SER N N 213 114.164 114.164 114.376 -0.212 17569 6063 1 10 . 1 1 59 59 SER HA H 213 4.212 4.212 4.271 -0.059 17569 6064 1 10 . 1 1 59 59 SER CA C 213 60.840 60.840 60.539 0.301 17569 6065 1 10 . 1 1 59 59 SER CB C 213 62.714 62.714 63.248 -0.534 17569 6066 1 10 . 1 1 59 59 SER H H 213 8.687 8.687 8.545 0.142 17569 6067 1 10 . 1 1 60 60 ASP N N 214 120.899 120.899 119.173 1.726 17569 6068 1 10 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.716 0.109 17569 6069 1 10 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.432 0.779 17569 6070 1 10 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.266 1.292 17569 6071 1 10 . 1 1 60 60 ASP H H 214 8.193 8.193 7.880 0.313 17569 6072 1 10 . 1 1 61 61 GLY N N 215 108.300 108.300 107.383 0.917 17569 6073 1 10 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.877 -0.480 17569 6074 1 10 . 1 1 61 61 GLY H H 215 8.234 8.234 7.710 0.524 17569 6075 1 10 . 1 1 62 62 MET N N 216 120.002 120.002 118.375 1.627 17569 6076 1 10 . 1 1 62 62 MET HA H 216 4.972 4.972 4.435 0.537 17569 6077 1 10 . 1 1 62 62 MET CA C 216 53.151 53.151 54.617 -1.466 17569 6078 1 10 . 1 1 62 62 MET CB C 216 32.311 32.311 32.667 -0.356 17569 6079 1 10 . 1 1 62 62 MET H H 216 8.376 8.376 7.740 0.636 17569 6080 1 10 . 1 1 63 63 ASP N N 217 127.300 127.300 118.570 8.730 17569 6081 1 10 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.425 0.541 17569 6082 1 10 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.461 0.108 17569 6083 1 10 . 1 1 63 63 ASP H H 217 9.368 9.368 7.745 1.623 17569 6084 1 10 . 1 1 64 64 GLU N N 218 114.400 114.400 125.262 -10.862 17569 6085 1 10 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.508 -0.352 17569 6086 1 10 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.672 0.178 17569 6087 1 10 . 1 1 64 64 GLU H H 218 8.583 8.583 8.412 0.171 17569 6088 1 10 . 1 1 65 65 GLN N N 219 115.500 115.500 116.759 -1.259 17569 6089 1 10 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.453 -0.142 17569 6090 1 10 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.520 -0.174 17569 6091 1 10 . 1 1 65 65 GLN H H 219 7.158 7.158 7.785 -0.627 17569 6092 1 10 . 1 1 66 66 CYS N N 220 122.600 122.600 117.637 4.963 17569 6093 1 10 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.162 -1.085 17569 6094 1 10 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.419 1.110 17569 6095 1 10 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.423 1.549 17569 6096 1 10 . 1 1 66 66 CYS H H 220 8.248 8.248 8.385 -0.137 17569 6097 1 10 . 1 1 67 67 ARG N N 221 130.363 130.363 123.734 6.629 17569 6098 1 10 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.453 -0.386 17569 6099 1 10 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.205 -3.189 17569 6100 1 10 . 1 1 67 67 ARG H H 221 9.145 9.145 8.595 0.550 17569 6101 1 10 . 1 1 68 68 TRP N N 222 124.200 124.200 120.816 3.384 17569 6102 1 10 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.755 -0.319 17569 6103 1 10 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.276 0.804 17569 6104 1 10 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.614 0.580 17569 6105 1 10 . 1 1 68 68 TRP H H 222 9.689 9.689 8.216 1.473 17569 6106 1 10 . 1 1 69 69 CYS N N 223 116.297 116.297 111.115 5.182 17569 6107 1 10 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.072 0.019 17569 6108 1 10 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.139 2.963 17569 6109 1 10 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.584 4.754 17569 6110 1 10 . 1 1 69 69 CYS H H 223 8.822 8.822 7.701 1.121 17569 6111 1 10 . 1 1 70 70 ALA N N 224 123.112 123.112 123.489 -0.377 17569 6112 1 10 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.372 0.034 17569 6113 1 10 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.474 -0.622 17569 6114 1 10 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.818 -0.098 17569 6115 1 10 . 1 1 70 70 ALA H H 224 8.787 8.787 8.360 0.427 17569 6116 1 10 . 1 1 71 71 GLU N N 225 118.300 118.300 120.198 -1.898 17569 6117 1 10 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.467 0.841 17569 6118 1 10 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.726 -2.427 17569 6119 1 10 . 1 1 71 71 GLU H H 225 8.541 8.541 8.188 0.353 17569 6120 1 10 . 1 1 72 72 GLY N N 226 111.995 111.995 110.486 1.509 17569 6121 1 10 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.677 -0.274 17569 6122 1 10 . 1 1 72 72 GLY H H 226 9.837 9.837 8.257 1.580 17569 6123 1 10 . 1 1 73 73 GLY N N 227 106.600 106.600 107.518 -0.918 17569 6124 1 10 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.367 0.604 17569 6125 1 10 . 1 1 73 73 GLY H H 227 7.772 7.772 8.169 -0.397 17569 6126 1 10 . 1 1 74 74 ASN N N 228 124.277 124.277 119.083 5.194 17569 6127 1 10 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.463 0.618 17569 6128 1 10 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.866 -0.766 17569 6129 1 10 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.330 -0.246 17569 6130 1 10 . 1 1 74 74 ASN H H 228 8.876 8.876 8.540 0.336 17569 6131 1 10 . 1 1 75 75 LEU N N 229 123.050 123.050 121.910 1.140 17569 6132 1 10 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.836 -0.236 17569 6133 1 10 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.451 0.911 17569 6134 1 10 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.014 0.486 17569 6135 1 10 . 1 1 75 75 LEU H H 229 8.901 8.901 8.070 0.831 17569 6136 1 10 . 1 1 76 76 ILE N N 230 123.552 123.552 123.858 -0.306 17569 6137 1 10 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.051 0.434 17569 6138 1 10 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.879 -1.179 17569 6139 1 10 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.233 -0.834 17569 6140 1 10 . 1 1 76 76 ILE H H 230 9.406 9.406 9.246 0.160 17569 6141 1 10 . 1 1 77 77 CYS N N 231 124.637 124.637 124.401 0.236 17569 6142 1 10 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.645 -0.770 17569 6143 1 10 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.370 0.989 17569 6144 1 10 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.509 -0.075 17569 6145 1 10 . 1 1 77 77 CYS H H 231 8.809 8.809 8.218 0.591 17569 6146 1 10 . 1 1 78 78 CYS N N 232 125.697 125.697 122.501 3.196 17569 6147 1 10 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.893 -0.609 17569 6148 1 10 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.383 3.501 17569 6149 1 10 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.549 1.621 17569 6150 1 10 . 1 1 78 78 CYS H H 232 8.579 8.579 8.776 -0.197 17569 6151 1 10 . 1 1 79 79 ASP N N 233 123.600 123.600 125.402 -1.802 17569 6152 1 10 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.606 0.151 17569 6153 1 10 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.036 2.953 17569 6154 1 10 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.650 0.979 17569 6155 1 10 . 1 1 79 79 ASP H H 233 8.577 8.577 8.102 0.475 17569 6156 1 10 . 1 1 80 80 PHE N N 234 122.100 122.100 116.743 5.357 17569 6157 1 10 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.560 -0.034 17569 6158 1 10 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.210 1.699 17569 6159 1 10 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.275 1.575 17569 6160 1 10 . 1 1 80 80 PHE H H 234 10.432 10.432 7.321 3.111 17569 6161 1 10 . 1 1 81 81 CYS N N 235 124.300 124.300 117.806 6.494 17569 6162 1 10 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.713 0.443 17569 6163 1 10 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.119 -0.074 17569 6164 1 10 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.732 3.675 17569 6165 1 10 . 1 1 81 81 CYS H H 235 8.476 8.476 8.052 0.424 17569 6166 1 10 . 1 1 82 82 HIS N N 236 112.598 112.598 118.959 -6.361 17569 6167 1 10 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.159 0.824 17569 6168 1 10 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.833 -1.435 17569 6169 1 10 . 1 1 82 82 HIS CB C 236 30.257 30.257 28.168 2.090 17569 6170 1 10 . 1 1 82 82 HIS H H 236 6.699 6.699 8.238 -1.539 17569 6171 1 10 . 1 1 83 83 ASN N N 237 123.600 123.600 119.628 3.972 17569 6172 1 10 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.904 -0.103 17569 6173 1 10 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.187 2.429 17569 6174 1 10 . 1 1 83 83 ASN H H 237 9.097 9.097 7.992 1.105 17569 6175 1 10 . 1 1 84 84 ALA N N 238 122.000 122.000 123.292 -1.292 17569 6176 1 10 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.401 0.008 17569 6177 1 10 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.185 0.179 17569 6178 1 10 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.183 2.887 17569 6179 1 10 . 1 1 84 84 ALA H H 238 9.885 9.885 8.690 1.195 17569 6180 1 10 . 1 1 85 85 PHE N N 239 116.707 116.707 120.832 -4.125 17569 6181 1 10 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.133 0.895 17569 6182 1 10 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.654 -0.437 17569 6183 1 10 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.148 1.516 17569 6184 1 10 . 1 1 85 85 PHE H H 239 9.450 9.450 9.143 0.307 17569 6185 1 10 . 1 1 86 86 CYS N N 240 126.682 126.682 124.777 1.905 17569 6186 1 10 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.713 0.909 17569 6187 1 10 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.809 -0.467 17569 6188 1 10 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.216 3.041 17569 6189 1 10 . 1 1 86 86 CYS H H 240 11.309 11.309 9.423 1.886 17569 6190 1 10 . 1 1 87 87 LYS N N 241 117.865 117.865 124.827 -6.962 17569 6191 1 10 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.919 -0.070 17569 6192 1 10 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.023 0.047 17569 6193 1 10 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.408 0.390 17569 6194 1 10 . 1 1 87 87 LYS H H 241 8.230 8.230 8.844 -0.614 17569 6195 1 10 . 1 1 88 88 LYS N N 242 117.949 117.949 118.301 -0.352 17569 6196 1 10 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.120 -0.142 17569 6197 1 10 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.153 1.217 17569 6198 1 10 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.269 0.047 17569 6199 1 10 . 1 1 88 88 LYS H H 242 7.945 7.945 8.482 -0.537 17569 6200 1 10 . 1 1 89 89 CYS N N 243 125.305 125.305 117.717 7.588 17569 6201 1 10 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.269 -0.527 17569 6202 1 10 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.441 2.386 17569 6203 1 10 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.162 1.079 17569 6204 1 10 . 1 1 89 89 CYS H H 243 9.297 9.297 7.718 1.579 17569 6205 1 10 . 1 1 90 90 ILE N N 244 119.687 119.687 121.424 -1.737 17569 6206 1 10 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.949 -0.342 17569 6207 1 10 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.838 0.112 17569 6208 1 10 . 1 1 90 90 ILE H H 244 7.997 7.997 7.687 0.310 17569 6209 1 10 . 1 1 91 91 LEU N N 245 120.280 120.280 121.170 -0.890 17569 6210 1 10 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.281 -0.596 17569 6211 1 10 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.581 0.654 17569 6212 1 10 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.037 -0.079 17569 6213 1 10 . 1 1 91 91 LEU H H 245 8.810 8.810 8.678 0.132 17569 6214 1 10 . 1 1 92 92 ARG N N 246 116.901 116.901 117.010 -0.109 17569 6215 1 10 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.129 -0.312 17569 6216 1 10 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.895 1.085 17569 6217 1 10 . 1 1 92 92 ARG CB C 246 30.600 30.600 29.868 0.732 17569 6218 1 10 . 1 1 92 92 ARG H H 246 8.086 8.086 7.614 0.472 17569 6219 1 10 . 1 1 93 93 ASN N N 247 111.200 111.200 116.702 -5.502 17569 6220 1 10 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.551 0.052 17569 6221 1 10 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.569 1.239 17569 6222 1 10 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.228 3.256 17569 6223 1 10 . 1 1 93 93 ASN H H 247 7.136 7.136 8.300 -1.164 17569 6224 1 10 . 1 1 94 94 LEU N N 248 118.807 118.807 117.335 1.472 17569 6225 1 10 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.438 0.376 17569 6226 1 10 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.451 -0.262 17569 6227 1 10 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.873 -0.175 17569 6228 1 10 . 1 1 94 94 LEU H H 248 8.515 8.515 8.035 0.480 17569 6229 1 10 . 1 1 95 95 GLY N N 249 108.000 108.000 105.354 2.646 17569 6230 1 10 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.598 0.030 17569 6231 1 10 . 1 1 95 95 GLY H H 249 7.955 7.955 7.776 0.179 17569 6232 1 10 . 1 1 96 96 ARG N N 250 117.797 117.797 121.858 -4.061 17569 6233 1 10 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.269 -0.426 17569 6234 1 10 . 1 1 96 96 ARG CA C 250 58.682 58.682 57.934 0.748 17569 6235 1 10 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.212 -0.352 17569 6236 1 10 . 1 1 96 96 ARG H H 250 8.559 8.559 8.659 -0.100 17569 6237 1 10 . 1 1 97 97 LYS N N 251 120.900 120.900 118.891 2.009 17569 6238 1 10 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.079 0.077 17569 6239 1 10 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.635 -0.479 17569 6240 1 10 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.634 -0.273 17569 6241 1 10 . 1 1 97 97 LYS H H 251 8.655 8.655 8.611 0.044 17569 6242 1 10 . 1 1 98 98 GLU N N 252 122.000 122.000 118.906 3.094 17569 6243 1 10 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.132 0.219 17569 6244 1 10 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.438 -0.856 17569 6245 1 10 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.078 -0.678 17569 6246 1 10 . 1 1 98 98 GLU H H 252 7.705 7.705 8.372 -0.667 17569 6247 1 10 . 1 1 99 99 LEU N N 253 117.400 117.400 121.248 -3.848 17569 6248 1 10 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.767 0.150 17569 6249 1 10 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.247 -0.249 17569 6250 1 10 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.827 -0.345 17569 6251 1 10 . 1 1 99 99 LEU H H 253 7.285 7.285 7.583 -0.298 17569 6252 1 10 . 1 1 100 100 SER N N 254 112.100 112.100 114.881 -2.781 17569 6253 1 10 . 1 1 100 100 SER HA H 254 4.107 4.107 4.041 0.066 17569 6254 1 10 . 1 1 100 100 SER CA C 254 61.603 61.603 61.928 -0.325 17569 6255 1 10 . 1 1 100 100 SER CB C 254 62.622 62.622 63.219 -0.597 17569 6256 1 10 . 1 1 100 100 SER H H 254 8.326 8.326 7.750 0.576 17569 6257 1 10 . 1 1 101 101 THR N N 255 118.151 118.151 118.834 -0.683 17569 6258 1 10 . 1 1 101 101 THR HA H 255 4.026 4.026 4.022 0.004 17569 6259 1 10 . 1 1 101 101 THR CA C 255 66.261 66.261 66.319 -0.058 17569 6260 1 10 . 1 1 101 101 THR CB C 255 68.735 68.735 68.781 -0.047 17569 6261 1 10 . 1 1 101 101 THR H H 255 7.972 7.972 7.563 0.409 17569 6262 1 10 . 1 1 102 102 ILE N N 256 120.100 120.100 122.490 -2.390 17569 6263 1 10 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.588 -0.125 17569 6264 1 10 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.813 -0.039 17569 6265 1 10 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.358 0.383 17569 6266 1 10 . 1 1 102 102 ILE H H 256 7.868 7.868 8.330 -0.462 17569 6267 1 10 . 1 1 103 103 MET N N 257 114.876 114.876 116.367 -1.491 17569 6268 1 10 . 1 1 103 103 MET HA H 257 4.211 4.211 4.091 0.120 17569 6269 1 10 . 1 1 103 103 MET CA C 257 55.691 55.691 58.392 -2.701 17569 6270 1 10 . 1 1 103 103 MET CB C 257 32.000 32.000 32.631 -0.631 17569 6271 1 10 . 1 1 103 103 MET H H 257 7.606 7.606 7.268 0.338 17569 6272 1 10 . 1 1 104 104 ASP N N 258 119.976 119.976 118.862 1.114 17569 6273 1 10 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.797 -0.259 17569 6274 1 10 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.963 0.949 17569 6275 1 10 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.298 1.202 17569 6276 1 10 . 1 1 104 104 ASP H H 258 7.444 7.444 7.671 -0.227 17569 6277 1 10 . 1 1 105 105 GLU N N 259 124.388 124.388 120.364 4.024 17569 6278 1 10 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.508 -0.221 17569 6279 1 10 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.008 2.563 17569 6280 1 10 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.625 -0.083 17569 6281 1 10 . 1 1 105 105 GLU H H 259 8.559 8.559 8.274 0.285 17569 6282 1 10 . 1 1 106 106 ASN N N 260 117.201 117.201 118.609 -1.408 17569 6283 1 10 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.425 0.317 17569 6284 1 10 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.796 -0.053 17569 6285 1 10 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.090 1.828 17569 6286 1 10 . 1 1 106 106 ASN H H 260 8.673 8.673 8.514 0.159 17569 6287 1 10 . 1 1 107 107 ASN N N 261 117.900 117.900 114.139 3.761 17569 6288 1 10 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.298 0.687 17569 6289 1 10 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.655 -2.353 17569 6290 1 10 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.869 2.745 17569 6291 1 10 . 1 1 107 107 ASN H H 261 7.956 7.956 8.709 -0.753 17569 6292 1 10 . 1 1 108 108 GLN N N 262 121.500 121.500 115.013 6.487 17569 6293 1 10 . 1 1 108 108 GLN HA H 262 4.608 4.608 3.949 0.659 17569 6294 1 10 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.795 0.981 17569 6295 1 10 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.744 0.814 17569 6296 1 10 . 1 1 108 108 GLN H H 262 8.493 8.493 7.604 0.889 17569 6297 1 10 . 1 1 109 109 TRP N N 263 128.056 128.056 123.413 4.643 17569 6298 1 10 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.731 0.240 17569 6299 1 10 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.451 0.646 17569 6300 1 10 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.844 0.649 17569 6301 1 10 . 1 1 109 109 TRP H H 263 10.497 10.497 8.032 2.465 17569 6302 1 10 . 1 1 110 110 TYR N N 264 126.600 126.600 125.880 0.720 17569 6303 1 10 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.302 0.100 17569 6304 1 10 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.915 -2.244 17569 6305 1 10 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.174 -1.166 17569 6306 1 10 . 1 1 110 110 TYR H H 264 7.545 7.545 8.156 -0.611 17569 6307 1 10 . 1 1 111 111 CYS N N 265 124.622 124.622 114.510 10.112 17569 6308 1 10 . 1 1 111 111 CYS H H 265 8.586 8.586 8.360 0.226 17569 6309 1 10 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.821 -0.629 17569 6310 1 10 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.598 1.117 17569 6311 1 10 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.645 1.275 17569 6312 1 10 . 1 1 113 113 ILE N N 267 119.504 119.504 119.680 -0.176 17569 6313 1 10 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.534 -0.584 17569 6314 1 10 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.896 0.353 17569 6315 1 10 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.558 -3.025 17569 6316 1 10 . 1 1 113 113 ILE H H 267 9.160 9.160 7.466 1.694 17569 6317 1 10 . 1 1 114 114 CYS N N 268 124.100 124.100 118.373 5.727 17569 6318 1 10 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.172 -0.358 17569 6319 1 10 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.690 3.610 17569 6320 1 10 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.069 2.652 17569 6321 1 10 . 1 1 114 114 CYS H H 268 7.818 7.818 8.237 -0.419 17569 6322 1 10 . 1 1 115 115 HIS N N 269 117.127 117.127 111.264 5.863 17569 6323 1 10 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.652 0.477 17569 6324 1 10 . 1 1 115 115 HIS CA C 269 52.161 52.161 52.923 -0.762 17569 6325 1 10 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.952 2.240 17569 6326 1 10 . 1 1 115 115 HIS H H 269 8.953 8.953 7.756 1.197 17569 6327 1 10 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.453 0.489 17569 6328 1 10 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.487 -0.179 17569 6329 1 10 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.717 0.925 17569 6330 1 10 . 1 1 117 117 GLU N N 271 123.504 123.504 124.249 -0.745 17569 6331 1 10 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.398 -0.378 17569 6332 1 10 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.756 4.113 17569 6333 1 10 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.819 -1.768 17569 6334 1 10 . 1 1 117 117 GLU H H 271 8.402 8.402 8.177 0.225 17569 6335 1 10 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.617 -0.075 17569 6336 1 10 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.449 1.910 17569 6337 1 10 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.364 0.778 17569 6338 1 10 . 1 1 119 119 LEU N N 273 112.296 112.296 113.859 -1.563 17569 6339 1 10 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.978 -0.504 17569 6340 1 10 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.569 -0.027 17569 6341 1 10 . 1 1 119 119 LEU H H 273 8.090 8.090 7.499 0.591 17569 6342 1 10 . 1 1 120 120 LEU N N 274 121.388 121.388 123.534 -2.146 17569 6343 1 10 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.941 0.086 17569 6344 1 10 . 1 1 120 120 LEU CA C 274 59.301 59.301 60.062 -0.761 17569 6345 1 10 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.428 0.672 17569 6346 1 10 . 1 1 120 120 LEU H H 274 7.823 7.823 8.450 -0.627 17569 6347 1 10 . 1 1 121 121 ASP N N 275 118.600 118.600 118.924 -0.324 17569 6348 1 10 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.387 0.154 17569 6349 1 10 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.606 0.097 17569 6350 1 10 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.155 -0.712 17569 6351 1 10 . 1 1 121 121 ASP H H 275 8.694 8.694 8.457 0.237 17569 6352 1 10 . 1 1 122 122 LEU N N 276 123.192 123.192 120.791 2.401 17569 6353 1 10 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.985 0.407 17569 6354 1 10 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.525 -0.554 17569 6355 1 10 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.162 0.380 17569 6356 1 10 . 1 1 122 122 LEU H H 276 8.013 8.013 7.916 0.097 17569 6357 1 10 . 1 1 123 123 VAL N N 277 126.898 126.898 118.829 8.069 17569 6358 1 10 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.737 0.118 17569 6359 1 10 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.928 -0.265 17569 6360 1 10 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.540 0.518 17569 6361 1 10 . 1 1 123 123 VAL H H 277 8.781 8.781 8.173 0.608 17569 6362 1 10 . 1 1 124 124 THR N N 278 117.500 117.500 116.834 0.666 17569 6363 1 10 . 1 1 124 124 THR HA H 278 4.030 4.030 3.926 0.104 17569 6364 1 10 . 1 1 124 124 THR CA C 278 66.589 66.589 67.456 -0.867 17569 6365 1 10 . 1 1 124 124 THR CB C 278 68.410 68.410 68.522 -0.111 17569 6366 1 10 . 1 1 124 124 THR H H 278 8.722 8.722 8.454 0.268 17569 6367 1 10 . 1 1 125 125 ALA N N 279 124.700 124.700 123.574 1.126 17569 6368 1 10 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.202 0.059 17569 6369 1 10 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.898 0.398 17569 6370 1 10 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.188 -0.239 17569 6371 1 10 . 1 1 125 125 ALA H H 279 8.239 8.239 8.270 -0.031 17569 6372 1 10 . 1 1 126 126 CYS N N 280 119.276 119.276 117.641 1.635 17569 6373 1 10 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.981 0.133 17569 6374 1 10 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.934 -1.831 17569 6375 1 10 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.935 -1.439 17569 6376 1 10 . 1 1 126 126 CYS H H 280 8.128 8.128 7.856 0.272 17569 6377 1 10 . 1 1 127 127 ASN N N 281 118.000 118.000 118.061 -0.061 17569 6378 1 10 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.461 0.099 17569 6379 1 10 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.732 -0.593 17569 6380 1 10 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.852 -0.887 17569 6381 1 10 . 1 1 127 127 ASN H H 281 8.725 8.725 8.105 0.620 17569 6382 1 10 . 1 1 128 128 SER N N 282 116.601 116.601 116.546 0.055 17569 6383 1 10 . 1 1 128 128 SER HA H 282 4.363 4.363 4.246 0.117 17569 6384 1 10 . 1 1 128 128 SER CA C 282 61.899 61.899 61.205 0.694 17569 6385 1 10 . 1 1 128 128 SER CB C 282 62.630 62.630 62.967 -0.337 17569 6386 1 10 . 1 1 128 128 SER H H 282 8.542 8.542 7.472 1.070 17569 6387 1 10 . 1 1 129 129 VAL N N 283 123.272 123.272 122.393 0.879 17569 6388 1 10 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.634 0.043 17569 6389 1 10 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.470 0.038 17569 6390 1 10 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.602 -0.384 17569 6391 1 10 . 1 1 129 129 VAL H H 283 7.990 7.990 7.561 0.429 17569 6392 1 10 . 1 1 130 130 PHE N N 284 118.594 118.594 119.119 -0.525 17569 6393 1 10 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.271 -0.258 17569 6394 1 10 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.077 2.423 17569 6395 1 10 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.562 0.434 17569 6396 1 10 . 1 1 130 130 PHE H H 284 8.190 8.190 8.494 -0.304 17569 6397 1 10 . 1 1 131 131 GLU N N 285 120.905 120.905 120.612 0.293 17569 6398 1 10 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.957 0.248 17569 6399 1 10 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.788 -0.574 17569 6400 1 10 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.521 -0.021 17569 6401 1 10 . 1 1 131 131 GLU H H 285 8.699 8.699 8.971 -0.272 17569 6402 1 10 . 1 1 132 132 ASN N N 286 117.997 117.997 118.472 -0.475 17569 6403 1 10 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.467 0.128 17569 6404 1 10 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.963 -0.348 17569 6405 1 10 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.965 -0.113 17569 6406 1 10 . 1 1 132 132 ASN H H 286 8.082 8.082 8.047 0.035 17569 6407 1 10 . 1 1 133 133 LEU N N 287 120.800 120.800 121.528 -0.728 17569 6408 1 10 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.024 0.093 17569 6409 1 10 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.251 -0.453 17569 6410 1 10 . 1 1 133 133 LEU H H 287 7.904 7.904 8.090 -0.186 17569 6411 1 10 . 1 1 134 134 GLU N N 288 118.200 118.200 118.772 -0.572 17569 6412 1 10 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.892 0.187 17569 6413 1 10 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.689 -0.692 17569 6414 1 10 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.351 -0.109 17569 6415 1 10 . 1 1 134 134 GLU H H 288 8.157 8.157 8.220 -0.063 17569 6416 1 10 . 1 1 135 135 GLN N N 289 117.400 117.400 118.938 -1.538 17569 6417 1 10 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.074 0.100 17569 6418 1 10 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.470 -0.481 17569 6419 1 10 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.802 -0.722 17569 6420 1 10 . 1 1 135 135 GLN H H 289 7.869 7.869 7.472 0.397 17569 6421 1 10 . 1 1 136 136 LEU N N 290 121.000 121.000 121.883 -0.883 17569 6422 1 10 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.863 0.310 17569 6423 1 10 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.602 -0.464 17569 6424 1 10 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.781 0.220 17569 6425 1 10 . 1 1 136 136 LEU H H 290 7.968 7.968 8.160 -0.192 17569 6426 1 10 . 1 1 137 137 LEU N N 291 118.900 118.900 117.728 1.172 17569 6427 1 10 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.044 0.197 17569 6428 1 10 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.374 -1.014 17569 6429 1 10 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.191 -0.719 17569 6430 1 10 . 1 1 137 137 LEU H H 291 8.154 8.154 7.917 0.237 17569 6431 1 10 . 1 1 138 138 GLN N N 292 117.993 117.993 116.738 1.255 17569 6432 1 10 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.405 -0.133 17569 6433 1 10 . 1 1 138 138 GLN CA C 292 56.632 56.632 55.613 1.019 17569 6434 1 10 . 1 1 138 138 GLN CB C 292 28.584 28.584 28.880 -0.295 17569 6435 1 10 . 1 1 138 138 GLN H H 292 7.896 7.896 7.561 0.335 17569 6436 1 10 . 1 1 139 139 GLN N N 293 118.889 118.889 118.689 0.200 17569 6437 1 10 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.393 -0.124 17569 6438 1 10 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.935 0.519 17569 6439 1 10 . 1 1 139 139 GLN CB C 293 29.069 29.069 28.485 0.584 17569 6440 1 10 . 1 1 139 139 GLN H H 293 8.091 8.091 7.689 0.402 17569 6441 1 10 . 1 1 140 140 ASN N N 294 118.604 118.604 117.012 1.592 17569 6442 1 10 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.681 0.078 17569 6443 1 10 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.824 -0.603 17569 6444 1 10 . 1 1 140 140 ASN CB C 294 38.733 38.733 38.994 -0.261 17569 6445 1 10 . 1 1 140 140 ASN H H 294 8.273 8.273 8.447 -0.174 17569 6446 1 10 . 1 1 141 141 LYS N N 295 121.685 121.685 120.159 1.526 17569 6447 1 10 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.341 0.019 17569 6448 1 10 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.372 -0.199 17569 6449 1 10 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.101 -0.566 17569 6450 1 10 . 1 1 141 141 LYS H H 295 8.089 8.089 8.265 -0.176 17569 6451 1 11 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.864 -0.477 17569 6452 1 11 . 1 1 2 2 ALA CA C 156 52.445 52.445 51.803 0.642 17569 6453 1 11 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.350 -1.094 17569 6454 1 11 . 1 1 3 3 MET HA H 157 4.476 4.476 4.089 0.387 17569 6455 1 11 . 1 1 3 3 MET CA C 157 55.401 55.401 55.899 -0.498 17569 6456 1 11 . 1 1 4 4 ALA N N 158 124.828 124.828 121.277 3.551 17569 6457 1 11 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.488 -0.174 17569 6458 1 11 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.472 1.038 17569 6459 1 11 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.735 -1.734 17569 6460 1 11 . 1 1 4 4 ALA H H 158 8.382 8.382 8.006 0.376 17569 6461 1 11 . 1 1 5 5 ASP N N 159 119.418 119.418 119.726 -0.308 17569 6462 1 11 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.935 -0.345 17569 6463 1 11 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.868 0.268 17569 6464 1 11 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.597 -1.583 17569 6465 1 11 . 1 1 5 5 ASP H H 159 8.312 8.312 8.331 -0.019 17569 6466 1 11 . 1 1 6 6 LYS N N 160 121.604 121.604 120.391 1.213 17569 6467 1 11 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.556 -0.213 17569 6468 1 11 . 1 1 6 6 LYS H H 160 8.274 8.274 8.392 -0.118 17569 6469 1 11 . 1 1 7 7 ARG N N 161 121.611 121.611 123.202 -1.591 17569 6470 1 11 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.422 -0.095 17569 6471 1 11 . 1 1 7 7 ARG H H 161 8.430 8.430 8.855 -0.425 17569 6472 1 11 . 1 1 8 8 GLY N N 162 109.606 109.606 111.316 -1.710 17569 6473 1 11 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.211 -0.164 17569 6474 1 11 . 1 1 8 8 GLY H H 162 8.473 8.473 8.824 -0.351 17569 6475 1 11 . 1 1 9 9 ASP N N 163 120.187 120.187 119.390 0.797 17569 6476 1 11 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.715 -0.066 17569 6477 1 11 . 1 1 9 9 ASP CA C 163 54.151 54.151 54.151 0.000 17569 6478 1 11 . 1 1 9 9 ASP H H 163 8.296 8.296 8.045 0.251 17569 6479 1 11 . 1 1 10 10 GLY N N 164 108.816 108.816 109.659 -0.843 17569 6480 1 11 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.331 0.036 17569 6481 1 11 . 1 1 10 10 GLY H H 164 8.458 8.458 8.524 -0.066 17569 6482 1 11 . 1 1 11 11 LEU N N 165 121.195 121.195 120.842 0.353 17569 6483 1 11 . 1 1 11 11 LEU HA H 165 4.316 4.316 3.998 0.318 17569 6484 1 11 . 1 1 11 11 LEU CA C 165 55.000 55.000 55.269 -0.269 17569 6485 1 11 . 1 1 11 11 LEU CB C 165 41.932 41.932 41.325 0.607 17569 6486 1 11 . 1 1 11 11 LEU H H 165 8.137 8.137 7.905 0.232 17569 6487 1 11 . 1 1 12 12 HIS N N 166 119.387 119.387 118.550 0.837 17569 6488 1 11 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.313 0.342 17569 6489 1 11 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.834 0.435 17569 6490 1 11 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.817 0.880 17569 6491 1 11 . 1 1 12 12 HIS H H 166 8.270 8.270 8.232 0.038 17569 6492 1 11 . 1 1 13 13 GLY N N 167 109.899 109.899 110.646 -0.747 17569 6493 1 11 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.981 0.124 17569 6494 1 11 . 1 1 13 13 GLY H H 167 8.276 8.276 8.182 0.094 17569 6495 1 11 . 1 1 14 14 ILE N N 168 119.597 119.597 124.819 -5.222 17569 6496 1 11 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.190 0.133 17569 6497 1 11 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.144 0.456 17569 6498 1 11 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.671 -2.721 17569 6499 1 11 . 1 1 14 14 ILE H H 168 7.962 7.962 7.936 0.026 17569 6500 1 11 . 1 1 15 15 VAL N N 169 127.578 127.578 124.687 2.891 17569 6501 1 11 . 1 1 15 15 VAL HA H 169 4.280 4.280 3.850 0.430 17569 6502 1 11 . 1 1 15 15 VAL CA C 169 61.317 61.317 63.150 -1.833 17569 6503 1 11 . 1 1 15 15 VAL CB C 169 33.402 33.402 32.536 0.866 17569 6504 1 11 . 1 1 15 15 VAL H H 169 9.011 9.011 8.095 0.916 17569 6505 1 11 . 1 1 16 16 SER N N 170 118.596 118.596 119.231 -0.635 17569 6506 1 11 . 1 1 16 16 SER HA H 170 5.140 5.140 4.648 0.492 17569 6507 1 11 . 1 1 16 16 SER CA C 170 55.985 55.985 56.950 -0.965 17569 6508 1 11 . 1 1 16 16 SER CB C 170 65.261 65.261 64.425 0.836 17569 6509 1 11 . 1 1 16 16 SER H H 170 8.242 8.242 8.052 0.190 17569 6510 1 11 . 1 1 17 17 CYS N N 171 123.783 123.783 124.884 -1.101 17569 6511 1 11 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.165 0.016 17569 6512 1 11 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.706 -0.862 17569 6513 1 11 . 1 1 17 17 CYS CB C 171 31.373 31.373 29.196 2.177 17569 6514 1 11 . 1 1 17 17 CYS H H 171 8.894 8.894 8.558 0.336 17569 6515 1 11 . 1 1 18 18 THR N N 172 121.703 121.703 117.511 4.192 17569 6516 1 11 . 1 1 18 18 THR HA H 172 4.386 4.386 4.111 0.275 17569 6517 1 11 . 1 1 18 18 THR CA C 172 64.667 64.667 64.055 0.612 17569 6518 1 11 . 1 1 18 18 THR CB C 172 69.498 69.498 68.988 0.510 17569 6519 1 11 . 1 1 18 18 THR H H 172 8.788 8.788 8.247 0.541 17569 6520 1 11 . 1 1 19 19 ALA N N 173 131.364 131.364 121.049 10.315 17569 6521 1 11 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.143 0.353 17569 6522 1 11 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.308 0.717 17569 6523 1 11 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.795 3.387 17569 6524 1 11 . 1 1 19 19 ALA H H 173 9.680 9.680 7.834 1.846 17569 6525 1 11 . 1 1 20 20 CYS N N 174 115.498 115.498 115.649 -0.151 17569 6526 1 11 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.559 0.409 17569 6527 1 11 . 1 1 20 20 CYS CA C 174 58.094 58.094 58.767 -0.672 17569 6528 1 11 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.174 4.070 17569 6529 1 11 . 1 1 20 20 CYS H H 174 8.470 8.470 7.531 0.939 17569 6530 1 11 . 1 1 21 21 GLY N N 175 112.464 112.464 109.102 3.362 17569 6531 1 11 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.085 0.621 17569 6532 1 11 . 1 1 21 21 GLY H H 175 7.884 7.884 8.025 -0.141 17569 6533 1 11 . 1 1 22 22 GLN N N 176 121.784 121.784 118.456 3.328 17569 6534 1 11 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.511 -0.135 17569 6535 1 11 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.371 1.920 17569 6536 1 11 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.258 -2.917 17569 6537 1 11 . 1 1 22 22 GLN H H 176 8.723 8.723 7.872 0.851 17569 6538 1 11 . 1 1 23 23 GLN N N 177 122.900 122.900 122.659 0.241 17569 6539 1 11 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.224 0.306 17569 6540 1 11 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.222 0.328 17569 6541 1 11 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.056 -0.596 17569 6542 1 11 . 1 1 23 23 GLN H H 177 8.721 8.721 8.527 0.194 17569 6543 1 11 . 1 1 24 24 VAL N N 178 121.000 121.000 123.289 -2.289 17569 6544 1 11 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.863 0.661 17569 6545 1 11 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.466 -2.589 17569 6546 1 11 . 1 1 24 24 VAL H H 178 8.689 8.689 8.403 0.286 17569 6547 1 11 . 1 1 25 25 ASN N N 179 121.392 121.392 122.648 -1.256 17569 6548 1 11 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.314 0.562 17569 6549 1 11 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.048 -1.899 17569 6550 1 11 . 1 1 25 25 ASN CB C 179 37.977 37.977 37.671 0.306 17569 6551 1 11 . 1 1 25 25 ASN H H 179 8.635 8.635 8.051 0.584 17569 6552 1 11 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.374 0.086 17569 6553 1 11 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.667 -1.669 17569 6554 1 11 . 1 1 27 27 PHE CB C 181 38.393 38.393 38.012 0.381 17569 6555 1 11 . 1 1 28 28 GLN N N 182 119.300 119.300 126.405 -7.105 17569 6556 1 11 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.629 -0.111 17569 6557 1 11 . 1 1 28 28 GLN CA C 182 54.342 54.342 55.055 -0.713 17569 6558 1 11 . 1 1 28 28 GLN CB C 182 30.350 30.350 31.355 -1.005 17569 6559 1 11 . 1 1 28 28 GLN H H 182 7.494 7.494 8.153 -0.659 17569 6560 1 11 . 1 1 29 29 LYS N N 183 124.516 124.516 126.950 -2.434 17569 6561 1 11 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.534 -0.612 17569 6562 1 11 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.505 1.807 17569 6563 1 11 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.332 -0.046 17569 6564 1 11 . 1 1 29 29 LYS H H 183 8.779 8.779 8.844 -0.065 17569 6565 1 11 . 1 1 30 30 ASP N N 184 116.500 116.500 118.739 -2.239 17569 6566 1 11 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.893 -0.434 17569 6567 1 11 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.651 -0.115 17569 6568 1 11 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.218 -1.247 17569 6569 1 11 . 1 1 30 30 ASP H H 184 8.556 8.556 8.271 0.285 17569 6570 1 11 . 1 1 31 31 SER N N 185 111.505 111.505 114.823 -3.318 17569 6571 1 11 . 1 1 31 31 SER HA H 185 4.695 4.695 4.696 -0.001 17569 6572 1 11 . 1 1 31 31 SER CA C 185 59.747 59.747 58.527 1.220 17569 6573 1 11 . 1 1 31 31 SER CB C 185 65.198 65.198 63.923 1.275 17569 6574 1 11 . 1 1 31 31 SER H H 185 7.933 7.933 8.502 -0.569 17569 6575 1 11 . 1 1 32 32 ILE N N 186 113.394 113.394 116.476 -3.082 17569 6576 1 11 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.944 -0.058 17569 6577 1 11 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.226 -0.647 17569 6578 1 11 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.820 0.992 17569 6579 1 11 . 1 1 32 32 ILE H H 186 7.105 7.105 7.568 -0.463 17569 6580 1 11 . 1 1 33 33 TYR N N 187 119.098 119.098 119.822 -0.724 17569 6581 1 11 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.143 -0.620 17569 6582 1 11 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.186 1.074 17569 6583 1 11 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.079 2.361 17569 6584 1 11 . 1 1 33 33 TYR H H 187 8.954 8.954 7.857 1.097 17569 6585 1 11 . 1 1 34 34 ARG N N 188 118.502 118.502 122.211 -3.709 17569 6586 1 11 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.738 -0.101 17569 6587 1 11 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.314 -1.562 17569 6588 1 11 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.067 1.184 17569 6589 1 11 . 1 1 34 34 ARG H H 188 8.412 8.412 8.607 -0.195 17569 6590 1 11 . 1 1 35 35 HIS N N 189 126.596 126.596 127.188 -0.592 17569 6591 1 11 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.934 -0.342 17569 6592 1 11 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.129 -0.408 17569 6593 1 11 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.148 1.323 17569 6594 1 11 . 1 1 35 35 HIS H H 189 9.813 9.813 9.136 0.677 17569 6595 1 11 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.560 -0.262 17569 6596 1 11 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.840 0.436 17569 6597 1 11 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.223 0.628 17569 6598 1 11 . 1 1 37 37 SER N N 191 110.003 110.003 113.570 -3.567 17569 6599 1 11 . 1 1 37 37 SER HA H 191 4.918 4.918 4.324 0.594 17569 6600 1 11 . 1 1 37 37 SER CA C 191 59.031 59.031 61.371 -2.340 17569 6601 1 11 . 1 1 37 37 SER CB C 191 65.104 65.104 63.362 1.742 17569 6602 1 11 . 1 1 37 37 SER H H 191 8.934 8.934 8.627 0.307 17569 6603 1 11 . 1 1 38 38 LEU N N 192 120.959 120.959 113.702 7.257 17569 6604 1 11 . 1 1 38 38 LEU HA H 192 4.129 4.129 5.030 -0.901 17569 6605 1 11 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.136 2.010 17569 6606 1 11 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.424 1.572 17569 6607 1 11 . 1 1 38 38 LEU H H 192 8.649 8.649 7.006 1.643 17569 6608 1 11 . 1 1 39 39 GLN N N 193 108.600 108.600 119.399 -10.799 17569 6609 1 11 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.104 -0.199 17569 6610 1 11 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.611 0.203 17569 6611 1 11 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.199 -2.165 17569 6612 1 11 . 1 1 39 39 GLN H H 193 8.465 8.465 7.840 0.625 17569 6613 1 11 . 1 1 40 40 VAL N N 194 105.325 105.325 118.826 -13.501 17569 6614 1 11 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.503 0.047 17569 6615 1 11 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.924 -1.283 17569 6616 1 11 . 1 1 40 40 VAL H H 194 6.256 6.256 7.894 -1.638 17569 6617 1 11 . 1 1 41 41 LEU N N 195 123.100 123.100 122.260 0.840 17569 6618 1 11 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.782 0.034 17569 6619 1 11 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.434 3.748 17569 6620 1 11 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.078 0.492 17569 6621 1 11 . 1 1 41 41 LEU H H 195 9.154 9.154 8.532 0.622 17569 6622 1 11 . 1 1 42 42 ILE N N 196 124.396 124.396 117.000 7.396 17569 6623 1 11 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.845 1.507 17569 6624 1 11 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.318 0.912 17569 6625 1 11 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.817 1.453 17569 6626 1 11 . 1 1 42 42 ILE H H 196 9.766 9.766 7.815 1.951 17569 6627 1 11 . 1 1 43 43 CYS N N 197 121.500 121.500 114.793 6.707 17569 6628 1 11 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.232 0.030 17569 6629 1 11 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.017 0.686 17569 6630 1 11 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.456 1.844 17569 6631 1 11 . 1 1 43 43 CYS H H 197 9.882 9.882 8.262 1.620 17569 6632 1 11 . 1 1 44 44 LYS N N 198 117.995 117.995 121.866 -3.871 17569 6633 1 11 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.164 -0.175 17569 6634 1 11 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.141 -0.481 17569 6635 1 11 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.314 0.386 17569 6636 1 11 . 1 1 44 44 LYS H H 198 8.089 8.089 8.501 -0.412 17569 6637 1 11 . 1 1 45 45 ASN N N 199 119.200 119.200 117.505 1.695 17569 6638 1 11 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.607 -0.093 17569 6639 1 11 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.176 0.544 17569 6640 1 11 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.139 0.028 17569 6641 1 11 . 1 1 45 45 ASN H H 199 8.356 8.356 8.646 -0.290 17569 6642 1 11 . 1 1 46 46 CYS N N 200 126.600 126.600 119.343 7.257 17569 6643 1 11 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.990 0.191 17569 6644 1 11 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.213 2.282 17569 6645 1 11 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.071 2.111 17569 6646 1 11 . 1 1 46 46 CYS H H 200 9.189 9.189 7.632 1.557 17569 6647 1 11 . 1 1 47 47 PHE N N 201 121.962 121.962 120.353 1.609 17569 6648 1 11 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.120 -0.250 17569 6649 1 11 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.867 1.403 17569 6650 1 11 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.541 0.626 17569 6651 1 11 . 1 1 47 47 PHE H H 201 8.826 8.826 8.296 0.530 17569 6652 1 11 . 1 1 48 48 LYS N N 202 117.400 117.400 120.621 -3.221 17569 6653 1 11 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.943 -0.245 17569 6654 1 11 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.259 -0.307 17569 6655 1 11 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.056 -0.514 17569 6656 1 11 . 1 1 48 48 LYS H H 202 8.512 8.512 8.053 0.459 17569 6657 1 11 . 1 1 49 49 TYR N N 203 120.400 120.400 120.418 -0.018 17569 6658 1 11 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.226 0.188 17569 6659 1 11 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.558 -0.786 17569 6660 1 11 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.737 -0.291 17569 6661 1 11 . 1 1 49 49 TYR H H 203 8.133 8.133 7.799 0.334 17569 6662 1 11 . 1 1 50 50 TYR N N 204 121.783 121.783 117.772 4.011 17569 6663 1 11 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.670 -1.175 17569 6664 1 11 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.973 2.977 17569 6665 1 11 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.588 0.904 17569 6666 1 11 . 1 1 50 50 TYR H H 204 8.765 8.765 7.508 1.257 17569 6667 1 11 . 1 1 51 51 MET N N 205 110.800 110.800 115.153 -4.353 17569 6668 1 11 . 1 1 51 51 MET HA H 205 4.349 4.349 4.188 0.161 17569 6669 1 11 . 1 1 51 51 MET CA C 205 53.505 53.505 57.930 -4.425 17569 6670 1 11 . 1 1 51 51 MET CB C 205 30.384 30.384 33.407 -3.023 17569 6671 1 11 . 1 1 51 51 MET H H 205 7.771 7.771 8.402 -0.631 17569 6672 1 11 . 1 1 52 52 SER N N 206 116.800 116.800 112.187 4.613 17569 6673 1 11 . 1 1 52 52 SER HA H 206 3.919 3.919 4.407 -0.488 17569 6674 1 11 . 1 1 52 52 SER CA C 206 61.621 61.621 60.046 1.575 17569 6675 1 11 . 1 1 52 52 SER CB C 206 62.611 62.611 64.482 -1.871 17569 6676 1 11 . 1 1 52 52 SER H H 206 7.581 7.581 8.252 -0.671 17569 6677 1 11 . 1 1 53 53 ASP N N 207 117.400 117.400 121.588 -4.188 17569 6678 1 11 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.775 -0.203 17569 6679 1 11 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.345 -0.246 17569 6680 1 11 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.610 0.578 17569 6681 1 11 . 1 1 53 53 ASP H H 207 7.085 7.085 8.142 -1.057 17569 6682 1 11 . 1 1 54 54 ASP N N 208 119.405 119.405 122.366 -2.961 17569 6683 1 11 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.958 -0.569 17569 6684 1 11 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.407 0.493 17569 6685 1 11 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.810 -1.461 17569 6686 1 11 . 1 1 54 54 ASP H H 208 8.439 8.439 8.446 -0.007 17569 6687 1 11 . 1 1 55 55 ILE N N 209 124.698 124.698 120.326 4.372 17569 6688 1 11 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.291 -0.291 17569 6689 1 11 . 1 1 55 55 ILE CA C 209 62.278 62.278 59.945 2.333 17569 6690 1 11 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.683 0.608 17569 6691 1 11 . 1 1 55 55 ILE H H 209 8.128 8.128 8.380 -0.252 17569 6692 1 11 . 1 1 56 56 SER N N 210 126.703 126.703 119.209 7.494 17569 6693 1 11 . 1 1 56 56 SER HA H 210 4.365 4.365 4.684 -0.319 17569 6694 1 11 . 1 1 56 56 SER CA C 210 57.769 57.769 57.533 0.236 17569 6695 1 11 . 1 1 56 56 SER CB C 210 64.991 64.991 64.955 0.036 17569 6696 1 11 . 1 1 56 56 SER H H 210 8.815 8.815 8.529 0.286 17569 6697 1 11 . 1 1 57 57 ARG N N 211 116.885 116.885 120.098 -3.213 17569 6698 1 11 . 1 1 57 57 ARG HA H 211 5.042 5.042 5.056 -0.014 17569 6699 1 11 . 1 1 57 57 ARG CA C 211 54.400 54.400 54.666 -0.266 17569 6700 1 11 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.248 3.036 17569 6701 1 11 . 1 1 57 57 ARG H H 211 8.365 8.365 8.442 -0.077 17569 6702 1 11 . 1 1 58 58 ASP N N 212 121.982 121.982 124.883 -2.901 17569 6703 1 11 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.504 0.111 17569 6704 1 11 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.465 -2.243 17569 6705 1 11 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.401 -0.899 17569 6706 1 11 . 1 1 58 58 ASP H H 212 8.706 8.706 8.257 0.449 17569 6707 1 11 . 1 1 59 59 SER N N 213 114.164 114.164 115.413 -1.249 17569 6708 1 11 . 1 1 59 59 SER HA H 213 4.212 4.212 4.208 0.004 17569 6709 1 11 . 1 1 59 59 SER CA C 213 60.840 60.840 60.674 0.166 17569 6710 1 11 . 1 1 59 59 SER CB C 213 62.714 62.714 63.422 -0.708 17569 6711 1 11 . 1 1 59 59 SER H H 213 8.687 8.687 8.753 -0.066 17569 6712 1 11 . 1 1 60 60 ASP N N 214 120.899 120.899 119.237 1.662 17569 6713 1 11 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.690 0.135 17569 6714 1 11 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.671 0.540 17569 6715 1 11 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.238 1.320 17569 6716 1 11 . 1 1 60 60 ASP H H 214 8.193 8.193 7.784 0.409 17569 6717 1 11 . 1 1 61 61 GLY N N 215 108.300 108.300 108.189 0.111 17569 6718 1 11 . 1 1 61 61 GLY CA C 215 45.397 45.397 46.012 -0.615 17569 6719 1 11 . 1 1 61 61 GLY H H 215 8.234 8.234 8.218 0.016 17569 6720 1 11 . 1 1 62 62 MET N N 216 120.002 120.002 117.453 2.549 17569 6721 1 11 . 1 1 62 62 MET HA H 216 4.972 4.972 4.493 0.479 17569 6722 1 11 . 1 1 62 62 MET CA C 216 53.151 53.151 54.696 -1.545 17569 6723 1 11 . 1 1 62 62 MET CB C 216 32.311 32.311 35.313 -3.002 17569 6724 1 11 . 1 1 62 62 MET H H 216 8.376 8.376 7.289 1.087 17569 6725 1 11 . 1 1 63 63 ASP N N 217 127.300 127.300 119.633 7.667 17569 6726 1 11 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.867 0.099 17569 6727 1 11 . 1 1 63 63 ASP CA C 217 55.569 55.569 54.288 1.281 17569 6728 1 11 . 1 1 63 63 ASP H H 217 9.368 9.368 8.684 0.684 17569 6729 1 11 . 1 1 64 64 GLU N N 218 114.400 114.400 125.324 -10.924 17569 6730 1 11 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.553 -0.397 17569 6731 1 11 . 1 1 64 64 GLU CA C 218 55.850 55.850 56.004 -0.154 17569 6732 1 11 . 1 1 64 64 GLU H H 218 8.583 8.583 8.555 0.028 17569 6733 1 11 . 1 1 65 65 GLN N N 219 115.500 115.500 117.199 -1.699 17569 6734 1 11 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.510 -0.199 17569 6735 1 11 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.255 0.091 17569 6736 1 11 . 1 1 65 65 GLN H H 219 7.158 7.158 7.691 -0.533 17569 6737 1 11 . 1 1 66 66 CYS N N 220 122.600 122.600 117.879 4.721 17569 6738 1 11 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.354 -1.277 17569 6739 1 11 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.398 1.131 17569 6740 1 11 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.376 1.596 17569 6741 1 11 . 1 1 66 66 CYS H H 220 8.248 8.248 8.431 -0.183 17569 6742 1 11 . 1 1 67 67 ARG N N 221 130.363 130.363 123.781 6.582 17569 6743 1 11 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.520 -0.453 17569 6744 1 11 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.055 -3.039 17569 6745 1 11 . 1 1 67 67 ARG H H 221 9.145 9.145 8.876 0.269 17569 6746 1 11 . 1 1 68 68 TRP N N 222 124.200 124.200 120.717 3.483 17569 6747 1 11 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.696 -0.260 17569 6748 1 11 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.422 0.658 17569 6749 1 11 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.359 0.835 17569 6750 1 11 . 1 1 68 68 TRP H H 222 9.689 9.689 8.291 1.398 17569 6751 1 11 . 1 1 69 69 CYS N N 223 116.297 116.297 111.048 5.249 17569 6752 1 11 . 1 1 69 69 CYS HA H 223 5.091 5.091 4.965 0.126 17569 6753 1 11 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.338 2.764 17569 6754 1 11 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.547 4.792 17569 6755 1 11 . 1 1 69 69 CYS H H 223 8.822 8.822 7.689 1.133 17569 6756 1 11 . 1 1 70 70 ALA N N 224 123.112 123.112 123.565 -0.453 17569 6757 1 11 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.382 0.024 17569 6758 1 11 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.404 -0.553 17569 6759 1 11 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.819 -0.099 17569 6760 1 11 . 1 1 70 70 ALA H H 224 8.787 8.787 8.324 0.463 17569 6761 1 11 . 1 1 71 71 GLU N N 225 118.300 118.300 120.427 -2.127 17569 6762 1 11 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.461 0.847 17569 6763 1 11 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.767 -2.468 17569 6764 1 11 . 1 1 71 71 GLU H H 225 8.541 8.541 8.205 0.336 17569 6765 1 11 . 1 1 72 72 GLY N N 226 111.995 111.995 110.181 1.814 17569 6766 1 11 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.757 -0.354 17569 6767 1 11 . 1 1 72 72 GLY H H 226 9.837 9.837 8.480 1.357 17569 6768 1 11 . 1 1 73 73 GLY N N 227 106.600 106.600 107.474 -0.874 17569 6769 1 11 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.066 0.905 17569 6770 1 11 . 1 1 73 73 GLY H H 227 7.772 7.772 8.230 -0.458 17569 6771 1 11 . 1 1 74 74 ASN N N 228 124.277 124.277 119.188 5.089 17569 6772 1 11 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.463 0.618 17569 6773 1 11 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.847 -0.747 17569 6774 1 11 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.316 -0.232 17569 6775 1 11 . 1 1 74 74 ASN H H 228 8.876 8.876 8.541 0.335 17569 6776 1 11 . 1 1 75 75 LEU N N 229 123.050 123.050 121.958 1.092 17569 6777 1 11 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.824 -0.224 17569 6778 1 11 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.456 0.906 17569 6779 1 11 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.313 0.187 17569 6780 1 11 . 1 1 75 75 LEU H H 229 8.901 8.901 8.007 0.894 17569 6781 1 11 . 1 1 76 76 ILE N N 230 123.552 123.552 123.520 0.032 17569 6782 1 11 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.053 0.432 17569 6783 1 11 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.102 -0.402 17569 6784 1 11 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.173 -0.774 17569 6785 1 11 . 1 1 76 76 ILE H H 230 9.406 9.406 9.221 0.185 17569 6786 1 11 . 1 1 77 77 CYS N N 231 124.637 124.637 127.555 -2.918 17569 6787 1 11 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.163 -0.288 17569 6788 1 11 . 1 1 77 77 CYS CA C 231 58.359 58.359 59.164 -0.805 17569 6789 1 11 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.140 0.294 17569 6790 1 11 . 1 1 77 77 CYS H H 231 8.809 8.809 8.596 0.213 17569 6791 1 11 . 1 1 78 78 CYS N N 232 125.697 125.697 125.078 0.619 17569 6792 1 11 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.927 -0.643 17569 6793 1 11 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.495 4.389 17569 6794 1 11 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.519 1.651 17569 6795 1 11 . 1 1 78 78 CYS H H 232 8.579 8.579 8.508 0.071 17569 6796 1 11 . 1 1 79 79 ASP N N 233 123.600 123.600 125.217 -1.617 17569 6797 1 11 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.656 0.101 17569 6798 1 11 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.377 2.612 17569 6799 1 11 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.172 1.456 17569 6800 1 11 . 1 1 79 79 ASP H H 233 8.577 8.577 8.327 0.250 17569 6801 1 11 . 1 1 80 80 PHE N N 234 122.100 122.100 117.029 5.071 17569 6802 1 11 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.544 -0.018 17569 6803 1 11 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.255 1.654 17569 6804 1 11 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.080 1.769 17569 6805 1 11 . 1 1 80 80 PHE H H 234 10.432 10.432 7.372 3.060 17569 6806 1 11 . 1 1 81 81 CYS N N 235 124.300 124.300 117.544 6.756 17569 6807 1 11 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.697 0.459 17569 6808 1 11 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.941 0.104 17569 6809 1 11 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.679 3.728 17569 6810 1 11 . 1 1 81 81 CYS H H 235 8.476 8.476 7.921 0.555 17569 6811 1 11 . 1 1 82 82 HIS N N 236 112.598 112.598 118.492 -5.894 17569 6812 1 11 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.176 0.807 17569 6813 1 11 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.750 -1.352 17569 6814 1 11 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.909 2.348 17569 6815 1 11 . 1 1 82 82 HIS H H 236 6.699 6.699 7.839 -1.140 17569 6816 1 11 . 1 1 83 83 ASN N N 237 123.600 123.600 118.684 4.916 17569 6817 1 11 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.834 -0.033 17569 6818 1 11 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.755 2.861 17569 6819 1 11 . 1 1 83 83 ASN H H 237 9.097 9.097 7.902 1.195 17569 6820 1 11 . 1 1 84 84 ALA N N 238 122.000 122.000 124.738 -2.738 17569 6821 1 11 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.205 0.204 17569 6822 1 11 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.080 0.284 17569 6823 1 11 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.019 3.051 17569 6824 1 11 . 1 1 84 84 ALA H H 238 9.885 9.885 8.461 1.424 17569 6825 1 11 . 1 1 85 85 PHE N N 239 116.707 116.707 121.600 -4.893 17569 6826 1 11 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.154 0.874 17569 6827 1 11 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.146 0.071 17569 6828 1 11 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.533 2.131 17569 6829 1 11 . 1 1 85 85 PHE H H 239 9.450 9.450 9.157 0.293 17569 6830 1 11 . 1 1 86 86 CYS N N 240 126.682 126.682 124.787 1.895 17569 6831 1 11 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.728 0.894 17569 6832 1 11 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.800 -0.458 17569 6833 1 11 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.296 2.961 17569 6834 1 11 . 1 1 86 86 CYS H H 240 11.309 11.309 9.530 1.779 17569 6835 1 11 . 1 1 87 87 LYS N N 241 117.865 117.865 124.177 -6.312 17569 6836 1 11 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.927 -0.078 17569 6837 1 11 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.168 -0.098 17569 6838 1 11 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.446 0.352 17569 6839 1 11 . 1 1 87 87 LYS H H 241 8.230 8.230 8.858 -0.628 17569 6840 1 11 . 1 1 88 88 LYS N N 242 117.949 117.949 118.473 -0.524 17569 6841 1 11 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.089 -0.111 17569 6842 1 11 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.011 1.359 17569 6843 1 11 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.056 0.260 17569 6844 1 11 . 1 1 88 88 LYS H H 242 7.945 7.945 8.549 -0.604 17569 6845 1 11 . 1 1 89 89 CYS N N 243 125.305 125.305 116.996 8.309 17569 6846 1 11 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.243 -0.501 17569 6847 1 11 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.330 2.497 17569 6848 1 11 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.078 1.163 17569 6849 1 11 . 1 1 89 89 CYS H H 243 9.297 9.297 7.624 1.673 17569 6850 1 11 . 1 1 90 90 ILE N N 244 119.687 119.687 121.785 -2.098 17569 6851 1 11 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.106 -0.499 17569 6852 1 11 . 1 1 90 90 ILE CA C 244 65.950 65.950 63.814 2.136 17569 6853 1 11 . 1 1 90 90 ILE H H 244 7.997 7.997 7.645 0.352 17569 6854 1 11 . 1 1 91 91 LEU N N 245 120.280 120.280 121.395 -1.115 17569 6855 1 11 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.413 -0.728 17569 6856 1 11 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.718 0.517 17569 6857 1 11 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.757 0.201 17569 6858 1 11 . 1 1 91 91 LEU H H 245 8.810 8.810 8.868 -0.058 17569 6859 1 11 . 1 1 92 92 ARG N N 246 116.901 116.901 117.685 -0.784 17569 6860 1 11 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.127 -0.309 17569 6861 1 11 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.952 1.028 17569 6862 1 11 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.043 0.557 17569 6863 1 11 . 1 1 92 92 ARG H H 246 8.086 8.086 7.607 0.479 17569 6864 1 11 . 1 1 93 93 ASN N N 247 111.200 111.200 115.595 -4.395 17569 6865 1 11 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.478 0.125 17569 6866 1 11 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.743 1.065 17569 6867 1 11 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.968 3.516 17569 6868 1 11 . 1 1 93 93 ASN H H 247 7.136 7.136 8.154 -1.018 17569 6869 1 11 . 1 1 94 94 LEU N N 248 118.807 118.807 117.461 1.346 17569 6870 1 11 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.426 0.388 17569 6871 1 11 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.220 -0.031 17569 6872 1 11 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.653 0.045 17569 6873 1 11 . 1 1 94 94 LEU H H 248 8.515 8.515 7.968 0.547 17569 6874 1 11 . 1 1 95 95 GLY N N 249 108.000 108.000 105.937 2.063 17569 6875 1 11 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.741 -0.113 17569 6876 1 11 . 1 1 95 95 GLY H H 249 7.955 7.955 7.816 0.139 17569 6877 1 11 . 1 1 96 96 ARG N N 250 117.797 117.797 121.866 -4.069 17569 6878 1 11 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.277 -0.434 17569 6879 1 11 . 1 1 96 96 ARG CA C 250 58.682 58.682 57.919 0.763 17569 6880 1 11 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.241 -0.381 17569 6881 1 11 . 1 1 96 96 ARG H H 250 8.559 8.559 8.613 -0.054 17569 6882 1 11 . 1 1 97 97 LYS N N 251 120.900 120.900 119.457 1.443 17569 6883 1 11 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.032 0.124 17569 6884 1 11 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.555 -0.399 17569 6885 1 11 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.527 -0.167 17569 6886 1 11 . 1 1 97 97 LYS H H 251 8.655 8.655 8.505 0.150 17569 6887 1 11 . 1 1 98 98 GLU N N 252 122.000 122.000 118.696 3.304 17569 6888 1 11 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.135 0.216 17569 6889 1 11 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.382 -0.800 17569 6890 1 11 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.325 -0.925 17569 6891 1 11 . 1 1 98 98 GLU H H 252 7.705 7.705 8.304 -0.599 17569 6892 1 11 . 1 1 99 99 LEU N N 253 117.400 117.400 121.051 -3.651 17569 6893 1 11 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.816 0.101 17569 6894 1 11 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.125 -0.127 17569 6895 1 11 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.799 -0.317 17569 6896 1 11 . 1 1 99 99 LEU H H 253 7.285 7.285 7.610 -0.325 17569 6897 1 11 . 1 1 100 100 SER N N 254 112.100 112.100 113.612 -1.512 17569 6898 1 11 . 1 1 100 100 SER HA H 254 4.107 4.107 4.194 -0.087 17569 6899 1 11 . 1 1 100 100 SER CA C 254 61.603 61.603 61.976 -0.373 17569 6900 1 11 . 1 1 100 100 SER CB C 254 62.622 62.622 63.178 -0.556 17569 6901 1 11 . 1 1 100 100 SER H H 254 8.326 8.326 8.162 0.164 17569 6902 1 11 . 1 1 101 101 THR N N 255 118.151 118.151 118.213 -0.062 17569 6903 1 11 . 1 1 101 101 THR HA H 255 4.026 4.026 4.105 -0.079 17569 6904 1 11 . 1 1 101 101 THR CA C 255 66.261 66.261 66.359 -0.098 17569 6905 1 11 . 1 1 101 101 THR CB C 255 68.735 68.735 68.799 -0.064 17569 6906 1 11 . 1 1 101 101 THR H H 255 7.972 7.972 8.035 -0.063 17569 6907 1 11 . 1 1 102 102 ILE N N 256 120.100 120.100 122.627 -2.527 17569 6908 1 11 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.655 -0.192 17569 6909 1 11 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.956 -0.182 17569 6910 1 11 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.370 0.372 17569 6911 1 11 . 1 1 102 102 ILE H H 256 7.868 7.868 8.601 -0.733 17569 6912 1 11 . 1 1 103 103 MET N N 257 114.876 114.876 115.614 -0.738 17569 6913 1 11 . 1 1 103 103 MET HA H 257 4.211 4.211 4.087 0.124 17569 6914 1 11 . 1 1 103 103 MET CA C 257 55.691 55.691 58.031 -2.340 17569 6915 1 11 . 1 1 103 103 MET CB C 257 32.000 32.000 32.323 -0.323 17569 6916 1 11 . 1 1 103 103 MET H H 257 7.606 7.606 7.239 0.367 17569 6917 1 11 . 1 1 104 104 ASP N N 258 119.976 119.976 118.431 1.545 17569 6918 1 11 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.756 -0.218 17569 6919 1 11 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.774 1.138 17569 6920 1 11 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.447 1.053 17569 6921 1 11 . 1 1 104 104 ASP H H 258 7.444 7.444 7.645 -0.201 17569 6922 1 11 . 1 1 105 105 GLU N N 259 124.388 124.388 122.871 1.517 17569 6923 1 11 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.526 -0.239 17569 6924 1 11 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.258 2.313 17569 6925 1 11 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.688 -0.146 17569 6926 1 11 . 1 1 105 105 GLU H H 259 8.559 8.559 8.254 0.305 17569 6927 1 11 . 1 1 106 106 ASN N N 260 117.201 117.201 118.235 -1.034 17569 6928 1 11 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.465 0.277 17569 6929 1 11 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.243 -0.500 17569 6930 1 11 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.575 1.343 17569 6931 1 11 . 1 1 106 106 ASN H H 260 8.673 8.673 8.781 -0.108 17569 6932 1 11 . 1 1 107 107 ASN N N 261 117.900 117.900 112.089 5.811 17569 6933 1 11 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.324 0.661 17569 6934 1 11 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.532 -2.230 17569 6935 1 11 . 1 1 107 107 ASN CB C 261 40.614 40.614 36.851 3.763 17569 6936 1 11 . 1 1 107 107 ASN H H 261 7.956 7.956 8.741 -0.785 17569 6937 1 11 . 1 1 108 108 GLN N N 262 121.500 121.500 115.579 5.921 17569 6938 1 11 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.108 0.500 17569 6939 1 11 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.850 0.926 17569 6940 1 11 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.854 0.704 17569 6941 1 11 . 1 1 108 108 GLN H H 262 8.493 8.493 7.771 0.722 17569 6942 1 11 . 1 1 109 109 TRP N N 263 128.056 128.056 124.139 3.917 17569 6943 1 11 . 1 1 109 109 TRP HA H 263 4.971 4.971 5.122 -0.151 17569 6944 1 11 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.316 0.781 17569 6945 1 11 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.562 0.931 17569 6946 1 11 . 1 1 109 109 TRP H H 263 10.497 10.497 8.062 2.434 17569 6947 1 11 . 1 1 110 110 TYR N N 264 126.600 126.600 126.137 0.463 17569 6948 1 11 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.238 0.164 17569 6949 1 11 . 1 1 110 110 TYR CA C 264 56.671 56.671 60.020 -3.349 17569 6950 1 11 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.745 -0.737 17569 6951 1 11 . 1 1 110 110 TYR H H 264 7.545 7.545 8.059 -0.514 17569 6952 1 11 . 1 1 111 111 CYS N N 265 124.622 124.622 114.319 10.303 17569 6953 1 11 . 1 1 111 111 CYS H H 265 8.586 8.586 8.401 0.185 17569 6954 1 11 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.823 -0.631 17569 6955 1 11 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.815 0.901 17569 6956 1 11 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.659 1.261 17569 6957 1 11 . 1 1 113 113 ILE N N 267 119.504 119.504 119.789 -0.285 17569 6958 1 11 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.728 -0.778 17569 6959 1 11 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.967 0.282 17569 6960 1 11 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.533 -3.001 17569 6961 1 11 . 1 1 113 113 ILE H H 267 9.160 9.160 7.508 1.652 17569 6962 1 11 . 1 1 114 114 CYS N N 268 124.100 124.100 118.351 5.749 17569 6963 1 11 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.161 -0.347 17569 6964 1 11 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.665 3.635 17569 6965 1 11 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.071 2.650 17569 6966 1 11 . 1 1 114 114 CYS H H 268 7.818 7.818 8.237 -0.419 17569 6967 1 11 . 1 1 115 115 HIS N N 269 117.127 117.127 111.150 5.977 17569 6968 1 11 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.660 0.469 17569 6969 1 11 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.046 -0.885 17569 6970 1 11 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.797 2.396 17569 6971 1 11 . 1 1 115 115 HIS H H 269 8.953 8.953 7.789 1.164 17569 6972 1 11 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.443 0.499 17569 6973 1 11 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.485 -0.177 17569 6974 1 11 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.496 1.146 17569 6975 1 11 . 1 1 117 117 GLU N N 271 123.504 123.504 122.690 0.814 17569 6976 1 11 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.384 -0.364 17569 6977 1 11 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.904 3.966 17569 6978 1 11 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.862 -1.811 17569 6979 1 11 . 1 1 117 117 GLU H H 271 8.402 8.402 8.161 0.241 17569 6980 1 11 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.519 0.023 17569 6981 1 11 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.523 1.836 17569 6982 1 11 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.415 0.727 17569 6983 1 11 . 1 1 119 119 LEU N N 273 112.296 112.296 114.391 -2.095 17569 6984 1 11 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.921 -0.447 17569 6985 1 11 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.483 0.059 17569 6986 1 11 . 1 1 119 119 LEU H H 273 8.090 8.090 7.464 0.626 17569 6987 1 11 . 1 1 120 120 LEU N N 274 121.388 121.388 122.847 -1.459 17569 6988 1 11 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.918 0.109 17569 6989 1 11 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.628 -0.327 17569 6990 1 11 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.776 0.324 17569 6991 1 11 . 1 1 120 120 LEU H H 274 7.823 7.823 8.078 -0.255 17569 6992 1 11 . 1 1 121 121 ASP N N 275 118.600 118.600 118.788 -0.188 17569 6993 1 11 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.321 0.220 17569 6994 1 11 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.345 0.358 17569 6995 1 11 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.688 -1.245 17569 6996 1 11 . 1 1 121 121 ASP H H 275 8.694 8.694 8.447 0.247 17569 6997 1 11 . 1 1 122 122 LEU N N 276 123.192 123.192 120.791 2.401 17569 6998 1 11 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.945 0.447 17569 6999 1 11 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.974 -0.002 17569 7000 1 11 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.185 0.357 17569 7001 1 11 . 1 1 122 122 LEU H H 276 8.013 8.013 7.348 0.665 17569 7002 1 11 . 1 1 123 123 VAL N N 277 126.898 126.898 118.614 8.284 17569 7003 1 11 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.525 0.330 17569 7004 1 11 . 1 1 123 123 VAL CA C 277 66.663 66.663 67.011 -0.348 17569 7005 1 11 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.443 0.615 17569 7006 1 11 . 1 1 123 123 VAL H H 277 8.781 8.781 7.887 0.894 17569 7007 1 11 . 1 1 124 124 THR N N 278 117.500 117.500 116.080 1.420 17569 7008 1 11 . 1 1 124 124 THR HA H 278 4.030 4.030 3.888 0.142 17569 7009 1 11 . 1 1 124 124 THR CA C 278 66.589 66.589 67.083 -0.494 17569 7010 1 11 . 1 1 124 124 THR CB C 278 68.410 68.410 68.538 -0.128 17569 7011 1 11 . 1 1 124 124 THR H H 278 8.722 8.722 8.162 0.560 17569 7012 1 11 . 1 1 125 125 ALA N N 279 124.700 124.700 123.930 0.770 17569 7013 1 11 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.089 0.172 17569 7014 1 11 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.993 0.303 17569 7015 1 11 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.962 -0.013 17569 7016 1 11 . 1 1 125 125 ALA H H 279 8.239 8.239 7.808 0.431 17569 7017 1 11 . 1 1 126 126 CYS N N 280 119.276 119.276 117.482 1.794 17569 7018 1 11 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.864 0.250 17569 7019 1 11 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.952 -1.849 17569 7020 1 11 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.896 -1.400 17569 7021 1 11 . 1 1 126 126 CYS H H 280 8.128 8.128 7.769 0.359 17569 7022 1 11 . 1 1 127 127 ASN N N 281 118.000 118.000 118.223 -0.223 17569 7023 1 11 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.574 -0.014 17569 7024 1 11 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.596 -0.458 17569 7025 1 11 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.057 -1.092 17569 7026 1 11 . 1 1 127 127 ASN H H 281 8.725 8.725 8.010 0.715 17569 7027 1 11 . 1 1 128 128 SER N N 282 116.601 116.601 116.967 -0.366 17569 7028 1 11 . 1 1 128 128 SER HA H 282 4.363 4.363 4.207 0.156 17569 7029 1 11 . 1 1 128 128 SER CA C 282 61.899 61.899 61.749 0.150 17569 7030 1 11 . 1 1 128 128 SER CB C 282 62.630 62.630 63.105 -0.475 17569 7031 1 11 . 1 1 128 128 SER H H 282 8.542 8.542 7.742 0.800 17569 7032 1 11 . 1 1 129 129 VAL N N 283 123.272 123.272 121.766 1.506 17569 7033 1 11 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.645 0.032 17569 7034 1 11 . 1 1 129 129 VAL CA C 283 66.508 66.508 65.960 0.548 17569 7035 1 11 . 1 1 129 129 VAL CB C 283 31.218 31.218 30.943 0.275 17569 7036 1 11 . 1 1 129 129 VAL H H 283 7.990 7.990 7.919 0.071 17569 7037 1 11 . 1 1 130 130 PHE N N 284 118.594 118.594 119.542 -0.948 17569 7038 1 11 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.319 -0.306 17569 7039 1 11 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.526 1.974 17569 7040 1 11 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.320 0.676 17569 7041 1 11 . 1 1 130 130 PHE H H 284 8.190 8.190 8.101 0.089 17569 7042 1 11 . 1 1 131 131 GLU N N 285 120.905 120.905 120.346 0.559 17569 7043 1 11 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.034 0.171 17569 7044 1 11 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.012 -0.798 17569 7045 1 11 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.503 -0.003 17569 7046 1 11 . 1 1 131 131 GLU H H 285 8.699 8.699 8.911 -0.212 17569 7047 1 11 . 1 1 132 132 ASN N N 286 117.997 117.997 118.065 -0.068 17569 7048 1 11 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.652 -0.057 17569 7049 1 11 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.476 -0.861 17569 7050 1 11 . 1 1 132 132 ASN CB C 286 38.852 38.852 39.029 -0.177 17569 7051 1 11 . 1 1 132 132 ASN H H 286 8.082 8.082 8.182 -0.100 17569 7052 1 11 . 1 1 133 133 LEU N N 287 120.800 120.800 122.136 -1.336 17569 7053 1 11 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.307 -0.190 17569 7054 1 11 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.267 -0.469 17569 7055 1 11 . 1 1 133 133 LEU H H 287 7.904 7.904 8.699 -0.795 17569 7056 1 11 . 1 1 134 134 GLU N N 288 118.200 118.200 119.223 -1.023 17569 7057 1 11 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.887 0.192 17569 7058 1 11 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.142 -1.145 17569 7059 1 11 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.398 -0.156 17569 7060 1 11 . 1 1 134 134 GLU H H 288 8.157 8.157 8.539 -0.382 17569 7061 1 11 . 1 1 135 135 GLN N N 289 117.400 117.400 118.514 -1.114 17569 7062 1 11 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.107 0.067 17569 7063 1 11 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.513 -0.524 17569 7064 1 11 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.398 -0.318 17569 7065 1 11 . 1 1 135 135 GLN H H 289 7.869 7.869 7.761 0.108 17569 7066 1 11 . 1 1 136 136 LEU N N 290 121.000 121.000 121.812 -0.812 17569 7067 1 11 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.801 0.372 17569 7068 1 11 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.809 -0.671 17569 7069 1 11 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.683 0.317 17569 7070 1 11 . 1 1 136 136 LEU H H 290 7.968 7.968 7.694 0.274 17569 7071 1 11 . 1 1 137 137 LEU N N 291 118.900 118.900 119.543 -0.643 17569 7072 1 11 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.001 0.240 17569 7073 1 11 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.382 -1.022 17569 7074 1 11 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.292 -0.820 17569 7075 1 11 . 1 1 137 137 LEU H H 291 8.154 8.154 7.790 0.364 17569 7076 1 11 . 1 1 138 138 GLN N N 292 117.993 117.993 115.001 2.992 17569 7077 1 11 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.514 -0.242 17569 7078 1 11 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.954 1.678 17569 7079 1 11 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.370 -0.787 17569 7080 1 11 . 1 1 138 138 GLN H H 292 7.896 7.896 7.576 0.320 17569 7081 1 11 . 1 1 139 139 GLN N N 293 118.889 118.889 120.777 -1.888 17569 7082 1 11 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.463 -0.194 17569 7083 1 11 . 1 1 139 139 GLN CA C 293 56.454 56.454 56.307 0.147 17569 7084 1 11 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.977 -0.908 17569 7085 1 11 . 1 1 139 139 GLN H H 293 8.091 8.091 7.441 0.650 17569 7086 1 11 . 1 1 140 140 ASN N N 294 118.604 118.604 122.292 -3.688 17569 7087 1 11 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.806 -0.047 17569 7088 1 11 . 1 1 140 140 ASN CA C 294 53.221 53.221 54.193 -0.972 17569 7089 1 11 . 1 1 140 140 ASN CB C 294 38.733 38.733 38.515 0.218 17569 7090 1 11 . 1 1 140 140 ASN H H 294 8.273 8.273 8.399 -0.126 17569 7091 1 11 . 1 1 141 141 LYS N N 295 121.685 121.685 121.663 0.022 17569 7092 1 11 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.478 -0.118 17569 7093 1 11 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.608 -0.435 17569 7094 1 11 . 1 1 141 141 LYS CB C 295 32.535 32.535 32.428 0.107 17569 7095 1 11 . 1 1 141 141 LYS H H 295 8.089 8.089 8.328 -0.239 17569 7096 1 12 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.846 -0.459 17569 7097 1 12 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.301 0.144 17569 7098 1 12 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.610 -1.353 17569 7099 1 12 . 1 1 3 3 MET HA H 157 4.476 4.476 4.687 -0.211 17569 7100 1 12 . 1 1 3 3 MET CA C 157 55.401 55.401 55.839 -0.438 17569 7101 1 12 . 1 1 4 4 ALA N N 158 124.828 124.828 123.367 1.461 17569 7102 1 12 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.653 -0.339 17569 7103 1 12 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.355 1.157 17569 7104 1 12 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.999 -0.998 17569 7105 1 12 . 1 1 4 4 ALA H H 158 8.382 8.382 7.831 0.551 17569 7106 1 12 . 1 1 5 5 ASP N N 159 119.418 119.418 119.844 -0.426 17569 7107 1 12 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.780 -0.190 17569 7108 1 12 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.770 0.366 17569 7109 1 12 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.023 -0.008 17569 7110 1 12 . 1 1 5 5 ASP H H 159 8.312 8.312 8.391 -0.079 17569 7111 1 12 . 1 1 6 6 LYS N N 160 121.604 121.604 122.542 -0.938 17569 7112 1 12 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.515 -0.172 17569 7113 1 12 . 1 1 6 6 LYS H H 160 8.274 8.274 8.378 -0.104 17569 7114 1 12 . 1 1 7 7 ARG N N 161 121.611 121.611 121.451 0.160 17569 7115 1 12 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.508 -0.181 17569 7116 1 12 . 1 1 7 7 ARG H H 161 8.430 8.430 8.696 -0.266 17569 7117 1 12 . 1 1 8 8 GLY N N 162 109.606 109.606 112.717 -3.111 17569 7118 1 12 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.569 0.478 17569 7119 1 12 . 1 1 8 8 GLY H H 162 8.473 8.473 8.673 -0.200 17569 7120 1 12 . 1 1 9 9 ASP N N 163 120.187 120.187 120.281 -0.094 17569 7121 1 12 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.437 0.212 17569 7122 1 12 . 1 1 9 9 ASP CA C 163 54.151 54.151 55.156 -1.005 17569 7123 1 12 . 1 1 9 9 ASP H H 163 8.296 8.296 8.270 0.026 17569 7124 1 12 . 1 1 10 10 GLY N N 164 108.816 108.816 108.605 0.211 17569 7125 1 12 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.092 0.275 17569 7126 1 12 . 1 1 10 10 GLY H H 164 8.458 8.458 8.564 -0.106 17569 7127 1 12 . 1 1 11 11 LEU N N 165 121.195 121.195 118.625 2.570 17569 7128 1 12 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.663 -0.347 17569 7129 1 12 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.093 0.907 17569 7130 1 12 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.927 -0.995 17569 7131 1 12 . 1 1 11 11 LEU H H 165 8.137 8.137 8.145 -0.008 17569 7132 1 12 . 1 1 12 12 HIS N N 166 119.387 119.387 123.405 -4.018 17569 7133 1 12 . 1 1 12 12 HIS HA H 166 4.655 4.655 5.006 -0.351 17569 7134 1 12 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.915 0.354 17569 7135 1 12 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.318 1.379 17569 7136 1 12 . 1 1 12 12 HIS H H 166 8.270 8.270 8.717 -0.447 17569 7137 1 12 . 1 1 13 13 GLY N N 167 109.899 109.899 111.654 -1.755 17569 7138 1 12 . 1 1 13 13 GLY CA C 167 45.105 45.105 45.000 0.105 17569 7139 1 12 . 1 1 13 13 GLY H H 167 8.276 8.276 8.133 0.143 17569 7140 1 12 . 1 1 14 14 ILE N N 168 119.597 119.597 120.594 -0.997 17569 7141 1 12 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.243 0.080 17569 7142 1 12 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.577 0.023 17569 7143 1 12 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.557 -2.607 17569 7144 1 12 . 1 1 14 14 ILE H H 168 7.962 7.962 8.077 -0.115 17569 7145 1 12 . 1 1 15 15 VAL N N 169 127.578 127.578 125.046 2.532 17569 7146 1 12 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.075 0.205 17569 7147 1 12 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.417 -1.100 17569 7148 1 12 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.105 2.297 17569 7149 1 12 . 1 1 15 15 VAL H H 169 9.011 9.011 8.420 0.591 17569 7150 1 12 . 1 1 16 16 SER N N 170 118.596 118.596 120.742 -2.146 17569 7151 1 12 . 1 1 16 16 SER HA H 170 5.140 5.140 4.651 0.489 17569 7152 1 12 . 1 1 16 16 SER CA C 170 55.985 55.985 56.805 -0.820 17569 7153 1 12 . 1 1 16 16 SER CB C 170 65.261 65.261 66.102 -0.841 17569 7154 1 12 . 1 1 16 16 SER H H 170 8.242 8.242 7.774 0.468 17569 7155 1 12 . 1 1 17 17 CYS N N 171 123.783 123.783 123.296 0.487 17569 7156 1 12 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.157 0.024 17569 7157 1 12 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.725 -0.881 17569 7158 1 12 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.586 2.787 17569 7159 1 12 . 1 1 17 17 CYS H H 171 8.894 8.894 8.503 0.391 17569 7160 1 12 . 1 1 18 18 THR N N 172 121.703 121.703 117.832 3.871 17569 7161 1 12 . 1 1 18 18 THR HA H 172 4.386 4.386 4.120 0.266 17569 7162 1 12 . 1 1 18 18 THR CA C 172 64.667 64.667 64.079 0.588 17569 7163 1 12 . 1 1 18 18 THR CB C 172 69.498 69.498 68.829 0.669 17569 7164 1 12 . 1 1 18 18 THR H H 172 8.788 8.788 8.300 0.488 17569 7165 1 12 . 1 1 19 19 ALA N N 173 131.364 131.364 121.741 9.623 17569 7166 1 12 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.133 0.363 17569 7167 1 12 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.626 0.400 17569 7168 1 12 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.905 3.277 17569 7169 1 12 . 1 1 19 19 ALA H H 173 9.680 9.680 7.859 1.821 17569 7170 1 12 . 1 1 20 20 CYS N N 174 115.498 115.498 113.572 1.926 17569 7171 1 12 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.585 0.383 17569 7172 1 12 . 1 1 20 20 CYS CA C 174 58.094 58.094 58.998 -0.904 17569 7173 1 12 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.711 4.533 17569 7174 1 12 . 1 1 20 20 CYS H H 174 8.470 8.470 7.540 0.930 17569 7175 1 12 . 1 1 21 21 GLY N N 175 112.464 112.464 108.432 4.032 17569 7176 1 12 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.078 0.628 17569 7177 1 12 . 1 1 21 21 GLY H H 175 7.884 7.884 7.921 -0.037 17569 7178 1 12 . 1 1 22 22 GLN N N 176 121.784 121.784 117.977 3.807 17569 7179 1 12 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.438 -0.062 17569 7180 1 12 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.344 1.947 17569 7181 1 12 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.439 -2.098 17569 7182 1 12 . 1 1 22 22 GLN H H 176 8.723 8.723 7.856 0.867 17569 7183 1 12 . 1 1 23 23 GLN N N 177 122.900 122.900 123.249 -0.349 17569 7184 1 12 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.200 0.330 17569 7185 1 12 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.886 -0.337 17569 7186 1 12 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.311 -0.851 17569 7187 1 12 . 1 1 23 23 GLN H H 177 8.721 8.721 8.556 0.165 17569 7188 1 12 . 1 1 24 24 VAL N N 178 121.000 121.000 124.504 -3.504 17569 7189 1 12 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.934 0.590 17569 7190 1 12 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.639 -2.762 17569 7191 1 12 . 1 1 24 24 VAL H H 178 8.689 8.689 7.871 0.818 17569 7192 1 12 . 1 1 25 25 ASN N N 179 121.392 121.392 122.605 -1.213 17569 7193 1 12 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.150 0.726 17569 7194 1 12 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.497 -2.348 17569 7195 1 12 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.743 -0.766 17569 7196 1 12 . 1 1 25 25 ASN H H 179 8.635 8.635 7.864 0.771 17569 7197 1 12 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.045 0.415 17569 7198 1 12 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.726 -1.728 17569 7199 1 12 . 1 1 27 27 PHE CB C 181 38.393 38.393 37.765 0.628 17569 7200 1 12 . 1 1 28 28 GLN N N 182 119.300 119.300 121.390 -2.090 17569 7201 1 12 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.572 -0.054 17569 7202 1 12 . 1 1 28 28 GLN CA C 182 54.342 54.342 55.432 -1.090 17569 7203 1 12 . 1 1 28 28 GLN CB C 182 30.350 30.350 31.207 -0.857 17569 7204 1 12 . 1 1 28 28 GLN H H 182 7.494 7.494 8.012 -0.518 17569 7205 1 12 . 1 1 29 29 LYS N N 183 124.516 124.516 125.998 -1.482 17569 7206 1 12 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.498 -0.576 17569 7207 1 12 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.696 1.616 17569 7208 1 12 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.329 -0.043 17569 7209 1 12 . 1 1 29 29 LYS H H 183 8.779 8.779 8.715 0.064 17569 7210 1 12 . 1 1 30 30 ASP N N 184 116.500 116.500 118.723 -2.223 17569 7211 1 12 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.785 -0.326 17569 7212 1 12 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.460 0.076 17569 7213 1 12 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.500 -1.529 17569 7214 1 12 . 1 1 30 30 ASP H H 184 8.556 8.556 8.279 0.277 17569 7215 1 12 . 1 1 31 31 SER N N 185 111.505 111.505 114.398 -2.893 17569 7216 1 12 . 1 1 31 31 SER HA H 185 4.695 4.695 4.775 -0.080 17569 7217 1 12 . 1 1 31 31 SER CA C 185 59.747 59.747 58.307 1.440 17569 7218 1 12 . 1 1 31 31 SER CB C 185 65.198 65.198 64.328 0.870 17569 7219 1 12 . 1 1 31 31 SER H H 185 7.933 7.933 8.503 -0.570 17569 7220 1 12 . 1 1 32 32 ILE N N 186 113.394 113.394 116.374 -2.980 17569 7221 1 12 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.032 -0.146 17569 7222 1 12 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.273 -0.694 17569 7223 1 12 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.554 1.258 17569 7224 1 12 . 1 1 32 32 ILE H H 186 7.105 7.105 7.570 -0.465 17569 7225 1 12 . 1 1 33 33 TYR N N 187 119.098 119.098 120.571 -1.473 17569 7226 1 12 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.166 -0.643 17569 7227 1 12 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.004 1.256 17569 7228 1 12 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.197 2.243 17569 7229 1 12 . 1 1 33 33 TYR H H 187 8.954 8.954 7.823 1.131 17569 7230 1 12 . 1 1 34 34 ARG N N 188 118.502 118.502 122.156 -3.654 17569 7231 1 12 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.743 -0.106 17569 7232 1 12 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.330 -1.578 17569 7233 1 12 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.193 1.058 17569 7234 1 12 . 1 1 34 34 ARG H H 188 8.412 8.412 8.619 -0.207 17569 7235 1 12 . 1 1 35 35 HIS N N 189 126.596 126.596 127.211 -0.615 17569 7236 1 12 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.936 -0.344 17569 7237 1 12 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.080 -0.359 17569 7238 1 12 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.128 1.345 17569 7239 1 12 . 1 1 35 35 HIS H H 189 9.813 9.813 9.151 0.662 17569 7240 1 12 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.555 -0.257 17569 7241 1 12 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.945 0.331 17569 7242 1 12 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.214 0.637 17569 7243 1 12 . 1 1 37 37 SER N N 191 110.003 110.003 113.928 -3.925 17569 7244 1 12 . 1 1 37 37 SER HA H 191 4.918 4.918 4.301 0.617 17569 7245 1 12 . 1 1 37 37 SER CA C 191 59.031 59.031 61.014 -1.983 17569 7246 1 12 . 1 1 37 37 SER CB C 191 65.104 65.104 63.301 1.803 17569 7247 1 12 . 1 1 37 37 SER H H 191 8.934 8.934 8.532 0.402 17569 7248 1 12 . 1 1 38 38 LEU N N 192 120.959 120.959 114.201 6.758 17569 7249 1 12 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.997 -0.868 17569 7250 1 12 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.121 2.025 17569 7251 1 12 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.488 1.508 17569 7252 1 12 . 1 1 38 38 LEU H H 192 8.649 8.649 7.027 1.622 17569 7253 1 12 . 1 1 39 39 GLN N N 193 108.600 108.600 119.202 -10.602 17569 7254 1 12 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.078 -0.173 17569 7255 1 12 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.678 0.136 17569 7256 1 12 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.803 -1.769 17569 7257 1 12 . 1 1 39 39 GLN H H 193 8.465 8.465 7.805 0.660 17569 7258 1 12 . 1 1 40 40 VAL N N 194 105.325 105.325 117.720 -12.395 17569 7259 1 12 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.520 0.030 17569 7260 1 12 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.668 -1.027 17569 7261 1 12 . 1 1 40 40 VAL H H 194 6.256 6.256 7.818 -1.562 17569 7262 1 12 . 1 1 41 41 LEU N N 195 123.100 123.100 121.883 1.217 17569 7263 1 12 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.783 0.033 17569 7264 1 12 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.456 3.726 17569 7265 1 12 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.887 0.683 17569 7266 1 12 . 1 1 41 41 LEU H H 195 9.154 9.154 8.512 0.642 17569 7267 1 12 . 1 1 42 42 ILE N N 196 124.396 124.396 117.100 7.296 17569 7268 1 12 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.816 1.536 17569 7269 1 12 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.283 0.947 17569 7270 1 12 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.857 1.413 17569 7271 1 12 . 1 1 42 42 ILE H H 196 9.766 9.766 7.803 1.963 17569 7272 1 12 . 1 1 43 43 CYS N N 197 121.500 121.500 115.005 6.495 17569 7273 1 12 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.223 0.039 17569 7274 1 12 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.131 0.572 17569 7275 1 12 . 1 1 43 43 CYS CB C 197 33.300 33.300 30.918 2.382 17569 7276 1 12 . 1 1 43 43 CYS H H 197 9.882 9.882 8.331 1.551 17569 7277 1 12 . 1 1 44 44 LYS N N 198 117.995 117.995 122.690 -4.695 17569 7278 1 12 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.183 -0.194 17569 7279 1 12 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.439 -0.779 17569 7280 1 12 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.429 0.271 17569 7281 1 12 . 1 1 44 44 LYS H H 198 8.089 8.089 8.808 -0.719 17569 7282 1 12 . 1 1 45 45 ASN N N 199 119.200 119.200 117.287 1.913 17569 7283 1 12 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.556 -0.042 17569 7284 1 12 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.996 0.724 17569 7285 1 12 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.075 0.092 17569 7286 1 12 . 1 1 45 45 ASN H H 199 8.356 8.356 8.443 -0.087 17569 7287 1 12 . 1 1 46 46 CYS N N 200 126.600 126.600 118.209 8.391 17569 7288 1 12 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.020 0.161 17569 7289 1 12 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.064 2.431 17569 7290 1 12 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.195 1.987 17569 7291 1 12 . 1 1 46 46 CYS H H 200 9.189 9.189 7.836 1.353 17569 7292 1 12 . 1 1 47 47 PHE N N 201 121.962 121.962 120.362 1.600 17569 7293 1 12 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.147 -0.277 17569 7294 1 12 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.597 1.672 17569 7295 1 12 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.572 0.595 17569 7296 1 12 . 1 1 47 47 PHE H H 201 8.826 8.826 7.888 0.939 17569 7297 1 12 . 1 1 48 48 LYS N N 202 117.400 117.400 120.298 -2.898 17569 7298 1 12 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.893 -0.195 17569 7299 1 12 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.239 -1.287 17569 7300 1 12 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.281 -0.739 17569 7301 1 12 . 1 1 48 48 LYS H H 202 8.512 8.512 8.069 0.443 17569 7302 1 12 . 1 1 49 49 TYR N N 203 120.400 120.400 120.852 -0.452 17569 7303 1 12 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.222 0.192 17569 7304 1 12 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.449 -0.677 17569 7305 1 12 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.608 -0.162 17569 7306 1 12 . 1 1 49 49 TYR H H 203 8.133 8.133 7.717 0.416 17569 7307 1 12 . 1 1 50 50 TYR N N 204 121.783 121.783 118.058 3.725 17569 7308 1 12 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.736 -1.241 17569 7309 1 12 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.865 3.085 17569 7310 1 12 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.659 0.833 17569 7311 1 12 . 1 1 50 50 TYR H H 204 8.765 8.765 7.562 1.203 17569 7312 1 12 . 1 1 51 51 MET N N 205 110.800 110.800 115.731 -4.931 17569 7313 1 12 . 1 1 51 51 MET HA H 205 4.349 4.349 4.200 0.149 17569 7314 1 12 . 1 1 51 51 MET CA C 205 53.505 53.505 56.994 -3.489 17569 7315 1 12 . 1 1 51 51 MET CB C 205 30.384 30.384 32.540 -2.156 17569 7316 1 12 . 1 1 51 51 MET H H 205 7.771 7.771 8.419 -0.648 17569 7317 1 12 . 1 1 52 52 SER N N 206 116.800 116.800 112.678 4.122 17569 7318 1 12 . 1 1 52 52 SER HA H 206 3.919 3.919 4.356 -0.437 17569 7319 1 12 . 1 1 52 52 SER CA C 206 61.621 61.621 60.431 1.190 17569 7320 1 12 . 1 1 52 52 SER CB C 206 62.611 62.611 64.342 -1.731 17569 7321 1 12 . 1 1 52 52 SER H H 206 7.581 7.581 8.376 -0.795 17569 7322 1 12 . 1 1 53 53 ASP N N 207 117.400 117.400 121.436 -4.036 17569 7323 1 12 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.821 -0.249 17569 7324 1 12 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.465 -0.366 17569 7325 1 12 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.897 0.291 17569 7326 1 12 . 1 1 53 53 ASP H H 207 7.085 7.085 8.232 -1.147 17569 7327 1 12 . 1 1 54 54 ASP N N 208 119.405 119.405 122.763 -3.358 17569 7328 1 12 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.991 -0.602 17569 7329 1 12 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.370 0.530 17569 7330 1 12 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.032 -1.683 17569 7331 1 12 . 1 1 54 54 ASP H H 208 8.439 8.439 8.500 -0.061 17569 7332 1 12 . 1 1 55 55 ILE N N 209 124.698 124.698 120.405 4.293 17569 7333 1 12 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.342 -0.342 17569 7334 1 12 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.575 1.702 17569 7335 1 12 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.007 1.284 17569 7336 1 12 . 1 1 55 55 ILE H H 209 8.128 8.128 8.391 -0.263 17569 7337 1 12 . 1 1 56 56 SER N N 210 126.703 126.703 122.450 4.253 17569 7338 1 12 . 1 1 56 56 SER HA H 210 4.365 4.365 4.732 -0.367 17569 7339 1 12 . 1 1 56 56 SER CA C 210 57.769 57.769 57.322 0.447 17569 7340 1 12 . 1 1 56 56 SER CB C 210 64.991 64.991 64.547 0.444 17569 7341 1 12 . 1 1 56 56 SER H H 210 8.815 8.815 8.637 0.178 17569 7342 1 12 . 1 1 57 57 ARG N N 211 116.885 116.885 120.142 -3.257 17569 7343 1 12 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.648 0.394 17569 7344 1 12 . 1 1 57 57 ARG CA C 211 54.400 54.400 56.426 -2.026 17569 7345 1 12 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.000 3.284 17569 7346 1 12 . 1 1 57 57 ARG H H 211 8.365 8.365 8.498 -0.133 17569 7347 1 12 . 1 1 58 58 ASP N N 212 121.982 121.982 123.821 -1.839 17569 7348 1 12 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.926 -0.311 17569 7349 1 12 . 1 1 58 58 ASP CA C 212 52.222 52.222 52.860 -0.638 17569 7350 1 12 . 1 1 58 58 ASP CB C 212 41.502 41.502 43.781 -2.279 17569 7351 1 12 . 1 1 58 58 ASP H H 212 8.706 8.706 8.510 0.196 17569 7352 1 12 . 1 1 59 59 SER N N 213 114.164 114.164 114.318 -0.154 17569 7353 1 12 . 1 1 59 59 SER HA H 213 4.212 4.212 4.121 0.091 17569 7354 1 12 . 1 1 59 59 SER CA C 213 60.840 60.840 61.022 -0.181 17569 7355 1 12 . 1 1 59 59 SER CB C 213 62.714 62.714 62.610 0.104 17569 7356 1 12 . 1 1 59 59 SER H H 213 8.687 8.687 8.590 0.097 17569 7357 1 12 . 1 1 60 60 ASP N N 214 120.899 120.899 123.090 -2.191 17569 7358 1 12 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.768 0.057 17569 7359 1 12 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.913 0.298 17569 7360 1 12 . 1 1 60 60 ASP CB C 214 41.558 41.558 41.120 0.438 17569 7361 1 12 . 1 1 60 60 ASP H H 214 8.193 8.193 8.231 -0.038 17569 7362 1 12 . 1 1 61 61 GLY N N 215 108.300 108.300 108.369 -0.069 17569 7363 1 12 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.764 -0.367 17569 7364 1 12 . 1 1 61 61 GLY H H 215 8.234 8.234 8.264 -0.030 17569 7365 1 12 . 1 1 62 62 MET N N 216 120.002 120.002 116.816 3.186 17569 7366 1 12 . 1 1 62 62 MET HA H 216 4.972 4.972 4.626 0.346 17569 7367 1 12 . 1 1 62 62 MET CA C 216 53.151 53.151 54.271 -1.120 17569 7368 1 12 . 1 1 62 62 MET CB C 216 32.311 32.311 36.892 -4.581 17569 7369 1 12 . 1 1 62 62 MET H H 216 8.376 8.376 7.432 0.944 17569 7370 1 12 . 1 1 63 63 ASP N N 217 127.300 127.300 122.250 5.050 17569 7371 1 12 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.812 0.154 17569 7372 1 12 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.463 0.106 17569 7373 1 12 . 1 1 63 63 ASP H H 217 9.368 9.368 8.664 0.704 17569 7374 1 12 . 1 1 64 64 GLU N N 218 114.400 114.400 126.414 -12.014 17569 7375 1 12 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.588 -0.432 17569 7376 1 12 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.380 0.470 17569 7377 1 12 . 1 1 64 64 GLU H H 218 8.583 8.583 8.529 0.054 17569 7378 1 12 . 1 1 65 65 GLN N N 219 115.500 115.500 117.376 -1.876 17569 7379 1 12 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.618 -0.307 17569 7380 1 12 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.031 0.315 17569 7381 1 12 . 1 1 65 65 GLN H H 219 7.158 7.158 8.139 -0.981 17569 7382 1 12 . 1 1 66 66 CYS N N 220 122.600 122.600 117.280 5.320 17569 7383 1 12 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.439 -1.361 17569 7384 1 12 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.520 1.009 17569 7385 1 12 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.278 1.694 17569 7386 1 12 . 1 1 66 66 CYS H H 220 8.248 8.248 8.367 -0.119 17569 7387 1 12 . 1 1 67 67 ARG N N 221 130.363 130.363 124.211 6.152 17569 7388 1 12 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.486 -0.419 17569 7389 1 12 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.457 -2.441 17569 7390 1 12 . 1 1 67 67 ARG H H 221 9.145 9.145 8.772 0.373 17569 7391 1 12 . 1 1 68 68 TRP N N 222 124.200 124.200 120.497 3.703 17569 7392 1 12 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.687 -0.251 17569 7393 1 12 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.208 0.872 17569 7394 1 12 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.505 0.690 17569 7395 1 12 . 1 1 68 68 TRP H H 222 9.689 9.689 8.247 1.442 17569 7396 1 12 . 1 1 69 69 CYS N N 223 116.297 116.297 110.530 5.767 17569 7397 1 12 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.001 0.090 17569 7398 1 12 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.940 3.162 17569 7399 1 12 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.510 4.828 17569 7400 1 12 . 1 1 69 69 CYS H H 223 8.822 8.822 7.702 1.120 17569 7401 1 12 . 1 1 70 70 ALA N N 224 123.112 123.112 123.975 -0.863 17569 7402 1 12 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.302 0.104 17569 7403 1 12 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.033 -0.182 17569 7404 1 12 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.816 -0.096 17569 7405 1 12 . 1 1 70 70 ALA H H 224 8.787 8.787 8.161 0.626 17569 7406 1 12 . 1 1 71 71 GLU N N 225 118.300 118.300 120.170 -1.870 17569 7407 1 12 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.469 0.839 17569 7408 1 12 . 1 1 71 71 GLU CA C 225 53.299 53.299 56.110 -2.811 17569 7409 1 12 . 1 1 71 71 GLU H H 225 8.541 8.541 8.141 0.400 17569 7410 1 12 . 1 1 72 72 GLY N N 226 111.995 111.995 110.143 1.852 17569 7411 1 12 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.516 -1.113 17569 7412 1 12 . 1 1 72 72 GLY H H 226 9.837 9.837 8.481 1.356 17569 7413 1 12 . 1 1 73 73 GLY N N 227 106.600 106.600 107.209 -0.609 17569 7414 1 12 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.046 0.925 17569 7415 1 12 . 1 1 73 73 GLY H H 227 7.772 7.772 8.336 -0.564 17569 7416 1 12 . 1 1 74 74 ASN N N 228 124.277 124.277 119.218 5.059 17569 7417 1 12 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.450 0.631 17569 7418 1 12 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.860 -0.760 17569 7419 1 12 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.239 -0.155 17569 7420 1 12 . 1 1 74 74 ASN H H 228 8.876 8.876 8.552 0.324 17569 7421 1 12 . 1 1 75 75 LEU N N 229 123.050 123.050 121.338 1.712 17569 7422 1 12 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.772 -0.172 17569 7423 1 12 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.448 0.914 17569 7424 1 12 . 1 1 75 75 LEU CB C 229 43.500 43.500 42.939 0.561 17569 7425 1 12 . 1 1 75 75 LEU H H 229 8.901 8.901 7.981 0.920 17569 7426 1 12 . 1 1 76 76 ILE N N 230 123.552 123.552 124.184 -0.632 17569 7427 1 12 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.052 0.433 17569 7428 1 12 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.383 -0.683 17569 7429 1 12 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.249 0.150 17569 7430 1 12 . 1 1 76 76 ILE H H 230 9.406 9.406 9.212 0.194 17569 7431 1 12 . 1 1 77 77 CYS N N 231 124.637 124.637 124.966 -0.329 17569 7432 1 12 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.313 -0.438 17569 7433 1 12 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.660 0.699 17569 7434 1 12 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.459 0.975 17569 7435 1 12 . 1 1 77 77 CYS H H 231 8.809 8.809 8.468 0.341 17569 7436 1 12 . 1 1 78 78 CYS N N 232 125.697 125.697 122.727 2.970 17569 7437 1 12 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.754 -0.470 17569 7438 1 12 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.437 3.447 17569 7439 1 12 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.800 1.370 17569 7440 1 12 . 1 1 78 78 CYS H H 232 8.579 8.579 8.589 -0.010 17569 7441 1 12 . 1 1 79 79 ASP N N 233 123.600 123.600 124.660 -1.060 17569 7442 1 12 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.604 0.153 17569 7443 1 12 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.384 2.605 17569 7444 1 12 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.529 1.100 17569 7445 1 12 . 1 1 79 79 ASP H H 233 8.577 8.577 8.278 0.299 17569 7446 1 12 . 1 1 80 80 PHE N N 234 122.100 122.100 116.284 5.816 17569 7447 1 12 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.626 -0.100 17569 7448 1 12 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.228 1.681 17569 7449 1 12 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.090 1.759 17569 7450 1 12 . 1 1 80 80 PHE H H 234 10.432 10.432 7.692 2.740 17569 7451 1 12 . 1 1 81 81 CYS N N 235 124.300 124.300 118.224 6.076 17569 7452 1 12 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.781 0.375 17569 7453 1 12 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.953 0.091 17569 7454 1 12 . 1 1 81 81 CYS CB C 235 31.407 31.407 26.791 4.616 17569 7455 1 12 . 1 1 81 81 CYS H H 235 8.476 8.476 8.060 0.415 17569 7456 1 12 . 1 1 82 82 HIS N N 236 112.598 112.598 119.196 -6.598 17569 7457 1 12 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.179 0.804 17569 7458 1 12 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.326 -1.928 17569 7459 1 12 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.717 2.540 17569 7460 1 12 . 1 1 82 82 HIS H H 236 6.699 6.699 8.418 -1.719 17569 7461 1 12 . 1 1 83 83 ASN N N 237 123.600 123.600 118.754 4.846 17569 7462 1 12 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.808 -0.007 17569 7463 1 12 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.931 2.685 17569 7464 1 12 . 1 1 83 83 ASN H H 237 9.097 9.097 7.993 1.104 17569 7465 1 12 . 1 1 84 84 ALA N N 238 122.000 122.000 125.054 -3.054 17569 7466 1 12 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.034 0.375 17569 7467 1 12 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.211 0.153 17569 7468 1 12 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.879 3.191 17569 7469 1 12 . 1 1 84 84 ALA H H 238 9.885 9.885 8.429 1.456 17569 7470 1 12 . 1 1 85 85 PHE N N 239 116.707 116.707 122.371 -5.664 17569 7471 1 12 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.150 0.878 17569 7472 1 12 . 1 1 85 85 PHE CA C 239 56.217 56.217 55.996 0.221 17569 7473 1 12 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.149 2.515 17569 7474 1 12 . 1 1 85 85 PHE H H 239 9.450 9.450 8.899 0.551 17569 7475 1 12 . 1 1 86 86 CYS N N 240 126.682 126.682 124.718 1.964 17569 7476 1 12 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.674 0.948 17569 7477 1 12 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.788 -0.446 17569 7478 1 12 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.262 2.995 17569 7479 1 12 . 1 1 86 86 CYS H H 240 11.309 11.309 9.511 1.798 17569 7480 1 12 . 1 1 87 87 LYS N N 241 117.865 117.865 124.228 -6.363 17569 7481 1 12 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.915 -0.066 17569 7482 1 12 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.018 0.052 17569 7483 1 12 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.413 0.385 17569 7484 1 12 . 1 1 87 87 LYS H H 241 8.230 8.230 8.736 -0.506 17569 7485 1 12 . 1 1 88 88 LYS N N 242 117.949 117.949 118.332 -0.383 17569 7486 1 12 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.113 -0.135 17569 7487 1 12 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.017 1.353 17569 7488 1 12 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.110 0.206 17569 7489 1 12 . 1 1 88 88 LYS H H 242 7.945 7.945 8.502 -0.557 17569 7490 1 12 . 1 1 89 89 CYS N N 243 125.305 125.305 117.476 7.829 17569 7491 1 12 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.258 -0.516 17569 7492 1 12 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.167 2.660 17569 7493 1 12 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.513 0.728 17569 7494 1 12 . 1 1 89 89 CYS H H 243 9.297 9.297 7.716 1.581 17569 7495 1 12 . 1 1 90 90 ILE N N 244 119.687 119.687 121.732 -2.045 17569 7496 1 12 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.012 -0.405 17569 7497 1 12 . 1 1 90 90 ILE CA C 244 65.950 65.950 64.154 1.796 17569 7498 1 12 . 1 1 90 90 ILE H H 244 7.997 7.997 7.762 0.235 17569 7499 1 12 . 1 1 91 91 LEU N N 245 120.280 120.280 120.872 -0.592 17569 7500 1 12 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.268 -0.583 17569 7501 1 12 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.807 0.428 17569 7502 1 12 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.934 0.024 17569 7503 1 12 . 1 1 91 91 LEU H H 245 8.810 8.810 8.891 -0.081 17569 7504 1 12 . 1 1 92 92 ARG N N 246 116.901 116.901 117.846 -0.945 17569 7505 1 12 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.084 -0.267 17569 7506 1 12 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.103 0.877 17569 7507 1 12 . 1 1 92 92 ARG CB C 246 30.600 30.600 29.955 0.645 17569 7508 1 12 . 1 1 92 92 ARG H H 246 8.086 8.086 7.591 0.495 17569 7509 1 12 . 1 1 93 93 ASN N N 247 111.200 111.200 115.792 -4.592 17569 7510 1 12 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.478 0.125 17569 7511 1 12 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.758 1.050 17569 7512 1 12 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.910 3.574 17569 7513 1 12 . 1 1 93 93 ASN H H 247 7.136 7.136 8.157 -1.021 17569 7514 1 12 . 1 1 94 94 LEU N N 248 118.807 118.807 117.301 1.506 17569 7515 1 12 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.587 0.227 17569 7516 1 12 . 1 1 94 94 LEU CA C 248 55.189 55.189 54.975 0.214 17569 7517 1 12 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.686 0.012 17569 7518 1 12 . 1 1 94 94 LEU H H 248 8.515 8.515 7.974 0.541 17569 7519 1 12 . 1 1 95 95 GLY N N 249 108.000 108.000 106.225 1.775 17569 7520 1 12 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.740 -0.112 17569 7521 1 12 . 1 1 95 95 GLY H H 249 7.955 7.955 7.854 0.101 17569 7522 1 12 . 1 1 96 96 ARG N N 250 117.797 117.797 122.276 -4.479 17569 7523 1 12 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.276 -0.433 17569 7524 1 12 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.128 0.554 17569 7525 1 12 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.174 -0.313 17569 7526 1 12 . 1 1 96 96 ARG H H 250 8.559 8.559 8.598 -0.039 17569 7527 1 12 . 1 1 97 97 LYS N N 251 120.900 120.900 119.611 1.289 17569 7528 1 12 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.038 0.118 17569 7529 1 12 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.426 -0.270 17569 7530 1 12 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.628 -0.268 17569 7531 1 12 . 1 1 97 97 LYS H H 251 8.655 8.655 8.502 0.153 17569 7532 1 12 . 1 1 98 98 GLU N N 252 122.000 122.000 119.097 2.903 17569 7533 1 12 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.092 0.259 17569 7534 1 12 . 1 1 98 98 GLU CA C 252 58.582 58.582 58.919 -0.337 17569 7535 1 12 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.421 -1.021 17569 7536 1 12 . 1 1 98 98 GLU H H 252 7.705 7.705 8.255 -0.550 17569 7537 1 12 . 1 1 99 99 LEU N N 253 117.400 117.400 120.822 -3.422 17569 7538 1 12 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.801 0.116 17569 7539 1 12 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.099 -0.101 17569 7540 1 12 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.841 -0.359 17569 7541 1 12 . 1 1 99 99 LEU H H 253 7.285 7.285 7.674 -0.389 17569 7542 1 12 . 1 1 100 100 SER N N 254 112.100 112.100 113.872 -1.772 17569 7543 1 12 . 1 1 100 100 SER HA H 254 4.107 4.107 4.084 0.023 17569 7544 1 12 . 1 1 100 100 SER CA C 254 61.603 61.603 61.488 0.115 17569 7545 1 12 . 1 1 100 100 SER CB C 254 62.622 62.622 63.086 -0.464 17569 7546 1 12 . 1 1 100 100 SER H H 254 8.326 8.326 7.971 0.355 17569 7547 1 12 . 1 1 101 101 THR N N 255 118.151 118.151 118.756 -0.605 17569 7548 1 12 . 1 1 101 101 THR HA H 255 4.026 4.026 4.062 -0.036 17569 7549 1 12 . 1 1 101 101 THR CA C 255 66.261 66.261 66.793 -0.533 17569 7550 1 12 . 1 1 101 101 THR CB C 255 68.735 68.735 68.939 -0.204 17569 7551 1 12 . 1 1 101 101 THR H H 255 7.972 7.972 7.820 0.152 17569 7552 1 12 . 1 1 102 102 ILE N N 256 120.100 120.100 122.932 -2.832 17569 7553 1 12 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.826 -0.363 17569 7554 1 12 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.970 -0.196 17569 7555 1 12 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.535 0.206 17569 7556 1 12 . 1 1 102 102 ILE H H 256 7.868 7.868 8.537 -0.669 17569 7557 1 12 . 1 1 103 103 MET N N 257 114.876 114.876 116.729 -1.853 17569 7558 1 12 . 1 1 103 103 MET HA H 257 4.211 4.211 4.074 0.137 17569 7559 1 12 . 1 1 103 103 MET CA C 257 55.691 55.691 58.348 -2.657 17569 7560 1 12 . 1 1 103 103 MET CB C 257 32.000 32.000 32.662 -0.662 17569 7561 1 12 . 1 1 103 103 MET H H 257 7.606 7.606 7.205 0.401 17569 7562 1 12 . 1 1 104 104 ASP N N 258 119.976 119.976 118.716 1.260 17569 7563 1 12 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.813 -0.275 17569 7564 1 12 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.900 1.012 17569 7565 1 12 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.122 1.378 17569 7566 1 12 . 1 1 104 104 ASP H H 258 7.444 7.444 7.648 -0.204 17569 7567 1 12 . 1 1 105 105 GLU N N 259 124.388 124.388 120.667 3.721 17569 7568 1 12 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.510 -0.223 17569 7569 1 12 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.858 2.713 17569 7570 1 12 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.777 -0.235 17569 7571 1 12 . 1 1 105 105 GLU H H 259 8.559 8.559 8.204 0.355 17569 7572 1 12 . 1 1 106 106 ASN N N 260 117.201 117.201 119.173 -1.972 17569 7573 1 12 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.388 0.354 17569 7574 1 12 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.692 0.051 17569 7575 1 12 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.437 1.481 17569 7576 1 12 . 1 1 106 106 ASN H H 260 8.673 8.673 8.498 0.175 17569 7577 1 12 . 1 1 107 107 ASN N N 261 117.900 117.900 113.591 4.309 17569 7578 1 12 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.257 0.728 17569 7579 1 12 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.784 -2.482 17569 7580 1 12 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.503 3.111 17569 7581 1 12 . 1 1 107 107 ASN H H 261 7.956 7.956 8.745 -0.789 17569 7582 1 12 . 1 1 108 108 GLN N N 262 121.500 121.500 115.875 5.625 17569 7583 1 12 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.127 0.481 17569 7584 1 12 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.542 1.234 17569 7585 1 12 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.869 0.689 17569 7586 1 12 . 1 1 108 108 GLN H H 262 8.493 8.493 7.690 0.803 17569 7587 1 12 . 1 1 109 109 TRP N N 263 128.056 128.056 123.510 4.546 17569 7588 1 12 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.622 0.349 17569 7589 1 12 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.782 0.315 17569 7590 1 12 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.683 0.810 17569 7591 1 12 . 1 1 109 109 TRP H H 263 10.497 10.497 7.909 2.588 17569 7592 1 12 . 1 1 110 110 TYR N N 264 126.600 126.600 126.167 0.433 17569 7593 1 12 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.245 0.157 17569 7594 1 12 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.754 -3.083 17569 7595 1 12 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.767 -0.759 17569 7596 1 12 . 1 1 110 110 TYR H H 264 7.545 7.545 8.060 -0.515 17569 7597 1 12 . 1 1 111 111 CYS N N 265 124.622 124.622 114.438 10.184 17569 7598 1 12 . 1 1 111 111 CYS H H 265 8.586 8.586 8.379 0.207 17569 7599 1 12 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.859 -0.667 17569 7600 1 12 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.771 0.944 17569 7601 1 12 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.755 1.165 17569 7602 1 12 . 1 1 113 113 ILE N N 267 119.504 119.504 119.809 -0.305 17569 7603 1 12 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.709 -0.759 17569 7604 1 12 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.964 0.285 17569 7605 1 12 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.575 -3.042 17569 7606 1 12 . 1 1 113 113 ILE H H 267 9.160 9.160 7.518 1.642 17569 7607 1 12 . 1 1 114 114 CYS N N 268 124.100 124.100 118.388 5.712 17569 7608 1 12 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.187 -0.373 17569 7609 1 12 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.715 3.586 17569 7610 1 12 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.103 2.618 17569 7611 1 12 . 1 1 114 114 CYS H H 268 7.818 7.818 8.252 -0.434 17569 7612 1 12 . 1 1 115 115 HIS N N 269 117.127 117.127 111.284 5.843 17569 7613 1 12 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.663 0.466 17569 7614 1 12 . 1 1 115 115 HIS CA C 269 52.161 52.161 52.983 -0.822 17569 7615 1 12 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.912 2.280 17569 7616 1 12 . 1 1 115 115 HIS H H 269 8.953 8.953 7.789 1.164 17569 7617 1 12 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.447 0.495 17569 7618 1 12 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.462 -0.154 17569 7619 1 12 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.682 0.960 17569 7620 1 12 . 1 1 117 117 GLU N N 271 123.504 123.504 123.031 0.473 17569 7621 1 12 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.446 -0.426 17569 7622 1 12 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.136 3.733 17569 7623 1 12 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.890 -1.839 17569 7624 1 12 . 1 1 117 117 GLU H H 271 8.402 8.402 8.112 0.290 17569 7625 1 12 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.526 0.016 17569 7626 1 12 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.631 1.728 17569 7627 1 12 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.329 0.813 17569 7628 1 12 . 1 1 119 119 LEU N N 273 112.296 112.296 113.957 -1.661 17569 7629 1 12 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.928 -0.454 17569 7630 1 12 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.516 0.026 17569 7631 1 12 . 1 1 119 119 LEU H H 273 8.090 8.090 7.419 0.671 17569 7632 1 12 . 1 1 120 120 LEU N N 274 121.388 121.388 123.764 -2.376 17569 7633 1 12 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.932 0.095 17569 7634 1 12 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.852 -0.551 17569 7635 1 12 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.137 0.963 17569 7636 1 12 . 1 1 120 120 LEU H H 274 7.823 7.823 8.596 -0.773 17569 7637 1 12 . 1 1 121 121 ASP N N 275 118.600 118.600 118.858 -0.258 17569 7638 1 12 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.369 0.172 17569 7639 1 12 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.741 -0.038 17569 7640 1 12 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.146 -0.703 17569 7641 1 12 . 1 1 121 121 ASP H H 275 8.694 8.694 8.725 -0.031 17569 7642 1 12 . 1 1 122 122 LEU N N 276 123.192 123.192 120.770 2.422 17569 7643 1 12 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.927 0.465 17569 7644 1 12 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.782 0.188 17569 7645 1 12 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.016 0.526 17569 7646 1 12 . 1 1 122 122 LEU H H 276 8.013 8.013 7.316 0.697 17569 7647 1 12 . 1 1 123 123 VAL N N 277 126.898 126.898 118.780 8.118 17569 7648 1 12 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.721 0.134 17569 7649 1 12 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.376 0.287 17569 7650 1 12 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.775 1.283 17569 7651 1 12 . 1 1 123 123 VAL H H 277 8.781 8.781 7.972 0.809 17569 7652 1 12 . 1 1 124 124 THR N N 278 117.500 117.500 116.471 1.029 17569 7653 1 12 . 1 1 124 124 THR HA H 278 4.030 4.030 3.961 0.069 17569 7654 1 12 . 1 1 124 124 THR CA C 278 66.589 66.589 66.716 -0.127 17569 7655 1 12 . 1 1 124 124 THR CB C 278 68.410 68.410 68.140 0.270 17569 7656 1 12 . 1 1 124 124 THR H H 278 8.722 8.722 8.527 0.195 17569 7657 1 12 . 1 1 125 125 ALA N N 279 124.700 124.700 123.871 0.829 17569 7658 1 12 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.098 0.163 17569 7659 1 12 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.017 0.279 17569 7660 1 12 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.010 -0.061 17569 7661 1 12 . 1 1 125 125 ALA H H 279 8.239 8.239 8.054 0.185 17569 7662 1 12 . 1 1 126 126 CYS N N 280 119.276 119.276 117.867 1.409 17569 7663 1 12 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.909 0.205 17569 7664 1 12 . 1 1 126 126 CYS CA C 280 62.103 62.103 62.940 -0.837 17569 7665 1 12 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.430 -0.934 17569 7666 1 12 . 1 1 126 126 CYS H H 280 8.128 8.128 7.791 0.337 17569 7667 1 12 . 1 1 127 127 ASN N N 281 118.000 118.000 118.054 -0.054 17569 7668 1 12 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.579 -0.019 17569 7669 1 12 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.597 -0.458 17569 7670 1 12 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.093 -1.128 17569 7671 1 12 . 1 1 127 127 ASN H H 281 8.725 8.725 7.930 0.795 17569 7672 1 12 . 1 1 128 128 SER N N 282 116.601 116.601 117.120 -0.519 17569 7673 1 12 . 1 1 128 128 SER HA H 282 4.363 4.363 4.209 0.154 17569 7674 1 12 . 1 1 128 128 SER CA C 282 61.899 61.899 61.391 0.508 17569 7675 1 12 . 1 1 128 128 SER CB C 282 62.630 62.630 62.959 -0.329 17569 7676 1 12 . 1 1 128 128 SER H H 282 8.542 8.542 7.648 0.894 17569 7677 1 12 . 1 1 129 129 VAL N N 283 123.272 123.272 122.145 1.127 17569 7678 1 12 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.497 0.180 17569 7679 1 12 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.576 -0.068 17569 7680 1 12 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.483 -0.265 17569 7681 1 12 . 1 1 129 129 VAL H H 283 7.990 7.990 8.154 -0.164 17569 7682 1 12 . 1 1 130 130 PHE N N 284 118.594 118.594 118.930 -0.336 17569 7683 1 12 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.278 -0.265 17569 7684 1 12 . 1 1 130 130 PHE CA C 284 63.500 63.500 60.980 2.520 17569 7685 1 12 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.359 0.637 17569 7686 1 12 . 1 1 130 130 PHE H H 284 8.190 8.190 7.993 0.197 17569 7687 1 12 . 1 1 131 131 GLU N N 285 120.905 120.905 120.156 0.749 17569 7688 1 12 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.018 0.187 17569 7689 1 12 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.891 -0.677 17569 7690 1 12 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.413 0.087 17569 7691 1 12 . 1 1 131 131 GLU H H 285 8.699 8.699 8.737 -0.038 17569 7692 1 12 . 1 1 132 132 ASN N N 286 117.997 117.997 118.224 -0.227 17569 7693 1 12 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.661 -0.066 17569 7694 1 12 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.759 -0.144 17569 7695 1 12 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.607 0.245 17569 7696 1 12 . 1 1 132 132 ASN H H 286 8.082 8.082 8.116 -0.034 17569 7697 1 12 . 1 1 133 133 LEU N N 287 120.800 120.800 122.191 -1.391 17569 7698 1 12 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.325 -0.208 17569 7699 1 12 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.171 -0.373 17569 7700 1 12 . 1 1 133 133 LEU H H 287 7.904 7.904 8.604 -0.700 17569 7701 1 12 . 1 1 134 134 GLU N N 288 118.200 118.200 118.530 -0.330 17569 7702 1 12 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.912 0.167 17569 7703 1 12 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.161 -1.164 17569 7704 1 12 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.419 -0.177 17569 7705 1 12 . 1 1 134 134 GLU H H 288 8.157 8.157 8.497 -0.340 17569 7706 1 12 . 1 1 135 135 GLN N N 289 117.400 117.400 119.152 -1.752 17569 7707 1 12 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.131 0.043 17569 7708 1 12 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.426 -0.437 17569 7709 1 12 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.376 -0.296 17569 7710 1 12 . 1 1 135 135 GLN H H 289 7.869 7.869 7.567 0.302 17569 7711 1 12 . 1 1 136 136 LEU N N 290 121.000 121.000 121.864 -0.864 17569 7712 1 12 . 1 1 136 136 LEU HA H 290 4.173 4.173 4.256 -0.083 17569 7713 1 12 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.861 -0.723 17569 7714 1 12 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.714 0.286 17569 7715 1 12 . 1 1 136 136 LEU H H 290 7.968 7.968 7.627 0.341 17569 7716 1 12 . 1 1 137 137 LEU N N 291 118.900 118.900 119.427 -0.527 17569 7717 1 12 . 1 1 137 137 LEU HA H 291 4.241 4.241 3.998 0.243 17569 7718 1 12 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.534 -1.174 17569 7719 1 12 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.277 -0.805 17569 7720 1 12 . 1 1 137 137 LEU H H 291 8.154 8.154 7.864 0.290 17569 7721 1 12 . 1 1 138 138 GLN N N 292 117.993 117.993 115.441 2.552 17569 7722 1 12 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.290 -0.018 17569 7723 1 12 . 1 1 138 138 GLN CA C 292 56.632 56.632 56.945 -0.313 17569 7724 1 12 . 1 1 138 138 GLN CB C 292 28.584 28.584 30.059 -1.476 17569 7725 1 12 . 1 1 138 138 GLN H H 292 7.896 7.896 7.638 0.258 17569 7726 1 12 . 1 1 139 139 GLN N N 293 118.889 118.889 120.293 -1.404 17569 7727 1 12 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.461 -0.192 17569 7728 1 12 . 1 1 139 139 GLN CA C 293 56.454 56.454 54.854 1.600 17569 7729 1 12 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.722 -0.653 17569 7730 1 12 . 1 1 139 139 GLN H H 293 8.091 8.091 8.414 -0.323 17569 7731 1 12 . 1 1 140 140 ASN N N 294 118.604 118.604 123.673 -5.069 17569 7732 1 12 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.731 0.028 17569 7733 1 12 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.754 0.467 17569 7734 1 12 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.133 -1.400 17569 7735 1 12 . 1 1 140 140 ASN H H 294 8.273 8.273 8.563 -0.290 17569 7736 1 12 . 1 1 141 141 LYS N N 295 121.685 121.685 119.900 1.785 17569 7737 1 12 . 1 1 141 141 LYS HA H 295 4.360 4.360 3.950 0.410 17569 7738 1 12 . 1 1 141 141 LYS CA C 295 56.173 56.173 57.326 -1.153 17569 7739 1 12 . 1 1 141 141 LYS CB C 295 32.535 32.535 32.415 0.120 17569 7740 1 12 . 1 1 141 141 LYS H H 295 8.089 8.089 8.486 -0.397 17569 7741 1 13 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.893 -0.506 17569 7742 1 13 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.331 0.114 17569 7743 1 13 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.266 -0.010 17569 7744 1 13 . 1 1 3 3 MET HA H 157 4.476 4.476 4.777 -0.301 17569 7745 1 13 . 1 1 3 3 MET CA C 157 55.401 55.401 54.824 0.577 17569 7746 1 13 . 1 1 4 4 ALA N N 158 124.828 124.828 122.988 1.840 17569 7747 1 13 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.688 -0.374 17569 7748 1 13 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.387 1.124 17569 7749 1 13 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.970 -0.969 17569 7750 1 13 . 1 1 4 4 ALA H H 158 8.382 8.382 8.210 0.172 17569 7751 1 13 . 1 1 5 5 ASP N N 159 119.418 119.418 120.127 -0.709 17569 7752 1 13 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.841 -0.251 17569 7753 1 13 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.753 0.383 17569 7754 1 13 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.863 -1.848 17569 7755 1 13 . 1 1 5 5 ASP H H 159 8.312 8.312 8.416 -0.104 17569 7756 1 13 . 1 1 6 6 LYS N N 160 121.604 121.604 120.800 0.804 17569 7757 1 13 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.514 -0.171 17569 7758 1 13 . 1 1 6 6 LYS H H 160 8.274 8.274 8.387 -0.114 17569 7759 1 13 . 1 1 7 7 ARG N N 161 121.611 121.611 121.649 -0.038 17569 7760 1 13 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.429 -0.102 17569 7761 1 13 . 1 1 7 7 ARG H H 161 8.430 8.430 8.709 -0.279 17569 7762 1 13 . 1 1 8 8 GLY N N 162 109.606 109.606 111.592 -1.986 17569 7763 1 13 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.764 0.284 17569 7764 1 13 . 1 1 8 8 GLY H H 162 8.473 8.473 8.657 -0.184 17569 7765 1 13 . 1 1 9 9 ASP N N 163 120.187 120.187 120.574 -0.387 17569 7766 1 13 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.855 -0.206 17569 7767 1 13 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.491 0.660 17569 7768 1 13 . 1 1 9 9 ASP H H 163 8.296 8.296 8.075 0.221 17569 7769 1 13 . 1 1 10 10 GLY N N 164 108.816 108.816 109.914 -1.098 17569 7770 1 13 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.310 0.057 17569 7771 1 13 . 1 1 10 10 GLY H H 164 8.458 8.458 8.332 0.126 17569 7772 1 13 . 1 1 11 11 LEU N N 165 121.195 121.195 121.962 -0.767 17569 7773 1 13 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.640 -0.324 17569 7774 1 13 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.919 0.081 17569 7775 1 13 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.960 -1.028 17569 7776 1 13 . 1 1 11 11 LEU H H 165 8.137 8.137 8.072 0.065 17569 7777 1 13 . 1 1 12 12 HIS N N 166 119.387 119.387 124.680 -5.293 17569 7778 1 13 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.783 -0.128 17569 7779 1 13 . 1 1 12 12 HIS CA C 166 56.269 56.269 56.292 -0.023 17569 7780 1 13 . 1 1 12 12 HIS CB C 166 30.697 30.697 30.273 0.424 17569 7781 1 13 . 1 1 12 12 HIS H H 166 8.270 8.270 8.907 -0.637 17569 7782 1 13 . 1 1 13 13 GLY N N 167 109.899 109.899 112.505 -2.606 17569 7783 1 13 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.764 0.341 17569 7784 1 13 . 1 1 13 13 GLY H H 167 8.276 8.276 8.352 -0.076 17569 7785 1 13 . 1 1 14 14 ILE N N 168 119.597 119.597 121.675 -2.078 17569 7786 1 13 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.331 -0.008 17569 7787 1 13 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.903 0.697 17569 7788 1 13 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.614 -2.664 17569 7789 1 13 . 1 1 14 14 ILE H H 168 7.962 7.962 8.055 -0.093 17569 7790 1 13 . 1 1 15 15 VAL N N 169 127.578 127.578 125.714 1.864 17569 7791 1 13 . 1 1 15 15 VAL HA H 169 4.280 4.280 3.958 0.322 17569 7792 1 13 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.733 -1.416 17569 7793 1 13 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.901 2.501 17569 7794 1 13 . 1 1 15 15 VAL H H 169 9.011 9.011 8.447 0.564 17569 7795 1 13 . 1 1 16 16 SER N N 170 118.596 118.596 120.539 -1.943 17569 7796 1 13 . 1 1 16 16 SER HA H 170 5.140 5.140 4.766 0.374 17569 7797 1 13 . 1 1 16 16 SER CA C 170 55.985 55.985 56.425 -0.440 17569 7798 1 13 . 1 1 16 16 SER CB C 170 65.261 65.261 65.710 -0.449 17569 7799 1 13 . 1 1 16 16 SER H H 170 8.242 8.242 7.692 0.550 17569 7800 1 13 . 1 1 17 17 CYS N N 171 123.783 123.783 122.942 0.841 17569 7801 1 13 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.164 0.017 17569 7802 1 13 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.793 -0.949 17569 7803 1 13 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.566 2.807 17569 7804 1 13 . 1 1 17 17 CYS H H 171 8.894 8.894 8.458 0.436 17569 7805 1 13 . 1 1 18 18 THR N N 172 121.703 121.703 117.635 4.068 17569 7806 1 13 . 1 1 18 18 THR HA H 172 4.386 4.386 4.121 0.265 17569 7807 1 13 . 1 1 18 18 THR CA C 172 64.667 64.667 64.086 0.581 17569 7808 1 13 . 1 1 18 18 THR CB C 172 69.498 69.498 68.905 0.593 17569 7809 1 13 . 1 1 18 18 THR H H 172 8.788 8.788 8.246 0.542 17569 7810 1 13 . 1 1 19 19 ALA N N 173 131.364 131.364 121.195 10.169 17569 7811 1 13 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.139 0.357 17569 7812 1 13 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.387 0.638 17569 7813 1 13 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.782 3.400 17569 7814 1 13 . 1 1 19 19 ALA H H 173 9.680 9.680 7.819 1.861 17569 7815 1 13 . 1 1 20 20 CYS N N 174 115.498 115.498 114.972 0.526 17569 7816 1 13 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.540 0.428 17569 7817 1 13 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.266 -1.172 17569 7818 1 13 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.012 4.232 17569 7819 1 13 . 1 1 20 20 CYS H H 174 8.470 8.470 7.573 0.897 17569 7820 1 13 . 1 1 21 21 GLY N N 175 112.464 112.464 108.329 4.135 17569 7821 1 13 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.247 0.459 17569 7822 1 13 . 1 1 21 21 GLY H H 175 7.884 7.884 7.873 0.011 17569 7823 1 13 . 1 1 22 22 GLN N N 176 121.784 121.784 117.958 3.826 17569 7824 1 13 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.493 -0.117 17569 7825 1 13 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.513 1.778 17569 7826 1 13 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.939 -2.598 17569 7827 1 13 . 1 1 22 22 GLN H H 176 8.723 8.723 7.817 0.906 17569 7828 1 13 . 1 1 23 23 GLN N N 177 122.900 122.900 122.146 0.754 17569 7829 1 13 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.310 0.220 17569 7830 1 13 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.995 -0.445 17569 7831 1 13 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.268 -0.808 17569 7832 1 13 . 1 1 23 23 GLN H H 177 8.721 8.721 8.515 0.206 17569 7833 1 13 . 1 1 24 24 VAL N N 178 121.000 121.000 124.095 -3.095 17569 7834 1 13 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.048 0.476 17569 7835 1 13 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.160 -1.283 17569 7836 1 13 . 1 1 24 24 VAL H H 178 8.689 8.689 7.871 0.818 17569 7837 1 13 . 1 1 25 25 ASN N N 179 121.392 121.392 123.312 -1.920 17569 7838 1 13 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.363 0.513 17569 7839 1 13 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.785 -2.636 17569 7840 1 13 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.582 -0.605 17569 7841 1 13 . 1 1 25 25 ASN H H 179 8.635 8.635 8.207 0.428 17569 7842 1 13 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.023 0.437 17569 7843 1 13 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.608 -1.611 17569 7844 1 13 . 1 1 27 27 PHE CB C 181 38.393 38.393 37.417 0.976 17569 7845 1 13 . 1 1 28 28 GLN N N 182 119.300 119.300 119.283 0.017 17569 7846 1 13 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.348 0.170 17569 7847 1 13 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.386 -2.044 17569 7848 1 13 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.244 0.106 17569 7849 1 13 . 1 1 28 28 GLN H H 182 7.494 7.494 7.728 -0.234 17569 7850 1 13 . 1 1 29 29 LYS N N 183 124.516 124.516 126.075 -1.559 17569 7851 1 13 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.507 -0.585 17569 7852 1 13 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.634 1.678 17569 7853 1 13 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.177 0.109 17569 7854 1 13 . 1 1 29 29 LYS H H 183 8.779 8.779 8.608 0.171 17569 7855 1 13 . 1 1 30 30 ASP N N 184 116.500 116.500 118.078 -1.578 17569 7856 1 13 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.795 -0.336 17569 7857 1 13 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.873 -0.337 17569 7858 1 13 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.896 -0.925 17569 7859 1 13 . 1 1 30 30 ASP H H 184 8.556 8.556 7.975 0.581 17569 7860 1 13 . 1 1 31 31 SER N N 185 111.505 111.505 115.313 -3.808 17569 7861 1 13 . 1 1 31 31 SER HA H 185 4.695 4.695 4.712 -0.017 17569 7862 1 13 . 1 1 31 31 SER CA C 185 59.747 59.747 58.663 1.084 17569 7863 1 13 . 1 1 31 31 SER CB C 185 65.198 65.198 63.373 1.825 17569 7864 1 13 . 1 1 31 31 SER H H 185 7.933 7.933 8.609 -0.676 17569 7865 1 13 . 1 1 32 32 ILE N N 186 113.394 113.394 116.678 -3.284 17569 7866 1 13 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.040 -0.153 17569 7867 1 13 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.283 -0.704 17569 7868 1 13 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.255 1.557 17569 7869 1 13 . 1 1 32 32 ILE H H 186 7.105 7.105 7.596 -0.491 17569 7870 1 13 . 1 1 33 33 TYR N N 187 119.098 119.098 120.960 -1.862 17569 7871 1 13 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.242 -0.719 17569 7872 1 13 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.213 1.047 17569 7873 1 13 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.692 1.748 17569 7874 1 13 . 1 1 33 33 TYR H H 187 8.954 8.954 7.713 1.241 17569 7875 1 13 . 1 1 34 34 ARG N N 188 118.502 118.502 122.661 -4.159 17569 7876 1 13 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.726 -0.089 17569 7877 1 13 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.314 -1.562 17569 7878 1 13 . 1 1 34 34 ARG CB C 188 31.251 31.251 29.807 1.444 17569 7879 1 13 . 1 1 34 34 ARG H H 188 8.412 8.412 8.641 -0.229 17569 7880 1 13 . 1 1 35 35 HIS N N 189 126.596 126.596 127.262 -0.666 17569 7881 1 13 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.925 -0.333 17569 7882 1 13 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.108 -0.387 17569 7883 1 13 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.111 1.361 17569 7884 1 13 . 1 1 35 35 HIS H H 189 9.813 9.813 9.104 0.709 17569 7885 1 13 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.583 -0.285 17569 7886 1 13 . 1 1 36 36 PRO CA C 190 65.276 65.276 65.089 0.187 17569 7887 1 13 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.041 0.811 17569 7888 1 13 . 1 1 37 37 SER N N 191 110.003 110.003 113.686 -3.683 17569 7889 1 13 . 1 1 37 37 SER HA H 191 4.918 4.918 4.311 0.607 17569 7890 1 13 . 1 1 37 37 SER CA C 191 59.031 59.031 61.505 -2.474 17569 7891 1 13 . 1 1 37 37 SER CB C 191 65.104 65.104 63.261 1.843 17569 7892 1 13 . 1 1 37 37 SER H H 191 8.934 8.934 8.637 0.297 17569 7893 1 13 . 1 1 38 38 LEU N N 192 120.959 120.959 114.772 6.187 17569 7894 1 13 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.975 -0.846 17569 7895 1 13 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.130 2.016 17569 7896 1 13 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.286 1.710 17569 7897 1 13 . 1 1 38 38 LEU H H 192 8.649 8.649 6.986 1.663 17569 7898 1 13 . 1 1 39 39 GLN N N 193 108.600 108.600 118.973 -10.373 17569 7899 1 13 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.090 -0.185 17569 7900 1 13 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.577 0.237 17569 7901 1 13 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.881 -1.847 17569 7902 1 13 . 1 1 39 39 GLN H H 193 8.465 8.465 7.791 0.674 17569 7903 1 13 . 1 1 40 40 VAL N N 194 105.325 105.325 118.434 -13.109 17569 7904 1 13 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.490 0.060 17569 7905 1 13 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.035 -1.394 17569 7906 1 13 . 1 1 40 40 VAL H H 194 6.256 6.256 7.825 -1.569 17569 7907 1 13 . 1 1 41 41 LEU N N 195 123.100 123.100 122.225 0.875 17569 7908 1 13 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.800 0.016 17569 7909 1 13 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.645 3.537 17569 7910 1 13 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.402 0.168 17569 7911 1 13 . 1 1 41 41 LEU H H 195 9.154 9.154 8.498 0.656 17569 7912 1 13 . 1 1 42 42 ILE N N 196 124.396 124.396 117.401 6.995 17569 7913 1 13 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.841 1.511 17569 7914 1 13 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.194 1.036 17569 7915 1 13 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.923 1.347 17569 7916 1 13 . 1 1 42 42 ILE H H 196 9.766 9.766 7.824 1.942 17569 7917 1 13 . 1 1 43 43 CYS N N 197 121.500 121.500 114.904 6.596 17569 7918 1 13 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.263 -0.001 17569 7919 1 13 . 1 1 43 43 CYS CA C 197 56.703 56.703 55.956 0.747 17569 7920 1 13 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.011 2.289 17569 7921 1 13 . 1 1 43 43 CYS H H 197 9.882 9.882 8.318 1.564 17569 7922 1 13 . 1 1 44 44 LYS N N 198 117.995 117.995 122.094 -4.099 17569 7923 1 13 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.142 -0.153 17569 7924 1 13 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.313 -0.653 17569 7925 1 13 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.468 0.232 17569 7926 1 13 . 1 1 44 44 LYS H H 198 8.089 8.089 8.762 -0.673 17569 7927 1 13 . 1 1 45 45 ASN N N 199 119.200 119.200 117.449 1.751 17569 7928 1 13 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.572 -0.058 17569 7929 1 13 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.406 0.314 17569 7930 1 13 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.305 -0.138 17569 7931 1 13 . 1 1 45 45 ASN H H 199 8.356 8.356 8.634 -0.278 17569 7932 1 13 . 1 1 46 46 CYS N N 200 126.600 126.600 118.382 8.218 17569 7933 1 13 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.031 0.150 17569 7934 1 13 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.155 2.340 17569 7935 1 13 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.158 2.024 17569 7936 1 13 . 1 1 46 46 CYS H H 200 9.189 9.189 7.905 1.284 17569 7937 1 13 . 1 1 47 47 PHE N N 201 121.962 121.962 120.575 1.387 17569 7938 1 13 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.167 -0.297 17569 7939 1 13 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.437 1.833 17569 7940 1 13 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.570 0.597 17569 7941 1 13 . 1 1 47 47 PHE H H 201 8.826 8.826 7.758 1.068 17569 7942 1 13 . 1 1 48 48 LYS N N 202 117.400 117.400 120.077 -2.677 17569 7943 1 13 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.875 -0.177 17569 7944 1 13 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.321 -1.369 17569 7945 1 13 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.327 -0.785 17569 7946 1 13 . 1 1 48 48 LYS H H 202 8.512 8.512 8.115 0.397 17569 7947 1 13 . 1 1 49 49 TYR N N 203 120.400 120.400 120.076 0.324 17569 7948 1 13 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.205 0.209 17569 7949 1 13 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.775 -1.003 17569 7950 1 13 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.561 -0.115 17569 7951 1 13 . 1 1 49 49 TYR H H 203 8.133 8.133 7.629 0.504 17569 7952 1 13 . 1 1 50 50 TYR N N 204 121.783 121.783 117.836 3.947 17569 7953 1 13 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.696 -1.201 17569 7954 1 13 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.046 2.904 17569 7955 1 13 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.600 0.892 17569 7956 1 13 . 1 1 50 50 TYR H H 204 8.765 8.765 7.534 1.231 17569 7957 1 13 . 1 1 51 51 MET N N 205 110.800 110.800 115.977 -5.177 17569 7958 1 13 . 1 1 51 51 MET HA H 205 4.349 4.349 4.163 0.186 17569 7959 1 13 . 1 1 51 51 MET CA C 205 53.505 53.505 58.162 -4.657 17569 7960 1 13 . 1 1 51 51 MET CB C 205 30.384 30.384 33.236 -2.852 17569 7961 1 13 . 1 1 51 51 MET H H 205 7.771 7.771 8.552 -0.781 17569 7962 1 13 . 1 1 52 52 SER N N 206 116.800 116.800 112.627 4.173 17569 7963 1 13 . 1 1 52 52 SER HA H 206 3.919 3.919 4.345 -0.426 17569 7964 1 13 . 1 1 52 52 SER CA C 206 61.621 61.621 59.635 1.986 17569 7965 1 13 . 1 1 52 52 SER CB C 206 62.611 62.611 64.016 -1.405 17569 7966 1 13 . 1 1 52 52 SER H H 206 7.581 7.581 8.269 -0.688 17569 7967 1 13 . 1 1 53 53 ASP N N 207 117.400 117.400 120.889 -3.489 17569 7968 1 13 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.816 -0.244 17569 7969 1 13 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.513 -0.414 17569 7970 1 13 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.069 0.119 17569 7971 1 13 . 1 1 53 53 ASP H H 207 7.085 7.085 8.088 -1.003 17569 7972 1 13 . 1 1 54 54 ASP N N 208 119.405 119.405 122.627 -3.222 17569 7973 1 13 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.974 -0.585 17569 7974 1 13 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.345 0.555 17569 7975 1 13 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.079 -1.730 17569 7976 1 13 . 1 1 54 54 ASP H H 208 8.439 8.439 8.442 -0.003 17569 7977 1 13 . 1 1 55 55 ILE N N 209 124.698 124.698 120.406 4.292 17569 7978 1 13 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.429 -0.429 17569 7979 1 13 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.255 2.023 17569 7980 1 13 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.437 0.854 17569 7981 1 13 . 1 1 55 55 ILE H H 209 8.128 8.128 8.419 -0.291 17569 7982 1 13 . 1 1 56 56 SER N N 210 126.703 126.703 120.338 6.365 17569 7983 1 13 . 1 1 56 56 SER HA H 210 4.365 4.365 4.780 -0.415 17569 7984 1 13 . 1 1 56 56 SER CA C 210 57.769 57.769 57.507 0.262 17569 7985 1 13 . 1 1 56 56 SER CB C 210 64.991 64.991 64.506 0.485 17569 7986 1 13 . 1 1 56 56 SER H H 210 8.815 8.815 8.699 0.116 17569 7987 1 13 . 1 1 57 57 ARG N N 211 116.885 116.885 120.066 -3.181 17569 7988 1 13 . 1 1 57 57 ARG HA H 211 5.042 5.042 5.044 -0.002 17569 7989 1 13 . 1 1 57 57 ARG CA C 211 54.400 54.400 54.913 -0.513 17569 7990 1 13 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.189 3.095 17569 7991 1 13 . 1 1 57 57 ARG H H 211 8.365 8.365 8.474 -0.109 17569 7992 1 13 . 1 1 58 58 ASP N N 212 121.982 121.982 124.955 -2.973 17569 7993 1 13 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.510 0.105 17569 7994 1 13 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.523 -2.301 17569 7995 1 13 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.184 -0.682 17569 7996 1 13 . 1 1 58 58 ASP H H 212 8.706 8.706 8.327 0.379 17569 7997 1 13 . 1 1 59 59 SER N N 213 114.164 114.164 115.902 -1.738 17569 7998 1 13 . 1 1 59 59 SER HA H 213 4.212 4.212 4.170 0.042 17569 7999 1 13 . 1 1 59 59 SER CA C 213 60.840 60.840 60.935 -0.095 17569 8000 1 13 . 1 1 59 59 SER CB C 213 62.714 62.714 63.434 -0.720 17569 8001 1 13 . 1 1 59 59 SER H H 213 8.687 8.687 8.772 -0.085 17569 8002 1 13 . 1 1 60 60 ASP N N 214 120.899 120.899 119.109 1.790 17569 8003 1 13 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.683 0.142 17569 8004 1 13 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.136 1.075 17569 8005 1 13 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.253 1.305 17569 8006 1 13 . 1 1 60 60 ASP H H 214 8.193 8.193 7.780 0.413 17569 8007 1 13 . 1 1 61 61 GLY N N 215 108.300 108.300 108.061 0.239 17569 8008 1 13 . 1 1 61 61 GLY CA C 215 45.397 45.397 46.020 -0.623 17569 8009 1 13 . 1 1 61 61 GLY H H 215 8.234 8.234 8.156 0.078 17569 8010 1 13 . 1 1 62 62 MET N N 216 120.002 120.002 117.012 2.990 17569 8011 1 13 . 1 1 62 62 MET HA H 216 4.972 4.972 4.504 0.468 17569 8012 1 13 . 1 1 62 62 MET CA C 216 53.151 53.151 54.790 -1.639 17569 8013 1 13 . 1 1 62 62 MET CB C 216 32.311 32.311 35.320 -3.009 17569 8014 1 13 . 1 1 62 62 MET H H 216 8.376 8.376 7.228 1.148 17569 8015 1 13 . 1 1 63 63 ASP N N 217 127.300 127.300 119.432 7.868 17569 8016 1 13 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.737 0.229 17569 8017 1 13 . 1 1 63 63 ASP CA C 217 55.569 55.569 53.769 1.800 17569 8018 1 13 . 1 1 63 63 ASP H H 217 9.368 9.368 8.607 0.761 17569 8019 1 13 . 1 1 64 64 GLU N N 218 114.400 114.400 126.212 -11.812 17569 8020 1 13 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.460 -0.304 17569 8021 1 13 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.763 0.087 17569 8022 1 13 . 1 1 64 64 GLU H H 218 8.583 8.583 8.492 0.091 17569 8023 1 13 . 1 1 65 65 GLN N N 219 115.500 115.500 117.024 -1.524 17569 8024 1 13 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.459 -0.148 17569 8025 1 13 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.061 0.285 17569 8026 1 13 . 1 1 65 65 GLN H H 219 7.158 7.158 7.612 -0.454 17569 8027 1 13 . 1 1 66 66 CYS N N 220 122.600 122.600 117.948 4.652 17569 8028 1 13 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.191 -1.114 17569 8029 1 13 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.346 1.183 17569 8030 1 13 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.450 1.522 17569 8031 1 13 . 1 1 66 66 CYS H H 220 8.248 8.248 8.359 -0.111 17569 8032 1 13 . 1 1 67 67 ARG N N 221 130.363 130.363 124.322 6.041 17569 8033 1 13 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.400 -0.333 17569 8034 1 13 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.468 -2.452 17569 8035 1 13 . 1 1 67 67 ARG H H 221 9.145 9.145 8.509 0.636 17569 8036 1 13 . 1 1 68 68 TRP N N 222 124.200 124.200 120.486 3.714 17569 8037 1 13 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.700 -0.264 17569 8038 1 13 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.538 0.542 17569 8039 1 13 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.375 0.819 17569 8040 1 13 . 1 1 68 68 TRP H H 222 9.689 9.689 8.159 1.530 17569 8041 1 13 . 1 1 69 69 CYS N N 223 116.297 116.297 111.288 5.009 17569 8042 1 13 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.069 0.022 17569 8043 1 13 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.462 2.640 17569 8044 1 13 . 1 1 69 69 CYS CB C 223 32.338 32.338 26.835 5.503 17569 8045 1 13 . 1 1 69 69 CYS H H 223 8.822 8.822 7.814 1.008 17569 8046 1 13 . 1 1 70 70 ALA N N 224 123.112 123.112 123.226 -0.114 17569 8047 1 13 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.243 0.163 17569 8048 1 13 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.446 -0.594 17569 8049 1 13 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.629 0.091 17569 8050 1 13 . 1 1 70 70 ALA H H 224 8.787 8.787 8.097 0.690 17569 8051 1 13 . 1 1 71 71 GLU N N 225 118.300 118.300 120.464 -2.164 17569 8052 1 13 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.449 0.859 17569 8053 1 13 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.697 -2.398 17569 8054 1 13 . 1 1 71 71 GLU H H 225 8.541 8.541 8.178 0.362 17569 8055 1 13 . 1 1 72 72 GLY N N 226 111.995 111.995 109.966 2.029 17569 8056 1 13 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.581 -0.178 17569 8057 1 13 . 1 1 72 72 GLY H H 226 9.837 9.837 8.455 1.382 17569 8058 1 13 . 1 1 73 73 GLY N N 227 106.600 106.600 107.249 -0.649 17569 8059 1 13 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.004 0.967 17569 8060 1 13 . 1 1 73 73 GLY H H 227 7.772 7.772 8.281 -0.509 17569 8061 1 13 . 1 1 74 74 ASN N N 228 124.277 124.277 119.142 5.135 17569 8062 1 13 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.461 0.620 17569 8063 1 13 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.821 -0.721 17569 8064 1 13 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.322 -0.238 17569 8065 1 13 . 1 1 74 74 ASN H H 228 8.876 8.876 8.527 0.349 17569 8066 1 13 . 1 1 75 75 LEU N N 229 123.050 123.050 121.814 1.236 17569 8067 1 13 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.854 -0.255 17569 8068 1 13 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.407 0.955 17569 8069 1 13 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.307 0.193 17569 8070 1 13 . 1 1 75 75 LEU H H 229 8.901 8.901 8.018 0.883 17569 8071 1 13 . 1 1 76 76 ILE N N 230 123.552 123.552 123.089 0.463 17569 8072 1 13 . 1 1 76 76 ILE HA H 230 4.485 4.485 3.990 0.495 17569 8073 1 13 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.699 -0.999 17569 8074 1 13 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.332 -0.933 17569 8075 1 13 . 1 1 76 76 ILE H H 230 9.406 9.406 9.153 0.253 17569 8076 1 13 . 1 1 77 77 CYS N N 231 124.637 124.637 127.204 -2.567 17569 8077 1 13 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.372 -0.497 17569 8078 1 13 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.392 -0.032 17569 8079 1 13 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.781 0.653 17569 8080 1 13 . 1 1 77 77 CYS H H 231 8.809 8.809 8.519 0.290 17569 8081 1 13 . 1 1 78 78 CYS N N 232 125.697 125.697 125.482 0.215 17569 8082 1 13 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.958 -0.674 17569 8083 1 13 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.201 3.683 17569 8084 1 13 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.565 1.605 17569 8085 1 13 . 1 1 78 78 CYS H H 232 8.579 8.579 8.673 -0.094 17569 8086 1 13 . 1 1 79 79 ASP N N 233 123.600 123.600 125.368 -1.768 17569 8087 1 13 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.720 0.037 17569 8088 1 13 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.422 2.567 17569 8089 1 13 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.672 0.958 17569 8090 1 13 . 1 1 79 79 ASP H H 233 8.577 8.577 8.294 0.283 17569 8091 1 13 . 1 1 80 80 PHE N N 234 122.100 122.100 116.719 5.381 17569 8092 1 13 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.590 -0.064 17569 8093 1 13 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.247 1.662 17569 8094 1 13 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.197 1.652 17569 8095 1 13 . 1 1 80 80 PHE H H 234 10.432 10.432 7.451 2.981 17569 8096 1 13 . 1 1 81 81 CYS N N 235 124.300 124.300 117.677 6.623 17569 8097 1 13 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.663 0.493 17569 8098 1 13 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.943 0.102 17569 8099 1 13 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.834 3.573 17569 8100 1 13 . 1 1 81 81 CYS H H 235 8.476 8.476 8.038 0.438 17569 8101 1 13 . 1 1 82 82 HIS N N 236 112.598 112.598 118.385 -5.787 17569 8102 1 13 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.161 0.822 17569 8103 1 13 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.605 -1.207 17569 8104 1 13 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.950 2.307 17569 8105 1 13 . 1 1 82 82 HIS H H 236 6.699 6.699 8.217 -1.518 17569 8106 1 13 . 1 1 83 83 ASN N N 237 123.600 123.600 118.798 4.802 17569 8107 1 13 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.879 -0.078 17569 8108 1 13 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.345 2.271 17569 8109 1 13 . 1 1 83 83 ASN H H 237 9.097 9.097 8.047 1.050 17569 8110 1 13 . 1 1 84 84 ALA N N 238 122.000 122.000 123.934 -1.934 17569 8111 1 13 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.427 -0.018 17569 8112 1 13 . 1 1 84 84 ALA CA C 238 50.364 50.364 49.956 0.408 17569 8113 1 13 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.176 2.894 17569 8114 1 13 . 1 1 84 84 ALA H H 238 9.885 9.885 8.936 0.949 17569 8115 1 13 . 1 1 85 85 PHE N N 239 116.707 116.707 121.382 -4.675 17569 8116 1 13 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.135 0.893 17569 8117 1 13 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.672 -0.455 17569 8118 1 13 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.014 1.650 17569 8119 1 13 . 1 1 85 85 PHE H H 239 9.450 9.450 9.247 0.203 17569 8120 1 13 . 1 1 86 86 CYS N N 240 126.682 126.682 124.782 1.900 17569 8121 1 13 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.804 0.818 17569 8122 1 13 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.834 -0.492 17569 8123 1 13 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.157 3.100 17569 8124 1 13 . 1 1 86 86 CYS H H 240 11.309 11.309 9.440 1.869 17569 8125 1 13 . 1 1 87 87 LYS N N 241 117.865 117.865 124.112 -6.247 17569 8126 1 13 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.911 -0.062 17569 8127 1 13 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.264 -0.194 17569 8128 1 13 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.480 0.318 17569 8129 1 13 . 1 1 87 87 LYS H H 241 8.230 8.230 8.770 -0.540 17569 8130 1 13 . 1 1 88 88 LYS N N 242 117.949 117.949 118.524 -0.575 17569 8131 1 13 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.114 -0.136 17569 8132 1 13 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.978 1.392 17569 8133 1 13 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.983 0.333 17569 8134 1 13 . 1 1 88 88 LYS H H 242 7.945 7.945 8.515 -0.570 17569 8135 1 13 . 1 1 89 89 CYS N N 243 125.305 125.305 117.430 7.875 17569 8136 1 13 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.274 -0.532 17569 8137 1 13 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.857 1.970 17569 8138 1 13 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.074 1.167 17569 8139 1 13 . 1 1 89 89 CYS H H 243 9.297 9.297 7.591 1.706 17569 8140 1 13 . 1 1 90 90 ILE N N 244 119.687 119.687 121.443 -1.756 17569 8141 1 13 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.943 -0.336 17569 8142 1 13 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.847 0.103 17569 8143 1 13 . 1 1 90 90 ILE H H 244 7.997 7.997 7.631 0.366 17569 8144 1 13 . 1 1 91 91 LEU N N 245 120.280 120.280 121.158 -0.878 17569 8145 1 13 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.405 -0.720 17569 8146 1 13 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.585 0.650 17569 8147 1 13 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.012 -0.054 17569 8148 1 13 . 1 1 91 91 LEU H H 245 8.810 8.810 8.744 0.066 17569 8149 1 13 . 1 1 92 92 ARG N N 246 116.901 116.901 117.322 -0.421 17569 8150 1 13 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.129 -0.312 17569 8151 1 13 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.379 0.601 17569 8152 1 13 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.284 0.316 17569 8153 1 13 . 1 1 92 92 ARG H H 246 8.086 8.086 7.670 0.416 17569 8154 1 13 . 1 1 93 93 ASN N N 247 111.200 111.200 116.347 -5.147 17569 8155 1 13 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.527 0.076 17569 8156 1 13 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.837 0.971 17569 8157 1 13 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.036 3.448 17569 8158 1 13 . 1 1 93 93 ASN H H 247 7.136 7.136 8.171 -1.035 17569 8159 1 13 . 1 1 94 94 LEU N N 248 118.807 118.807 117.437 1.370 17569 8160 1 13 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.519 0.295 17569 8161 1 13 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.169 0.020 17569 8162 1 13 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.637 0.061 17569 8163 1 13 . 1 1 94 94 LEU H H 248 8.515 8.515 7.946 0.569 17569 8164 1 13 . 1 1 95 95 GLY N N 249 108.000 108.000 105.621 2.379 17569 8165 1 13 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.696 -0.068 17569 8166 1 13 . 1 1 95 95 GLY H H 249 7.955 7.955 7.838 0.117 17569 8167 1 13 . 1 1 96 96 ARG N N 250 117.797 117.797 122.201 -4.404 17569 8168 1 13 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.226 -0.383 17569 8169 1 13 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.320 0.362 17569 8170 1 13 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.155 -0.295 17569 8171 1 13 . 1 1 96 96 ARG H H 250 8.559 8.559 8.608 -0.049 17569 8172 1 13 . 1 1 97 97 LYS N N 251 120.900 120.900 119.619 1.281 17569 8173 1 13 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.030 0.126 17569 8174 1 13 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.425 -0.269 17569 8175 1 13 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.747 -0.387 17569 8176 1 13 . 1 1 97 97 LYS H H 251 8.655 8.655 8.588 0.067 17569 8177 1 13 . 1 1 98 98 GLU N N 252 122.000 122.000 119.147 2.853 17569 8178 1 13 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.065 0.286 17569 8179 1 13 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.428 -0.846 17569 8180 1 13 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.431 -1.031 17569 8181 1 13 . 1 1 98 98 GLU H H 252 7.705 7.705 8.363 -0.658 17569 8182 1 13 . 1 1 99 99 LEU N N 253 117.400 117.400 120.934 -3.534 17569 8183 1 13 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.794 0.123 17569 8184 1 13 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.167 -0.169 17569 8185 1 13 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.859 -0.377 17569 8186 1 13 . 1 1 99 99 LEU H H 253 7.285 7.285 7.642 -0.357 17569 8187 1 13 . 1 1 100 100 SER N N 254 112.100 112.100 113.681 -1.581 17569 8188 1 13 . 1 1 100 100 SER HA H 254 4.107 4.107 4.135 -0.028 17569 8189 1 13 . 1 1 100 100 SER CA C 254 61.603 61.603 61.721 -0.118 17569 8190 1 13 . 1 1 100 100 SER CB C 254 62.622 62.622 63.092 -0.470 17569 8191 1 13 . 1 1 100 100 SER H H 254 8.326 8.326 8.023 0.303 17569 8192 1 13 . 1 1 101 101 THR N N 255 118.151 118.151 118.332 -0.181 17569 8193 1 13 . 1 1 101 101 THR HA H 255 4.026 4.026 4.084 -0.058 17569 8194 1 13 . 1 1 101 101 THR CA C 255 66.261 66.261 66.687 -0.426 17569 8195 1 13 . 1 1 101 101 THR CB C 255 68.735 68.735 68.881 -0.146 17569 8196 1 13 . 1 1 101 101 THR H H 255 7.972 7.972 7.884 0.088 17569 8197 1 13 . 1 1 102 102 ILE N N 256 120.100 120.100 122.797 -2.697 17569 8198 1 13 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.861 -0.398 17569 8199 1 13 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.749 0.025 17569 8200 1 13 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.372 0.369 17569 8201 1 13 . 1 1 102 102 ILE H H 256 7.868 7.868 8.690 -0.822 17569 8202 1 13 . 1 1 103 103 MET N N 257 114.876 114.876 116.173 -1.297 17569 8203 1 13 . 1 1 103 103 MET HA H 257 4.211 4.211 4.075 0.136 17569 8204 1 13 . 1 1 103 103 MET CA C 257 55.691 55.691 58.325 -2.634 17569 8205 1 13 . 1 1 103 103 MET CB C 257 32.000 32.000 32.629 -0.629 17569 8206 1 13 . 1 1 103 103 MET H H 257 7.606 7.606 7.252 0.354 17569 8207 1 13 . 1 1 104 104 ASP N N 258 119.976 119.976 118.728 1.248 17569 8208 1 13 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.772 -0.234 17569 8209 1 13 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.686 1.226 17569 8210 1 13 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.639 0.861 17569 8211 1 13 . 1 1 104 104 ASP H H 258 7.444 7.444 7.650 -0.206 17569 8212 1 13 . 1 1 105 105 GLU N N 259 124.388 124.388 121.828 2.560 17569 8213 1 13 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.544 -0.257 17569 8214 1 13 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.529 2.042 17569 8215 1 13 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.995 -0.453 17569 8216 1 13 . 1 1 105 105 GLU H H 259 8.559 8.559 8.139 0.420 17569 8217 1 13 . 1 1 106 106 ASN N N 260 117.201 117.201 116.746 0.455 17569 8218 1 13 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.415 0.327 17569 8219 1 13 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.113 -0.370 17569 8220 1 13 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.692 1.226 17569 8221 1 13 . 1 1 106 106 ASN H H 260 8.673 8.673 8.731 -0.058 17569 8222 1 13 . 1 1 107 107 ASN N N 261 117.900 117.900 112.089 5.811 17569 8223 1 13 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.303 0.682 17569 8224 1 13 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.551 -2.249 17569 8225 1 13 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.474 3.140 17569 8226 1 13 . 1 1 107 107 ASN H H 261 7.956 7.956 8.712 -0.756 17569 8227 1 13 . 1 1 108 108 GLN N N 262 121.500 121.500 115.203 6.297 17569 8228 1 13 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.147 0.461 17569 8229 1 13 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.562 1.214 17569 8230 1 13 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.831 0.727 17569 8231 1 13 . 1 1 108 108 GLN H H 262 8.493 8.493 7.842 0.651 17569 8232 1 13 . 1 1 109 109 TRP N N 263 128.056 128.056 124.018 4.038 17569 8233 1 13 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.949 0.022 17569 8234 1 13 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.369 0.728 17569 8235 1 13 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.741 0.752 17569 8236 1 13 . 1 1 109 109 TRP H H 263 10.497 10.497 8.150 2.347 17569 8237 1 13 . 1 1 110 110 TYR N N 264 126.600 126.600 125.547 1.053 17569 8238 1 13 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.295 0.107 17569 8239 1 13 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.522 -2.851 17569 8240 1 13 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.801 -0.793 17569 8241 1 13 . 1 1 110 110 TYR H H 264 7.545 7.545 8.068 -0.523 17569 8242 1 13 . 1 1 111 111 CYS N N 265 124.622 124.622 114.406 10.216 17569 8243 1 13 . 1 1 111 111 CYS H H 265 8.586 8.586 8.091 0.495 17569 8244 1 13 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.804 -0.612 17569 8245 1 13 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.781 0.934 17569 8246 1 13 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.651 1.269 17569 8247 1 13 . 1 1 113 113 ILE N N 267 119.504 119.504 119.776 -0.272 17569 8248 1 13 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.708 -0.758 17569 8249 1 13 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.970 0.279 17569 8250 1 13 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.593 -3.060 17569 8251 1 13 . 1 1 113 113 ILE H H 267 9.160 9.160 7.497 1.663 17569 8252 1 13 . 1 1 114 114 CYS N N 268 124.100 124.100 118.380 5.720 17569 8253 1 13 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.168 -0.354 17569 8254 1 13 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.677 3.623 17569 8255 1 13 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.093 2.627 17569 8256 1 13 . 1 1 114 114 CYS H H 268 7.818 7.818 8.244 -0.426 17569 8257 1 13 . 1 1 115 115 HIS N N 269 117.127 117.127 111.280 5.847 17569 8258 1 13 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.652 0.477 17569 8259 1 13 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.003 -0.842 17569 8260 1 13 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.849 2.344 17569 8261 1 13 . 1 1 115 115 HIS H H 269 8.953 8.953 7.784 1.169 17569 8262 1 13 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.440 0.502 17569 8263 1 13 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.448 -0.140 17569 8264 1 13 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.683 0.959 17569 8265 1 13 . 1 1 117 117 GLU N N 271 123.504 123.504 123.276 0.228 17569 8266 1 13 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.399 -0.379 17569 8267 1 13 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.677 4.192 17569 8268 1 13 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.123 -2.072 17569 8269 1 13 . 1 1 117 117 GLU H H 271 8.402 8.402 8.118 0.284 17569 8270 1 13 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.563 -0.021 17569 8271 1 13 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.635 1.724 17569 8272 1 13 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.327 0.815 17569 8273 1 13 . 1 1 119 119 LEU N N 273 112.296 112.296 114.471 -2.175 17569 8274 1 13 . 1 1 119 119 LEU HA H 273 4.474 4.474 5.068 -0.594 17569 8275 1 13 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.625 -0.083 17569 8276 1 13 . 1 1 119 119 LEU H H 273 8.090 8.090 7.397 0.693 17569 8277 1 13 . 1 1 120 120 LEU N N 274 121.388 121.388 124.451 -3.063 17569 8278 1 13 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.968 0.059 17569 8279 1 13 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.432 -0.132 17569 8280 1 13 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.368 0.731 17569 8281 1 13 . 1 1 120 120 LEU H H 274 7.823 7.823 8.542 -0.719 17569 8282 1 13 . 1 1 121 121 ASP N N 275 118.600 118.600 117.965 0.635 17569 8283 1 13 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.337 0.204 17569 8284 1 13 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.161 0.542 17569 8285 1 13 . 1 1 121 121 ASP CB C 275 39.443 39.443 39.425 0.018 17569 8286 1 13 . 1 1 121 121 ASP H H 275 8.694 8.694 8.742 -0.048 17569 8287 1 13 . 1 1 122 122 LEU N N 276 123.192 123.192 121.062 2.130 17569 8288 1 13 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.058 0.334 17569 8289 1 13 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.873 0.098 17569 8290 1 13 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.009 0.533 17569 8291 1 13 . 1 1 122 122 LEU H H 276 8.013 8.013 7.193 0.820 17569 8292 1 13 . 1 1 123 123 VAL N N 277 126.898 126.898 119.194 7.704 17569 8293 1 13 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.673 0.182 17569 8294 1 13 . 1 1 123 123 VAL CA C 277 66.663 66.663 67.011 -0.348 17569 8295 1 13 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.568 0.490 17569 8296 1 13 . 1 1 123 123 VAL H H 277 8.781 8.781 7.993 0.788 17569 8297 1 13 . 1 1 124 124 THR N N 278 117.500 117.500 116.787 0.713 17569 8298 1 13 . 1 1 124 124 THR HA H 278 4.030 4.030 3.879 0.151 17569 8299 1 13 . 1 1 124 124 THR CA C 278 66.589 66.589 67.390 -0.801 17569 8300 1 13 . 1 1 124 124 THR CB C 278 68.410 68.410 68.521 -0.111 17569 8301 1 13 . 1 1 124 124 THR H H 278 8.722 8.722 8.412 0.310 17569 8302 1 13 . 1 1 125 125 ALA N N 279 124.700 124.700 123.933 0.767 17569 8303 1 13 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.042 0.219 17569 8304 1 13 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.089 0.207 17569 8305 1 13 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.809 0.140 17569 8306 1 13 . 1 1 125 125 ALA H H 279 8.239 8.239 8.105 0.134 17569 8307 1 13 . 1 1 126 126 CYS N N 280 119.276 119.276 117.990 1.286 17569 8308 1 13 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.893 0.221 17569 8309 1 13 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.364 -1.261 17569 8310 1 13 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.253 -0.757 17569 8311 1 13 . 1 1 126 126 CYS H H 280 8.128 8.128 7.692 0.436 17569 8312 1 13 . 1 1 127 127 ASN N N 281 118.000 118.000 118.526 -0.526 17569 8313 1 13 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.548 0.012 17569 8314 1 13 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.963 -0.824 17569 8315 1 13 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.449 -1.484 17569 8316 1 13 . 1 1 127 127 ASN H H 281 8.725 8.725 7.900 0.825 17569 8317 1 13 . 1 1 128 128 SER N N 282 116.601 116.601 116.825 -0.224 17569 8318 1 13 . 1 1 128 128 SER HA H 282 4.363 4.363 4.212 0.151 17569 8319 1 13 . 1 1 128 128 SER CA C 282 61.899 61.899 61.493 0.406 17569 8320 1 13 . 1 1 128 128 SER CB C 282 62.630 62.630 63.093 -0.463 17569 8321 1 13 . 1 1 128 128 SER H H 282 8.542 8.542 7.896 0.646 17569 8322 1 13 . 1 1 129 129 VAL N N 283 123.272 123.272 121.965 1.307 17569 8323 1 13 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.479 0.198 17569 8324 1 13 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.393 0.115 17569 8325 1 13 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.444 -0.226 17569 8326 1 13 . 1 1 129 129 VAL H H 283 7.990 7.990 8.156 -0.166 17569 8327 1 13 . 1 1 130 130 PHE N N 284 118.594 118.594 118.782 -0.188 17569 8328 1 13 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.244 -0.231 17569 8329 1 13 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.332 2.168 17569 8330 1 13 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.472 0.524 17569 8331 1 13 . 1 1 130 130 PHE H H 284 8.190 8.190 7.935 0.255 17569 8332 1 13 . 1 1 131 131 GLU N N 285 120.905 120.905 120.686 0.219 17569 8333 1 13 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.036 0.169 17569 8334 1 13 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.680 -0.466 17569 8335 1 13 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.604 -0.104 17569 8336 1 13 . 1 1 131 131 GLU H H 285 8.699 8.699 8.607 0.092 17569 8337 1 13 . 1 1 132 132 ASN N N 286 117.997 117.997 117.834 0.163 17569 8338 1 13 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.654 -0.059 17569 8339 1 13 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.586 0.029 17569 8340 1 13 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.665 0.187 17569 8341 1 13 . 1 1 132 132 ASN H H 286 8.082 8.082 8.218 -0.136 17569 8342 1 13 . 1 1 133 133 LEU N N 287 120.800 120.800 121.620 -0.820 17569 8343 1 13 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.341 -0.224 17569 8344 1 13 . 1 1 133 133 LEU CA C 287 57.798 57.798 57.984 -0.186 17569 8345 1 13 . 1 1 133 133 LEU H H 287 7.904 7.904 8.132 -0.228 17569 8346 1 13 . 1 1 134 134 GLU N N 288 118.200 118.200 118.815 -0.615 17569 8347 1 13 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.903 0.176 17569 8348 1 13 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.111 -1.114 17569 8349 1 13 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.275 -0.033 17569 8350 1 13 . 1 1 134 134 GLU H H 288 8.157 8.157 8.077 0.080 17569 8351 1 13 . 1 1 135 135 GLN N N 289 117.400 117.400 118.412 -1.012 17569 8352 1 13 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.109 0.065 17569 8353 1 13 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.737 -0.748 17569 8354 1 13 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.089 -0.009 17569 8355 1 13 . 1 1 135 135 GLN H H 289 7.869 7.869 7.936 -0.067 17569 8356 1 13 . 1 1 136 136 LEU N N 290 121.000 121.000 120.489 0.511 17569 8357 1 13 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.844 0.329 17569 8358 1 13 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.770 -0.632 17569 8359 1 13 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.508 0.492 17569 8360 1 13 . 1 1 136 136 LEU H H 290 7.968 7.968 7.442 0.526 17569 8361 1 13 . 1 1 137 137 LEU N N 291 118.900 118.900 119.185 -0.285 17569 8362 1 13 . 1 1 137 137 LEU HA H 291 4.241 4.241 3.963 0.278 17569 8363 1 13 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.364 -1.004 17569 8364 1 13 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.231 -0.759 17569 8365 1 13 . 1 1 137 137 LEU H H 291 8.154 8.154 7.716 0.438 17569 8366 1 13 . 1 1 138 138 GLN N N 292 117.993 117.993 117.045 0.948 17569 8367 1 13 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.067 0.205 17569 8368 1 13 . 1 1 138 138 GLN CA C 292 56.632 56.632 58.000 -1.368 17569 8369 1 13 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.302 -0.718 17569 8370 1 13 . 1 1 138 138 GLN H H 292 7.896 7.896 7.671 0.225 17569 8371 1 13 . 1 1 139 139 GLN N N 293 118.889 118.889 120.248 -1.359 17569 8372 1 13 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.319 -0.050 17569 8373 1 13 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.369 1.085 17569 8374 1 13 . 1 1 139 139 GLN CB C 293 29.069 29.069 27.714 1.355 17569 8375 1 13 . 1 1 139 139 GLN H H 293 8.091 8.091 7.927 0.164 17569 8376 1 13 . 1 1 140 140 ASN N N 294 118.604 118.604 122.862 -4.258 17569 8377 1 13 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.797 -0.038 17569 8378 1 13 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.316 -0.095 17569 8379 1 13 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.715 -0.982 17569 8380 1 13 . 1 1 140 140 ASN H H 294 8.273 8.273 8.051 0.222 17569 8381 1 13 . 1 1 141 141 LYS N N 295 121.685 121.685 123.230 -1.545 17569 8382 1 13 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.639 -0.279 17569 8383 1 13 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.206 -0.033 17569 8384 1 13 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.621 -1.086 17569 8385 1 13 . 1 1 141 141 LYS H H 295 8.089 8.089 8.423 -0.334 17569 8386 1 14 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.623 -0.236 17569 8387 1 14 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.299 0.146 17569 8388 1 14 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.880 -0.624 17569 8389 1 14 . 1 1 3 3 MET HA H 157 4.476 4.476 4.616 -0.140 17569 8390 1 14 . 1 1 3 3 MET CA C 157 55.401 55.401 55.263 0.138 17569 8391 1 14 . 1 1 4 4 ALA N N 158 124.828 124.828 125.584 -0.756 17569 8392 1 14 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.477 -0.163 17569 8393 1 14 . 1 1 4 4 ALA CA C 158 52.511 52.511 52.249 0.262 17569 8394 1 14 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.713 -0.712 17569 8395 1 14 . 1 1 4 4 ALA H H 158 8.382 8.382 8.375 0.007 17569 8396 1 14 . 1 1 5 5 ASP N N 159 119.418 119.418 119.490 -0.072 17569 8397 1 14 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.945 -0.355 17569 8398 1 14 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.681 0.455 17569 8399 1 14 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.498 -1.483 17569 8400 1 14 . 1 1 5 5 ASP H H 159 8.312 8.312 8.168 0.144 17569 8401 1 14 . 1 1 6 6 LYS N N 160 121.604 121.604 119.727 1.877 17569 8402 1 14 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.647 -0.304 17569 8403 1 14 . 1 1 6 6 LYS H H 160 8.274 8.274 8.295 -0.021 17569 8404 1 14 . 1 1 7 7 ARG N N 161 121.611 121.611 120.832 0.779 17569 8405 1 14 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.570 -0.243 17569 8406 1 14 . 1 1 7 7 ARG H H 161 8.430 8.430 8.905 -0.475 17569 8407 1 14 . 1 1 8 8 GLY N N 162 109.606 109.606 109.443 0.163 17569 8408 1 14 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.798 0.249 17569 8409 1 14 . 1 1 8 8 GLY H H 162 8.473 8.473 8.119 0.354 17569 8410 1 14 . 1 1 9 9 ASP N N 163 120.187 120.187 120.729 -0.542 17569 8411 1 14 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.774 -0.125 17569 8412 1 14 . 1 1 9 9 ASP CA C 163 54.151 54.151 54.067 0.084 17569 8413 1 14 . 1 1 9 9 ASP H H 163 8.296 8.296 8.133 0.163 17569 8414 1 14 . 1 1 10 10 GLY N N 164 108.816 108.816 110.750 -1.934 17569 8415 1 14 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.919 0.448 17569 8416 1 14 . 1 1 10 10 GLY H H 164 8.458 8.458 8.336 0.122 17569 8417 1 14 . 1 1 11 11 LEU N N 165 121.195 121.195 121.950 -0.755 17569 8418 1 14 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.650 -0.334 17569 8419 1 14 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.365 0.634 17569 8420 1 14 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.148 -2.216 17569 8421 1 14 . 1 1 11 11 LEU H H 165 8.137 8.137 7.855 0.282 17569 8422 1 14 . 1 1 12 12 HIS N N 166 119.387 119.387 121.093 -1.706 17569 8423 1 14 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.330 0.325 17569 8424 1 14 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.648 0.621 17569 8425 1 14 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.861 0.836 17569 8426 1 14 . 1 1 12 12 HIS H H 166 8.270 8.270 8.637 -0.367 17569 8427 1 14 . 1 1 13 13 GLY N N 167 109.899 109.899 108.239 1.660 17569 8428 1 14 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.204 0.901 17569 8429 1 14 . 1 1 13 13 GLY H H 167 8.276 8.276 8.054 0.222 17569 8430 1 14 . 1 1 14 14 ILE N N 168 119.597 119.597 120.471 -0.874 17569 8431 1 14 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.155 0.168 17569 8432 1 14 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.109 0.491 17569 8433 1 14 . 1 1 14 14 ILE CB C 168 38.950 38.950 40.937 -1.987 17569 8434 1 14 . 1 1 14 14 ILE H H 168 7.962 7.962 8.113 -0.151 17569 8435 1 14 . 1 1 15 15 VAL N N 169 127.578 127.578 126.549 1.029 17569 8436 1 14 . 1 1 15 15 VAL HA H 169 4.280 4.280 3.829 0.451 17569 8437 1 14 . 1 1 15 15 VAL CA C 169 61.317 61.317 63.106 -1.789 17569 8438 1 14 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.738 2.664 17569 8439 1 14 . 1 1 15 15 VAL H H 169 9.011 9.011 8.425 0.586 17569 8440 1 14 . 1 1 16 16 SER N N 170 118.596 118.596 120.260 -1.664 17569 8441 1 14 . 1 1 16 16 SER HA H 170 5.140 5.140 4.740 0.400 17569 8442 1 14 . 1 1 16 16 SER CA C 170 55.985 55.985 55.975 0.010 17569 8443 1 14 . 1 1 16 16 SER CB C 170 65.261 65.261 65.578 -0.316 17569 8444 1 14 . 1 1 16 16 SER H H 170 8.242 8.242 7.658 0.584 17569 8445 1 14 . 1 1 17 17 CYS N N 171 123.783 123.783 122.736 1.047 17569 8446 1 14 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.164 0.017 17569 8447 1 14 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.816 -0.972 17569 8448 1 14 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.593 2.780 17569 8449 1 14 . 1 1 17 17 CYS H H 171 8.894 8.894 8.542 0.352 17569 8450 1 14 . 1 1 18 18 THR N N 172 121.703 121.703 117.471 4.232 17569 8451 1 14 . 1 1 18 18 THR HA H 172 4.386 4.386 4.094 0.292 17569 8452 1 14 . 1 1 18 18 THR CA C 172 64.667 64.667 64.767 -0.100 17569 8453 1 14 . 1 1 18 18 THR CB C 172 69.498 69.498 68.743 0.755 17569 8454 1 14 . 1 1 18 18 THR H H 172 8.788 8.788 8.309 0.479 17569 8455 1 14 . 1 1 19 19 ALA N N 173 131.364 131.364 121.946 9.418 17569 8456 1 14 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.250 0.246 17569 8457 1 14 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.717 0.309 17569 8458 1 14 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.678 3.504 17569 8459 1 14 . 1 1 19 19 ALA H H 173 9.680 9.680 7.843 1.837 17569 8460 1 14 . 1 1 20 20 CYS N N 174 115.498 115.498 115.363 0.135 17569 8461 1 14 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.591 0.377 17569 8462 1 14 . 1 1 20 20 CYS CA C 174 58.094 58.094 58.723 -0.629 17569 8463 1 14 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.086 4.158 17569 8464 1 14 . 1 1 20 20 CYS H H 174 8.470 8.470 7.515 0.955 17569 8465 1 14 . 1 1 21 21 GLY N N 175 112.464 112.464 108.943 3.521 17569 8466 1 14 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.116 0.590 17569 8467 1 14 . 1 1 21 21 GLY H H 175 7.884 7.884 7.974 -0.090 17569 8468 1 14 . 1 1 22 22 GLN N N 176 121.784 121.784 118.379 3.405 17569 8469 1 14 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.504 -0.128 17569 8470 1 14 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.637 1.654 17569 8471 1 14 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.949 -2.608 17569 8472 1 14 . 1 1 22 22 GLN H H 176 8.723 8.723 8.032 0.691 17569 8473 1 14 . 1 1 23 23 GLN N N 177 122.900 122.900 121.560 1.340 17569 8474 1 14 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.220 0.310 17569 8475 1 14 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.235 0.315 17569 8476 1 14 . 1 1 23 23 GLN CB C 177 28.460 28.460 28.789 -0.329 17569 8477 1 14 . 1 1 23 23 GLN H H 177 8.721 8.721 8.505 0.216 17569 8478 1 14 . 1 1 24 24 VAL N N 178 121.000 121.000 123.053 -2.053 17569 8479 1 14 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.972 0.552 17569 8480 1 14 . 1 1 24 24 VAL CA C 178 59.877 59.877 60.897 -1.020 17569 8481 1 14 . 1 1 24 24 VAL H H 178 8.689 8.689 7.754 0.935 17569 8482 1 14 . 1 1 25 25 ASN N N 179 121.392 121.392 123.416 -2.024 17569 8483 1 14 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.284 0.592 17569 8484 1 14 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.288 -2.139 17569 8485 1 14 . 1 1 25 25 ASN CB C 179 37.977 37.977 37.500 0.477 17569 8486 1 14 . 1 1 25 25 ASN H H 179 8.635 8.635 8.470 0.165 17569 8487 1 14 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.737 -0.277 17569 8488 1 14 . 1 1 27 27 PHE CA C 181 56.998 56.998 57.442 -0.444 17569 8489 1 14 . 1 1 27 27 PHE CB C 181 38.393 38.393 40.647 -2.254 17569 8490 1 14 . 1 1 28 28 GLN N N 182 119.300 119.300 124.970 -5.670 17569 8491 1 14 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.708 -0.190 17569 8492 1 14 . 1 1 28 28 GLN CA C 182 54.342 54.342 55.013 -0.671 17569 8493 1 14 . 1 1 28 28 GLN CB C 182 30.350 30.350 31.760 -1.410 17569 8494 1 14 . 1 1 28 28 GLN H H 182 7.494 7.494 7.990 -0.496 17569 8495 1 14 . 1 1 29 29 LYS N N 183 124.516 124.516 126.311 -1.795 17569 8496 1 14 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.570 -0.648 17569 8497 1 14 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.410 1.902 17569 8498 1 14 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.298 -0.012 17569 8499 1 14 . 1 1 29 29 LYS H H 183 8.779 8.779 8.836 -0.057 17569 8500 1 14 . 1 1 30 30 ASP N N 184 116.500 116.500 115.584 0.916 17569 8501 1 14 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.798 -0.339 17569 8502 1 14 . 1 1 30 30 ASP CA C 184 54.536 54.536 53.943 0.593 17569 8503 1 14 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.271 -0.300 17569 8504 1 14 . 1 1 30 30 ASP H H 184 8.556 8.556 8.023 0.533 17569 8505 1 14 . 1 1 31 31 SER N N 185 111.505 111.505 114.085 -2.580 17569 8506 1 14 . 1 1 31 31 SER HA H 185 4.695 4.695 4.678 0.017 17569 8507 1 14 . 1 1 31 31 SER CA C 185 59.747 59.747 58.441 1.306 17569 8508 1 14 . 1 1 31 31 SER CB C 185 65.198 65.198 63.816 1.382 17569 8509 1 14 . 1 1 31 31 SER H H 185 7.933 7.933 8.544 -0.611 17569 8510 1 14 . 1 1 32 32 ILE N N 186 113.394 113.394 116.627 -3.233 17569 8511 1 14 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.990 -0.104 17569 8512 1 14 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.385 -0.806 17569 8513 1 14 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.749 1.063 17569 8514 1 14 . 1 1 32 32 ILE H H 186 7.105 7.105 7.592 -0.487 17569 8515 1 14 . 1 1 33 33 TYR N N 187 119.098 119.098 120.251 -1.153 17569 8516 1 14 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.146 -0.623 17569 8517 1 14 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.184 1.076 17569 8518 1 14 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.136 2.304 17569 8519 1 14 . 1 1 33 33 TYR H H 187 8.954 8.954 7.894 1.060 17569 8520 1 14 . 1 1 34 34 ARG N N 188 118.502 118.502 122.213 -3.711 17569 8521 1 14 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.739 -0.102 17569 8522 1 14 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.294 -1.542 17569 8523 1 14 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.071 1.180 17569 8524 1 14 . 1 1 34 34 ARG H H 188 8.412 8.412 8.623 -0.211 17569 8525 1 14 . 1 1 35 35 HIS N N 189 126.596 126.596 127.236 -0.640 17569 8526 1 14 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.913 -0.321 17569 8527 1 14 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.104 -0.383 17569 8528 1 14 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.064 1.408 17569 8529 1 14 . 1 1 35 35 HIS H H 189 9.813 9.813 9.108 0.705 17569 8530 1 14 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.553 -0.255 17569 8531 1 14 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.891 0.385 17569 8532 1 14 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.194 0.657 17569 8533 1 14 . 1 1 37 37 SER N N 191 110.003 110.003 113.729 -3.726 17569 8534 1 14 . 1 1 37 37 SER HA H 191 4.918 4.918 4.301 0.617 17569 8535 1 14 . 1 1 37 37 SER CA C 191 59.031 59.031 61.018 -1.987 17569 8536 1 14 . 1 1 37 37 SER CB C 191 65.104 65.104 63.320 1.784 17569 8537 1 14 . 1 1 37 37 SER H H 191 8.934 8.934 8.533 0.401 17569 8538 1 14 . 1 1 38 38 LEU N N 192 120.959 120.959 113.832 7.127 17569 8539 1 14 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.936 -0.807 17569 8540 1 14 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.219 1.927 17569 8541 1 14 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.479 1.517 17569 8542 1 14 . 1 1 38 38 LEU H H 192 8.649 8.649 7.015 1.634 17569 8543 1 14 . 1 1 39 39 GLN N N 193 108.600 108.600 119.344 -10.744 17569 8544 1 14 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.082 -0.177 17569 8545 1 14 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.579 0.235 17569 8546 1 14 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.840 -1.806 17569 8547 1 14 . 1 1 39 39 GLN H H 193 8.465 8.465 7.854 0.611 17569 8548 1 14 . 1 1 40 40 VAL N N 194 105.325 105.325 118.695 -13.370 17569 8549 1 14 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.472 0.078 17569 8550 1 14 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.191 -1.550 17569 8551 1 14 . 1 1 40 40 VAL H H 194 6.256 6.256 7.796 -1.540 17569 8552 1 14 . 1 1 41 41 LEU N N 195 123.100 123.100 122.103 0.997 17569 8553 1 14 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.784 0.032 17569 8554 1 14 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.574 3.608 17569 8555 1 14 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.124 0.446 17569 8556 1 14 . 1 1 41 41 LEU H H 195 9.154 9.154 8.461 0.693 17569 8557 1 14 . 1 1 42 42 ILE N N 196 124.396 124.396 117.221 7.175 17569 8558 1 14 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.828 1.524 17569 8559 1 14 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.216 1.014 17569 8560 1 14 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.875 1.395 17569 8561 1 14 . 1 1 42 42 ILE H H 196 9.766 9.766 7.803 1.963 17569 8562 1 14 . 1 1 43 43 CYS N N 197 121.500 121.500 115.001 6.499 17569 8563 1 14 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.236 0.026 17569 8564 1 14 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.104 0.599 17569 8565 1 14 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.301 1.999 17569 8566 1 14 . 1 1 43 43 CYS H H 197 9.882 9.882 8.306 1.576 17569 8567 1 14 . 1 1 44 44 LYS N N 198 117.995 117.995 122.081 -4.086 17569 8568 1 14 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.138 -0.149 17569 8569 1 14 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.123 -0.464 17569 8570 1 14 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.316 0.384 17569 8571 1 14 . 1 1 44 44 LYS H H 198 8.089 8.089 8.528 -0.439 17569 8572 1 14 . 1 1 45 45 ASN N N 199 119.200 119.200 117.557 1.643 17569 8573 1 14 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.610 -0.096 17569 8574 1 14 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.160 0.560 17569 8575 1 14 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.202 -0.035 17569 8576 1 14 . 1 1 45 45 ASN H H 199 8.356 8.356 8.573 -0.217 17569 8577 1 14 . 1 1 46 46 CYS N N 200 126.600 126.600 119.387 7.213 17569 8578 1 14 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.987 0.194 17569 8579 1 14 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.296 2.199 17569 8580 1 14 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.068 2.114 17569 8581 1 14 . 1 1 46 46 CYS H H 200 9.189 9.189 7.898 1.291 17569 8582 1 14 . 1 1 47 47 PHE N N 201 121.962 121.962 120.426 1.536 17569 8583 1 14 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.175 -0.305 17569 8584 1 14 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.752 1.517 17569 8585 1 14 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.542 0.625 17569 8586 1 14 . 1 1 47 47 PHE H H 201 8.826 8.826 8.296 0.530 17569 8587 1 14 . 1 1 48 48 LYS N N 202 117.400 117.400 120.190 -2.790 17569 8588 1 14 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.882 -0.184 17569 8589 1 14 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.092 -1.140 17569 8590 1 14 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.320 -0.778 17569 8591 1 14 . 1 1 48 48 LYS H H 202 8.512 8.512 7.888 0.624 17569 8592 1 14 . 1 1 49 49 TYR N N 203 120.400 120.400 120.606 -0.206 17569 8593 1 14 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.190 0.224 17569 8594 1 14 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.642 -0.870 17569 8595 1 14 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.725 -0.279 17569 8596 1 14 . 1 1 49 49 TYR H H 203 8.133 8.133 7.699 0.434 17569 8597 1 14 . 1 1 50 50 TYR N N 204 121.783 121.783 117.887 3.896 17569 8598 1 14 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.632 -1.137 17569 8599 1 14 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.200 2.750 17569 8600 1 14 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.602 0.890 17569 8601 1 14 . 1 1 50 50 TYR H H 204 8.765 8.765 7.615 1.150 17569 8602 1 14 . 1 1 51 51 MET N N 205 110.800 110.800 115.082 -4.282 17569 8603 1 14 . 1 1 51 51 MET HA H 205 4.349 4.349 4.189 0.160 17569 8604 1 14 . 1 1 51 51 MET CA C 205 53.505 53.505 58.081 -4.576 17569 8605 1 14 . 1 1 51 51 MET CB C 205 30.384 30.384 33.408 -3.024 17569 8606 1 14 . 1 1 51 51 MET H H 205 7.771 7.771 8.394 -0.623 17569 8607 1 14 . 1 1 52 52 SER N N 206 116.800 116.800 112.789 4.011 17569 8608 1 14 . 1 1 52 52 SER HA H 206 3.919 3.919 4.364 -0.445 17569 8609 1 14 . 1 1 52 52 SER CA C 206 61.621 61.621 59.786 1.835 17569 8610 1 14 . 1 1 52 52 SER CB C 206 62.611 62.611 64.601 -1.990 17569 8611 1 14 . 1 1 52 52 SER H H 206 7.581 7.581 8.264 -0.683 17569 8612 1 14 . 1 1 53 53 ASP N N 207 117.400 117.400 121.434 -4.034 17569 8613 1 14 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.770 -0.198 17569 8614 1 14 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.285 -0.186 17569 8615 1 14 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.562 0.626 17569 8616 1 14 . 1 1 53 53 ASP H H 207 7.085 7.085 8.162 -1.077 17569 8617 1 14 . 1 1 54 54 ASP N N 208 119.405 119.405 122.525 -3.120 17569 8618 1 14 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.952 -0.563 17569 8619 1 14 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.413 0.488 17569 8620 1 14 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.699 -1.350 17569 8621 1 14 . 1 1 54 54 ASP H H 208 8.439 8.439 8.437 0.002 17569 8622 1 14 . 1 1 55 55 ILE N N 209 124.698 124.698 120.852 3.846 17569 8623 1 14 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.357 -0.357 17569 8624 1 14 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.672 1.606 17569 8625 1 14 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.503 0.788 17569 8626 1 14 . 1 1 55 55 ILE H H 209 8.128 8.128 8.410 -0.282 17569 8627 1 14 . 1 1 56 56 SER N N 210 126.703 126.703 120.967 5.736 17569 8628 1 14 . 1 1 56 56 SER HA H 210 4.365 4.365 4.684 -0.319 17569 8629 1 14 . 1 1 56 56 SER CA C 210 57.769 57.769 57.762 0.007 17569 8630 1 14 . 1 1 56 56 SER CB C 210 64.991 64.991 65.233 -0.242 17569 8631 1 14 . 1 1 56 56 SER H H 210 8.815 8.815 8.611 0.204 17569 8632 1 14 . 1 1 57 57 ARG N N 211 116.885 116.885 119.865 -2.980 17569 8633 1 14 . 1 1 57 57 ARG HA H 211 5.042 5.042 5.028 0.014 17569 8634 1 14 . 1 1 57 57 ARG CA C 211 54.400 54.400 54.381 0.019 17569 8635 1 14 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.489 2.795 17569 8636 1 14 . 1 1 57 57 ARG H H 211 8.365 8.365 8.435 -0.070 17569 8637 1 14 . 1 1 58 58 ASP N N 212 121.982 121.982 124.675 -2.693 17569 8638 1 14 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.506 0.109 17569 8639 1 14 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.849 -2.627 17569 8640 1 14 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.500 -0.998 17569 8641 1 14 . 1 1 58 58 ASP H H 212 8.706 8.706 8.408 0.298 17569 8642 1 14 . 1 1 59 59 SER N N 213 114.164 114.164 116.434 -2.270 17569 8643 1 14 . 1 1 59 59 SER HA H 213 4.212 4.212 4.156 0.056 17569 8644 1 14 . 1 1 59 59 SER CA C 213 60.840 60.840 61.491 -0.651 17569 8645 1 14 . 1 1 59 59 SER CB C 213 62.714 62.714 63.136 -0.422 17569 8646 1 14 . 1 1 59 59 SER H H 213 8.687 8.687 8.949 -0.262 17569 8647 1 14 . 1 1 60 60 ASP N N 214 120.899 120.899 120.335 0.564 17569 8648 1 14 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.750 0.075 17569 8649 1 14 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.950 0.261 17569 8650 1 14 . 1 1 60 60 ASP CB C 214 41.558 41.558 39.709 1.849 17569 8651 1 14 . 1 1 60 60 ASP H H 214 8.193 8.193 7.599 0.594 17569 8652 1 14 . 1 1 61 61 GLY N N 215 108.300 108.300 107.225 1.075 17569 8653 1 14 . 1 1 61 61 GLY CA C 215 45.397 45.397 46.077 -0.680 17569 8654 1 14 . 1 1 61 61 GLY H H 215 8.234 8.234 8.154 0.080 17569 8655 1 14 . 1 1 62 62 MET N N 216 120.002 120.002 117.609 2.393 17569 8656 1 14 . 1 1 62 62 MET HA H 216 4.972 4.972 4.603 0.369 17569 8657 1 14 . 1 1 62 62 MET CA C 216 53.151 53.151 54.502 -1.351 17569 8658 1 14 . 1 1 62 62 MET CB C 216 32.311 32.311 35.707 -3.396 17569 8659 1 14 . 1 1 62 62 MET H H 216 8.376 8.376 7.304 1.072 17569 8660 1 14 . 1 1 63 63 ASP N N 217 127.300 127.300 119.710 7.590 17569 8661 1 14 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.848 0.118 17569 8662 1 14 . 1 1 63 63 ASP CA C 217 55.569 55.569 53.664 1.905 17569 8663 1 14 . 1 1 63 63 ASP H H 217 9.368 9.368 8.679 0.689 17569 8664 1 14 . 1 1 64 64 GLU N N 218 114.400 114.400 124.355 -9.955 17569 8665 1 14 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.440 -0.284 17569 8666 1 14 . 1 1 64 64 GLU CA C 218 55.850 55.850 56.022 -0.172 17569 8667 1 14 . 1 1 64 64 GLU H H 218 8.583 8.583 8.637 -0.054 17569 8668 1 14 . 1 1 65 65 GLN N N 219 115.500 115.500 117.010 -1.510 17569 8669 1 14 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.460 -0.149 17569 8670 1 14 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.303 0.043 17569 8671 1 14 . 1 1 65 65 GLN H H 219 7.158 7.158 7.593 -0.435 17569 8672 1 14 . 1 1 66 66 CYS N N 220 122.600 122.600 117.976 4.624 17569 8673 1 14 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.192 -1.115 17569 8674 1 14 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.326 1.203 17569 8675 1 14 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.489 1.483 17569 8676 1 14 . 1 1 66 66 CYS H H 220 8.248 8.248 8.332 -0.084 17569 8677 1 14 . 1 1 67 67 ARG N N 221 130.363 130.363 123.920 6.443 17569 8678 1 14 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.430 -0.363 17569 8679 1 14 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.821 -2.805 17569 8680 1 14 . 1 1 67 67 ARG H H 221 9.145 9.145 8.410 0.735 17569 8681 1 14 . 1 1 68 68 TRP N N 222 124.200 124.200 120.446 3.754 17569 8682 1 14 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.721 -0.285 17569 8683 1 14 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.589 0.491 17569 8684 1 14 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.366 0.828 17569 8685 1 14 . 1 1 68 68 TRP H H 222 9.689 9.689 8.151 1.538 17569 8686 1 14 . 1 1 69 69 CYS N N 223 116.297 116.297 110.873 5.424 17569 8687 1 14 . 1 1 69 69 CYS HA H 223 5.091 5.091 4.943 0.148 17569 8688 1 14 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.132 2.970 17569 8689 1 14 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.374 4.964 17569 8690 1 14 . 1 1 69 69 CYS H H 223 8.822 8.822 7.798 1.024 17569 8691 1 14 . 1 1 70 70 ALA N N 224 123.112 123.112 124.023 -0.911 17569 8692 1 14 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.311 0.095 17569 8693 1 14 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.183 -0.332 17569 8694 1 14 . 1 1 70 70 ALA CB C 224 17.720 17.720 18.064 -0.344 17569 8695 1 14 . 1 1 70 70 ALA H H 224 8.787 8.787 8.167 0.620 17569 8696 1 14 . 1 1 71 71 GLU N N 225 118.300 118.300 119.842 -1.542 17569 8697 1 14 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.479 0.829 17569 8698 1 14 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.796 -2.497 17569 8699 1 14 . 1 1 71 71 GLU H H 225 8.541 8.541 8.164 0.377 17569 8700 1 14 . 1 1 72 72 GLY N N 226 111.995 111.995 110.004 1.991 17569 8701 1 14 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.462 -1.059 17569 8702 1 14 . 1 1 72 72 GLY H H 226 9.837 9.837 8.482 1.355 17569 8703 1 14 . 1 1 73 73 GLY N N 227 106.600 106.600 106.670 -0.070 17569 8704 1 14 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.954 1.017 17569 8705 1 14 . 1 1 73 73 GLY H H 227 7.772 7.772 8.359 -0.587 17569 8706 1 14 . 1 1 74 74 ASN N N 228 124.277 124.277 119.064 5.213 17569 8707 1 14 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.459 0.622 17569 8708 1 14 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.874 -0.774 17569 8709 1 14 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.327 -0.243 17569 8710 1 14 . 1 1 74 74 ASN H H 228 8.876 8.876 8.528 0.348 17569 8711 1 14 . 1 1 75 75 LEU N N 229 123.050 123.050 122.139 0.911 17569 8712 1 14 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.872 -0.272 17569 8713 1 14 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.383 0.980 17569 8714 1 14 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.573 -0.073 17569 8715 1 14 . 1 1 75 75 LEU H H 229 8.901 8.901 8.028 0.873 17569 8716 1 14 . 1 1 76 76 ILE N N 230 123.552 123.552 122.866 0.686 17569 8717 1 14 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.034 0.451 17569 8718 1 14 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.481 -0.781 17569 8719 1 14 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.281 -0.882 17569 8720 1 14 . 1 1 76 76 ILE H H 230 9.406 9.406 9.210 0.196 17569 8721 1 14 . 1 1 77 77 CYS N N 231 124.637 124.637 126.701 -2.064 17569 8722 1 14 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.434 -0.559 17569 8723 1 14 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.046 0.313 17569 8724 1 14 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.619 -0.185 17569 8725 1 14 . 1 1 77 77 CYS H H 231 8.809 8.809 8.440 0.369 17569 8726 1 14 . 1 1 78 78 CYS N N 232 125.697 125.697 125.759 -0.062 17569 8727 1 14 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.888 -0.604 17569 8728 1 14 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.740 4.144 17569 8729 1 14 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.995 1.175 17569 8730 1 14 . 1 1 78 78 CYS H H 232 8.579 8.579 8.739 -0.160 17569 8731 1 14 . 1 1 79 79 ASP N N 233 123.600 123.600 126.916 -3.316 17569 8732 1 14 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.525 0.232 17569 8733 1 14 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.031 2.958 17569 8734 1 14 . 1 1 79 79 ASP CB C 233 41.629 41.629 39.924 1.705 17569 8735 1 14 . 1 1 79 79 ASP H H 233 8.577 8.577 8.260 0.317 17569 8736 1 14 . 1 1 80 80 PHE N N 234 122.100 122.100 116.403 5.697 17569 8737 1 14 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.548 -0.022 17569 8738 1 14 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.167 1.742 17569 8739 1 14 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.347 1.502 17569 8740 1 14 . 1 1 80 80 PHE H H 234 10.432 10.432 7.163 3.269 17569 8741 1 14 . 1 1 81 81 CYS N N 235 124.300 124.300 117.242 7.058 17569 8742 1 14 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.748 0.408 17569 8743 1 14 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.947 0.098 17569 8744 1 14 . 1 1 81 81 CYS CB C 235 31.407 31.407 26.781 4.626 17569 8745 1 14 . 1 1 81 81 CYS H H 235 8.476 8.476 7.898 0.578 17569 8746 1 14 . 1 1 82 82 HIS N N 236 112.598 112.598 118.932 -6.334 17569 8747 1 14 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.150 0.833 17569 8748 1 14 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.306 -1.909 17569 8749 1 14 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.319 2.938 17569 8750 1 14 . 1 1 82 82 HIS H H 236 6.699 6.699 8.002 -1.303 17569 8751 1 14 . 1 1 83 83 ASN N N 237 123.600 123.600 117.714 5.886 17569 8752 1 14 . 1 1 83 83 ASN HA H 237 4.801 4.801 5.225 -0.424 17569 8753 1 14 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.526 3.090 17569 8754 1 14 . 1 1 83 83 ASN H H 237 9.097 9.097 7.796 1.301 17569 8755 1 14 . 1 1 84 84 ALA N N 238 122.000 122.000 123.761 -1.761 17569 8756 1 14 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.340 0.069 17569 8757 1 14 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.236 0.127 17569 8758 1 14 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.333 2.737 17569 8759 1 14 . 1 1 84 84 ALA H H 238 9.885 9.885 8.424 1.461 17569 8760 1 14 . 1 1 85 85 PHE N N 239 116.707 116.707 121.104 -4.397 17569 8761 1 14 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.139 0.889 17569 8762 1 14 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.742 -0.525 17569 8763 1 14 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.024 1.640 17569 8764 1 14 . 1 1 85 85 PHE H H 239 9.450 9.450 9.292 0.158 17569 8765 1 14 . 1 1 86 86 CYS N N 240 126.682 126.682 124.866 1.816 17569 8766 1 14 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.804 0.818 17569 8767 1 14 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.822 -0.480 17569 8768 1 14 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.149 3.108 17569 8769 1 14 . 1 1 86 86 CYS H H 240 11.309 11.309 9.437 1.872 17569 8770 1 14 . 1 1 87 87 LYS N N 241 117.865 117.865 124.274 -6.409 17569 8771 1 14 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.911 -0.062 17569 8772 1 14 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.236 -0.167 17569 8773 1 14 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.480 0.318 17569 8774 1 14 . 1 1 87 87 LYS H H 241 8.230 8.230 8.802 -0.572 17569 8775 1 14 . 1 1 88 88 LYS N N 242 117.949 117.949 118.473 -0.524 17569 8776 1 14 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.106 -0.128 17569 8777 1 14 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.969 1.401 17569 8778 1 14 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.991 0.325 17569 8779 1 14 . 1 1 88 88 LYS H H 242 7.945 7.945 8.516 -0.571 17569 8780 1 14 . 1 1 89 89 CYS N N 243 125.305 125.305 117.684 7.621 17569 8781 1 14 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.262 -0.520 17569 8782 1 14 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.593 2.234 17569 8783 1 14 . 1 1 89 89 CYS CB C 243 28.241 28.241 26.973 1.268 17569 8784 1 14 . 1 1 89 89 CYS H H 243 9.297 9.297 7.638 1.659 17569 8785 1 14 . 1 1 90 90 ILE N N 244 119.687 119.687 121.325 -1.638 17569 8786 1 14 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.914 -0.307 17569 8787 1 14 . 1 1 90 90 ILE CA C 244 65.950 65.950 66.014 -0.065 17569 8788 1 14 . 1 1 90 90 ILE H H 244 7.997 7.997 7.655 0.342 17569 8789 1 14 . 1 1 91 91 LEU N N 245 120.280 120.280 120.985 -0.705 17569 8790 1 14 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.375 -0.690 17569 8791 1 14 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.592 0.643 17569 8792 1 14 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.981 -0.023 17569 8793 1 14 . 1 1 91 91 LEU H H 245 8.810 8.810 8.705 0.105 17569 8794 1 14 . 1 1 92 92 ARG N N 246 116.901 116.901 118.108 -1.207 17569 8795 1 14 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.110 -0.293 17569 8796 1 14 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.252 0.728 17569 8797 1 14 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.221 0.379 17569 8798 1 14 . 1 1 92 92 ARG H H 246 8.086 8.086 7.602 0.484 17569 8799 1 14 . 1 1 93 93 ASN N N 247 111.200 111.200 116.573 -5.373 17569 8800 1 14 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.520 0.083 17569 8801 1 14 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.865 0.943 17569 8802 1 14 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.111 3.373 17569 8803 1 14 . 1 1 93 93 ASN H H 247 7.136 7.136 8.345 -1.209 17569 8804 1 14 . 1 1 94 94 LEU N N 248 118.807 118.807 117.466 1.341 17569 8805 1 14 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.386 0.428 17569 8806 1 14 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.289 -0.101 17569 8807 1 14 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.700 -0.002 17569 8808 1 14 . 1 1 94 94 LEU H H 248 8.515 8.515 7.974 0.541 17569 8809 1 14 . 1 1 95 95 GLY N N 249 108.000 108.000 106.448 1.552 17569 8810 1 14 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.543 0.085 17569 8811 1 14 . 1 1 95 95 GLY H H 249 7.955 7.955 7.542 0.413 17569 8812 1 14 . 1 1 96 96 ARG N N 250 117.797 117.797 121.062 -3.265 17569 8813 1 14 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.314 -0.471 17569 8814 1 14 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.425 0.257 17569 8815 1 14 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.224 -0.363 17569 8816 1 14 . 1 1 96 96 ARG H H 250 8.559 8.559 8.666 -0.107 17569 8817 1 14 . 1 1 97 97 LYS N N 251 120.900 120.900 119.554 1.346 17569 8818 1 14 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.008 0.148 17569 8819 1 14 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.689 -0.533 17569 8820 1 14 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.527 -0.167 17569 8821 1 14 . 1 1 97 97 LYS H H 251 8.655 8.655 8.560 0.095 17569 8822 1 14 . 1 1 98 98 GLU N N 252 122.000 122.000 118.998 3.002 17569 8823 1 14 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.057 0.294 17569 8824 1 14 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.561 -0.979 17569 8825 1 14 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.277 -0.877 17569 8826 1 14 . 1 1 98 98 GLU H H 252 7.705 7.705 8.368 -0.663 17569 8827 1 14 . 1 1 99 99 LEU N N 253 117.400 117.400 121.184 -3.784 17569 8828 1 14 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.779 0.138 17569 8829 1 14 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.095 -0.097 17569 8830 1 14 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.822 -0.340 17569 8831 1 14 . 1 1 99 99 LEU H H 253 7.285 7.285 7.611 -0.326 17569 8832 1 14 . 1 1 100 100 SER N N 254 112.100 112.100 114.670 -2.570 17569 8833 1 14 . 1 1 100 100 SER HA H 254 4.107 4.107 4.145 -0.038 17569 8834 1 14 . 1 1 100 100 SER CA C 254 61.603 61.603 62.111 -0.508 17569 8835 1 14 . 1 1 100 100 SER CB C 254 62.622 62.622 63.040 -0.418 17569 8836 1 14 . 1 1 100 100 SER H H 254 8.326 8.326 8.010 0.316 17569 8837 1 14 . 1 1 101 101 THR N N 255 118.151 118.151 118.492 -0.341 17569 8838 1 14 . 1 1 101 101 THR HA H 255 4.026 4.026 4.090 -0.064 17569 8839 1 14 . 1 1 101 101 THR CA C 255 66.261 66.261 66.416 -0.155 17569 8840 1 14 . 1 1 101 101 THR CB C 255 68.735 68.735 68.764 -0.029 17569 8841 1 14 . 1 1 101 101 THR H H 255 7.972 7.972 7.963 0.009 17569 8842 1 14 . 1 1 102 102 ILE N N 256 120.100 120.100 122.887 -2.787 17569 8843 1 14 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.845 -0.382 17569 8844 1 14 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.764 0.009 17569 8845 1 14 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.447 0.294 17569 8846 1 14 . 1 1 102 102 ILE H H 256 7.868 7.868 8.696 -0.828 17569 8847 1 14 . 1 1 103 103 MET N N 257 114.876 114.876 117.276 -2.400 17569 8848 1 14 . 1 1 103 103 MET HA H 257 4.211 4.211 4.050 0.161 17569 8849 1 14 . 1 1 103 103 MET CA C 257 55.691 55.691 58.381 -2.690 17569 8850 1 14 . 1 1 103 103 MET CB C 257 32.000 32.000 32.867 -0.868 17569 8851 1 14 . 1 1 103 103 MET H H 257 7.606 7.606 7.268 0.338 17569 8852 1 14 . 1 1 104 104 ASP N N 258 119.976 119.976 118.492 1.484 17569 8853 1 14 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.767 -0.229 17569 8854 1 14 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.641 1.271 17569 8855 1 14 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.866 0.634 17569 8856 1 14 . 1 1 104 104 ASP H H 258 7.444 7.444 7.620 -0.176 17569 8857 1 14 . 1 1 105 105 GLU N N 259 124.388 124.388 123.485 0.903 17569 8858 1 14 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.535 -0.248 17569 8859 1 14 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.418 3.153 17569 8860 1 14 . 1 1 105 105 GLU CB C 259 29.542 29.542 28.978 0.564 17569 8861 1 14 . 1 1 105 105 GLU H H 259 8.559 8.559 8.122 0.437 17569 8862 1 14 . 1 1 106 106 ASN N N 260 117.201 117.201 118.601 -1.400 17569 8863 1 14 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.419 0.323 17569 8864 1 14 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.892 -0.149 17569 8865 1 14 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.467 1.452 17569 8866 1 14 . 1 1 106 106 ASN H H 260 8.673 8.673 8.156 0.517 17569 8867 1 14 . 1 1 107 107 ASN N N 261 117.900 117.900 114.581 3.319 17569 8868 1 14 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.312 0.673 17569 8869 1 14 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.598 -2.296 17569 8870 1 14 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.441 3.173 17569 8871 1 14 . 1 1 107 107 ASN H H 261 7.956 7.956 8.694 -0.738 17569 8872 1 14 . 1 1 108 108 GLN N N 262 121.500 121.500 112.581 8.919 17569 8873 1 14 . 1 1 108 108 GLN HA H 262 4.608 4.608 3.971 0.637 17569 8874 1 14 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.815 0.961 17569 8875 1 14 . 1 1 108 108 GLN CB C 262 30.558 30.558 28.618 1.940 17569 8876 1 14 . 1 1 108 108 GLN H H 262 8.493 8.493 7.565 0.928 17569 8877 1 14 . 1 1 109 109 TRP N N 263 128.056 128.056 122.928 5.128 17569 8878 1 14 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.637 0.334 17569 8879 1 14 . 1 1 109 109 TRP CA C 263 58.097 58.097 58.373 -0.276 17569 8880 1 14 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.743 0.750 17569 8881 1 14 . 1 1 109 109 TRP H H 263 10.497 10.497 7.928 2.569 17569 8882 1 14 . 1 1 110 110 TYR N N 264 126.600 126.600 125.290 1.310 17569 8883 1 14 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.245 0.157 17569 8884 1 14 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.975 -2.304 17569 8885 1 14 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.082 -1.074 17569 8886 1 14 . 1 1 110 110 TYR H H 264 7.545 7.545 8.023 -0.478 17569 8887 1 14 . 1 1 111 111 CYS N N 265 124.622 124.622 114.326 10.296 17569 8888 1 14 . 1 1 111 111 CYS H H 265 8.586 8.586 8.364 0.222 17569 8889 1 14 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.793 -0.601 17569 8890 1 14 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.725 0.990 17569 8891 1 14 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.616 1.304 17569 8892 1 14 . 1 1 113 113 ILE N N 267 119.504 119.504 119.687 -0.183 17569 8893 1 14 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.695 -0.745 17569 8894 1 14 . 1 1 113 113 ILE CA C 267 61.249 61.249 61.004 0.245 17569 8895 1 14 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.593 -3.060 17569 8896 1 14 . 1 1 113 113 ILE H H 267 9.160 9.160 7.486 1.675 17569 8897 1 14 . 1 1 114 114 CYS N N 268 124.100 124.100 118.337 5.763 17569 8898 1 14 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.167 -0.353 17569 8899 1 14 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.622 3.678 17569 8900 1 14 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.078 2.643 17569 8901 1 14 . 1 1 114 114 CYS H H 268 7.818 7.818 8.240 -0.422 17569 8902 1 14 . 1 1 115 115 HIS N N 269 117.127 117.127 111.269 5.858 17569 8903 1 14 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.658 0.471 17569 8904 1 14 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.033 -0.872 17569 8905 1 14 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.765 2.428 17569 8906 1 14 . 1 1 115 115 HIS H H 269 8.953 8.953 7.794 1.159 17569 8907 1 14 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.468 0.474 17569 8908 1 14 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.568 -0.260 17569 8909 1 14 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.547 1.095 17569 8910 1 14 . 1 1 117 117 GLU N N 271 123.504 123.504 123.375 0.129 17569 8911 1 14 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.354 -0.334 17569 8912 1 14 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.046 3.823 17569 8913 1 14 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.150 -2.099 17569 8914 1 14 . 1 1 117 117 GLU H H 271 8.402 8.402 8.103 0.299 17569 8915 1 14 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.557 -0.015 17569 8916 1 14 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.646 1.713 17569 8917 1 14 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.450 0.692 17569 8918 1 14 . 1 1 119 119 LEU N N 273 112.296 112.296 114.508 -2.212 17569 8919 1 14 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.914 -0.440 17569 8920 1 14 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.497 0.045 17569 8921 1 14 . 1 1 119 119 LEU H H 273 8.090 8.090 7.459 0.631 17569 8922 1 14 . 1 1 120 120 LEU N N 274 121.388 121.388 122.948 -1.560 17569 8923 1 14 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.922 0.105 17569 8924 1 14 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.328 -0.027 17569 8925 1 14 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.763 0.337 17569 8926 1 14 . 1 1 120 120 LEU H H 274 7.823 7.823 8.008 -0.185 17569 8927 1 14 . 1 1 121 121 ASP N N 275 118.600 118.600 118.351 0.249 17569 8928 1 14 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.324 0.217 17569 8929 1 14 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.200 0.503 17569 8930 1 14 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.498 -1.055 17569 8931 1 14 . 1 1 121 121 ASP H H 275 8.694 8.694 8.470 0.224 17569 8932 1 14 . 1 1 122 122 LEU N N 276 123.192 123.192 119.990 3.202 17569 8933 1 14 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.823 0.569 17569 8934 1 14 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.759 0.212 17569 8935 1 14 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.066 0.476 17569 8936 1 14 . 1 1 122 122 LEU H H 276 8.013 8.013 7.315 0.698 17569 8937 1 14 . 1 1 123 123 VAL N N 277 126.898 126.898 118.656 8.242 17569 8938 1 14 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.554 0.301 17569 8939 1 14 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.925 -0.262 17569 8940 1 14 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.524 0.533 17569 8941 1 14 . 1 1 123 123 VAL H H 277 8.781 8.781 7.761 1.020 17569 8942 1 14 . 1 1 124 124 THR N N 278 117.500 117.500 116.190 1.310 17569 8943 1 14 . 1 1 124 124 THR HA H 278 4.030 4.030 3.882 0.148 17569 8944 1 14 . 1 1 124 124 THR CA C 278 66.589 66.589 67.147 -0.558 17569 8945 1 14 . 1 1 124 124 THR CB C 278 68.410 68.410 68.570 -0.160 17569 8946 1 14 . 1 1 124 124 THR H H 278 8.722 8.722 8.298 0.424 17569 8947 1 14 . 1 1 125 125 ALA N N 279 124.700 124.700 124.195 0.505 17569 8948 1 14 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.060 0.201 17569 8949 1 14 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.089 0.207 17569 8950 1 14 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.907 0.042 17569 8951 1 14 . 1 1 125 125 ALA H H 279 8.239 8.239 7.915 0.324 17569 8952 1 14 . 1 1 126 126 CYS N N 280 119.276 119.276 117.440 1.836 17569 8953 1 14 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.824 0.290 17569 8954 1 14 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.535 -1.431 17569 8955 1 14 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.613 -1.117 17569 8956 1 14 . 1 1 126 126 CYS H H 280 8.128 8.128 7.813 0.315 17569 8957 1 14 . 1 1 127 127 ASN N N 281 118.000 118.000 118.241 -0.241 17569 8958 1 14 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.599 -0.039 17569 8959 1 14 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.366 -0.227 17569 8960 1 14 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.818 -0.853 17569 8961 1 14 . 1 1 127 127 ASN H H 281 8.725 8.725 8.009 0.716 17569 8962 1 14 . 1 1 128 128 SER N N 282 116.601 116.601 117.079 -0.478 17569 8963 1 14 . 1 1 128 128 SER HA H 282 4.363 4.363 4.191 0.172 17569 8964 1 14 . 1 1 128 128 SER CA C 282 61.899 61.899 62.205 -0.306 17569 8965 1 14 . 1 1 128 128 SER CB C 282 62.630 62.630 62.979 -0.349 17569 8966 1 14 . 1 1 128 128 SER H H 282 8.542 8.542 7.686 0.856 17569 8967 1 14 . 1 1 129 129 VAL N N 283 123.272 123.272 121.914 1.358 17569 8968 1 14 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.551 0.126 17569 8969 1 14 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.778 -0.270 17569 8970 1 14 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.125 0.094 17569 8971 1 14 . 1 1 129 129 VAL H H 283 7.990 7.990 8.110 -0.120 17569 8972 1 14 . 1 1 130 130 PHE N N 284 118.594 118.594 119.145 -0.551 17569 8973 1 14 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.290 -0.277 17569 8974 1 14 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.280 2.220 17569 8975 1 14 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.158 0.837 17569 8976 1 14 . 1 1 130 130 PHE H H 284 8.190 8.190 8.149 0.041 17569 8977 1 14 . 1 1 131 131 GLU N N 285 120.905 120.905 120.930 -0.025 17569 8978 1 14 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.040 0.165 17569 8979 1 14 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.662 -0.448 17569 8980 1 14 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.379 0.121 17569 8981 1 14 . 1 1 131 131 GLU H H 285 8.699 8.699 8.880 -0.181 17569 8982 1 14 . 1 1 132 132 ASN N N 286 117.997 117.997 118.273 -0.276 17569 8983 1 14 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.663 -0.068 17569 8984 1 14 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.043 -0.428 17569 8985 1 14 . 1 1 132 132 ASN CB C 286 38.852 38.852 39.135 -0.283 17569 8986 1 14 . 1 1 132 132 ASN H H 286 8.082 8.082 8.078 0.004 17569 8987 1 14 . 1 1 133 133 LEU N N 287 120.800 120.800 122.060 -1.260 17569 8988 1 14 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.340 -0.223 17569 8989 1 14 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.339 -0.541 17569 8990 1 14 . 1 1 133 133 LEU H H 287 7.904 7.904 8.634 -0.730 17569 8991 1 14 . 1 1 134 134 GLU N N 288 118.200 118.200 118.761 -0.561 17569 8992 1 14 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.930 0.149 17569 8993 1 14 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.012 -1.015 17569 8994 1 14 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.315 -0.073 17569 8995 1 14 . 1 1 134 134 GLU H H 288 8.157 8.157 8.451 -0.294 17569 8996 1 14 . 1 1 135 135 GLN N N 289 117.400 117.400 117.974 -0.574 17569 8997 1 14 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.095 0.079 17569 8998 1 14 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.425 -0.436 17569 8999 1 14 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.517 -0.437 17569 9000 1 14 . 1 1 135 135 GLN H H 289 7.869 7.869 7.752 0.117 17569 9001 1 14 . 1 1 136 136 LEU N N 290 121.000 121.000 121.705 -0.705 17569 9002 1 14 . 1 1 136 136 LEU HA H 290 4.173 4.173 4.019 0.154 17569 9003 1 14 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.785 -0.647 17569 9004 1 14 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.820 0.180 17569 9005 1 14 . 1 1 136 136 LEU H H 290 7.968 7.968 7.827 0.141 17569 9006 1 14 . 1 1 137 137 LEU N N 291 118.900 118.900 118.629 0.271 17569 9007 1 14 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.011 0.230 17569 9008 1 14 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.618 -1.258 17569 9009 1 14 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.359 -0.887 17569 9010 1 14 . 1 1 137 137 LEU H H 291 8.154 8.154 7.695 0.459 17569 9011 1 14 . 1 1 138 138 GLN N N 292 117.993 117.993 114.088 3.905 17569 9012 1 14 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.429 -0.157 17569 9013 1 14 . 1 1 138 138 GLN CA C 292 56.632 56.632 55.297 1.335 17569 9014 1 14 . 1 1 138 138 GLN CB C 292 28.584 28.584 28.697 -0.113 17569 9015 1 14 . 1 1 138 138 GLN H H 292 7.896 7.896 7.492 0.404 17569 9016 1 14 . 1 1 139 139 GLN N N 293 118.889 118.889 119.574 -0.685 17569 9017 1 14 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.307 -0.038 17569 9018 1 14 . 1 1 139 139 GLN CA C 293 56.454 56.454 57.055 -0.601 17569 9019 1 14 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.970 -0.901 17569 9020 1 14 . 1 1 139 139 GLN H H 293 8.091 8.091 7.489 0.602 17569 9021 1 14 . 1 1 140 140 ASN N N 294 118.604 118.604 117.937 0.667 17569 9022 1 14 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.870 -0.111 17569 9023 1 14 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.553 -0.332 17569 9024 1 14 . 1 1 140 140 ASN CB C 294 38.733 38.733 38.728 0.005 17569 9025 1 14 . 1 1 140 140 ASN H H 294 8.273 8.273 8.384 -0.111 17569 9026 1 14 . 1 1 141 141 LYS N N 295 121.685 121.685 122.240 -0.555 17569 9027 1 14 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.572 -0.212 17569 9028 1 14 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.140 0.033 17569 9029 1 14 . 1 1 141 141 LYS CB C 295 32.535 32.535 34.010 -1.475 17569 9030 1 14 . 1 1 141 141 LYS H H 295 8.089 8.089 8.334 -0.245 17569 9031 1 15 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.736 -0.349 17569 9032 1 15 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.407 0.038 17569 9033 1 15 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.963 -0.707 17569 9034 1 15 . 1 1 3 3 MET HA H 157 4.476 4.476 4.713 -0.237 17569 9035 1 15 . 1 1 3 3 MET CA C 157 55.401 55.401 55.240 0.161 17569 9036 1 15 . 1 1 4 4 ALA N N 158 124.828 124.828 125.502 -0.674 17569 9037 1 15 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.559 -0.245 17569 9038 1 15 . 1 1 4 4 ALA CA C 158 52.511 52.511 52.299 0.212 17569 9039 1 15 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.959 -0.958 17569 9040 1 15 . 1 1 4 4 ALA H H 158 8.382 8.382 8.311 0.071 17569 9041 1 15 . 1 1 5 5 ASP N N 159 119.418 119.418 123.477 -4.059 17569 9042 1 15 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.738 -0.148 17569 9043 1 15 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.462 -0.326 17569 9044 1 15 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.773 -0.758 17569 9045 1 15 . 1 1 5 5 ASP H H 159 8.312 8.312 8.542 -0.230 17569 9046 1 15 . 1 1 6 6 LYS N N 160 121.604 121.604 118.954 2.650 17569 9047 1 15 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.465 -0.122 17569 9048 1 15 . 1 1 6 6 LYS H H 160 8.274 8.274 7.868 0.406 17569 9049 1 15 . 1 1 7 7 ARG N N 161 121.611 121.611 118.789 2.822 17569 9050 1 15 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.149 0.178 17569 9051 1 15 . 1 1 7 7 ARG H H 161 8.430 8.430 8.704 -0.274 17569 9052 1 15 . 1 1 8 8 GLY N N 162 109.606 109.606 106.853 2.753 17569 9053 1 15 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.052 -0.005 17569 9054 1 15 . 1 1 8 8 GLY H H 162 8.473 8.473 8.129 0.344 17569 9055 1 15 . 1 1 9 9 ASP N N 163 120.187 120.187 119.577 0.610 17569 9056 1 15 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.748 -0.099 17569 9057 1 15 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.740 0.411 17569 9058 1 15 . 1 1 9 9 ASP H H 163 8.296 8.296 7.972 0.324 17569 9059 1 15 . 1 1 10 10 GLY N N 164 108.816 108.816 111.293 -2.477 17569 9060 1 15 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.362 0.005 17569 9061 1 15 . 1 1 10 10 GLY H H 164 8.458 8.458 8.590 -0.132 17569 9062 1 15 . 1 1 11 11 LEU N N 165 121.195 121.195 120.658 0.537 17569 9063 1 15 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.506 -0.190 17569 9064 1 15 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.258 0.742 17569 9065 1 15 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.849 -0.916 17569 9066 1 15 . 1 1 11 11 LEU H H 165 8.137 8.137 7.988 0.149 17569 9067 1 15 . 1 1 12 12 HIS N N 166 119.387 119.387 119.303 0.084 17569 9068 1 15 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.774 -0.119 17569 9069 1 15 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.867 0.402 17569 9070 1 15 . 1 1 12 12 HIS CB C 166 30.697 30.697 30.617 0.080 17569 9071 1 15 . 1 1 12 12 HIS H H 166 8.270 8.270 8.250 0.020 17569 9072 1 15 . 1 1 13 13 GLY N N 167 109.899 109.899 112.613 -2.714 17569 9073 1 15 . 1 1 13 13 GLY CA C 167 45.105 45.105 45.228 -0.123 17569 9074 1 15 . 1 1 13 13 GLY H H 167 8.276 8.276 8.488 -0.212 17569 9075 1 15 . 1 1 14 14 ILE N N 168 119.597 119.597 122.610 -3.013 17569 9076 1 15 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.259 0.064 17569 9077 1 15 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.964 0.636 17569 9078 1 15 . 1 1 14 14 ILE CB C 168 38.950 38.950 40.883 -1.933 17569 9079 1 15 . 1 1 14 14 ILE H H 168 7.962 7.962 8.076 -0.114 17569 9080 1 15 . 1 1 15 15 VAL N N 169 127.578 127.578 124.856 2.722 17569 9081 1 15 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.066 0.214 17569 9082 1 15 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.548 -1.231 17569 9083 1 15 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.300 3.102 17569 9084 1 15 . 1 1 15 15 VAL H H 169 9.011 9.011 8.416 0.595 17569 9085 1 15 . 1 1 16 16 SER N N 170 118.596 118.596 120.644 -2.048 17569 9086 1 15 . 1 1 16 16 SER HA H 170 5.140 5.140 4.636 0.504 17569 9087 1 15 . 1 1 16 16 SER CA C 170 55.985 55.985 56.803 -0.818 17569 9088 1 15 . 1 1 16 16 SER CB C 170 65.261 65.261 66.016 -0.755 17569 9089 1 15 . 1 1 16 16 SER H H 170 8.242 8.242 7.774 0.468 17569 9090 1 15 . 1 1 17 17 CYS N N 171 123.783 123.783 122.885 0.898 17569 9091 1 15 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.139 0.042 17569 9092 1 15 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.480 -0.635 17569 9093 1 15 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.870 2.503 17569 9094 1 15 . 1 1 17 17 CYS H H 171 8.894 8.894 8.522 0.372 17569 9095 1 15 . 1 1 18 18 THR N N 172 121.703 121.703 117.924 3.779 17569 9096 1 15 . 1 1 18 18 THR HA H 172 4.386 4.386 4.091 0.295 17569 9097 1 15 . 1 1 18 18 THR CA C 172 64.667 64.667 64.520 0.147 17569 9098 1 15 . 1 1 18 18 THR CB C 172 69.498 69.498 68.656 0.842 17569 9099 1 15 . 1 1 18 18 THR H H 172 8.788 8.788 8.218 0.570 17569 9100 1 15 . 1 1 19 19 ALA N N 173 131.364 131.364 122.366 8.998 17569 9101 1 15 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.172 0.324 17569 9102 1 15 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.655 0.370 17569 9103 1 15 . 1 1 19 19 ALA CB C 173 22.182 22.182 19.014 3.168 17569 9104 1 15 . 1 1 19 19 ALA H H 173 9.680 9.680 7.857 1.823 17569 9105 1 15 . 1 1 20 20 CYS N N 174 115.498 115.498 113.737 1.761 17569 9106 1 15 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.349 0.619 17569 9107 1 15 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.795 -1.701 17569 9108 1 15 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.503 3.741 17569 9109 1 15 . 1 1 20 20 CYS H H 174 8.470 8.470 7.663 0.807 17569 9110 1 15 . 1 1 21 21 GLY N N 175 112.464 112.464 107.973 4.491 17569 9111 1 15 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.114 0.592 17569 9112 1 15 . 1 1 21 21 GLY H H 175 7.884 7.884 7.850 0.034 17569 9113 1 15 . 1 1 22 22 GLN N N 176 121.784 121.784 118.215 3.569 17569 9114 1 15 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.436 -0.060 17569 9115 1 15 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.530 1.761 17569 9116 1 15 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.649 -2.308 17569 9117 1 15 . 1 1 22 22 GLN H H 176 8.723 8.723 7.894 0.829 17569 9118 1 15 . 1 1 23 23 GLN N N 177 122.900 122.900 123.566 -0.666 17569 9119 1 15 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.173 0.357 17569 9120 1 15 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.906 -0.356 17569 9121 1 15 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.297 -0.837 17569 9122 1 15 . 1 1 23 23 GLN H H 177 8.721 8.721 8.554 0.167 17569 9123 1 15 . 1 1 24 24 VAL N N 178 121.000 121.000 123.535 -2.535 17569 9124 1 15 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.020 0.504 17569 9125 1 15 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.047 -2.170 17569 9126 1 15 . 1 1 24 24 VAL H H 178 8.689 8.689 7.801 0.888 17569 9127 1 15 . 1 1 25 25 ASN N N 179 121.392 121.392 123.704 -2.312 17569 9128 1 15 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.254 0.622 17569 9129 1 15 . 1 1 25 25 ASN CA C 179 52.149 52.149 53.978 -1.829 17569 9130 1 15 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.141 -0.164 17569 9131 1 15 . 1 1 25 25 ASN H H 179 8.635 8.635 8.670 -0.035 17569 9132 1 15 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.676 -0.216 17569 9133 1 15 . 1 1 27 27 PHE CA C 181 56.998 56.998 57.461 -0.463 17569 9134 1 15 . 1 1 27 27 PHE CB C 181 38.393 38.393 40.292 -1.899 17569 9135 1 15 . 1 1 28 28 GLN N N 182 119.300 119.300 121.742 -2.442 17569 9136 1 15 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.440 0.078 17569 9137 1 15 . 1 1 28 28 GLN CA C 182 54.342 54.342 55.848 -1.506 17569 9138 1 15 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.246 0.104 17569 9139 1 15 . 1 1 28 28 GLN H H 182 7.494 7.494 7.518 -0.024 17569 9140 1 15 . 1 1 29 29 LYS N N 183 124.516 124.516 124.973 -0.457 17569 9141 1 15 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.498 -0.576 17569 9142 1 15 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.458 1.854 17569 9143 1 15 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.483 -0.197 17569 9144 1 15 . 1 1 29 29 LYS H H 183 8.779 8.779 8.550 0.229 17569 9145 1 15 . 1 1 30 30 ASP N N 184 116.500 116.500 118.465 -1.965 17569 9146 1 15 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.817 -0.358 17569 9147 1 15 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.277 0.259 17569 9148 1 15 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.190 -1.219 17569 9149 1 15 . 1 1 30 30 ASP H H 184 8.556 8.556 8.207 0.349 17569 9150 1 15 . 1 1 31 31 SER N N 185 111.505 111.505 115.599 -4.094 17569 9151 1 15 . 1 1 31 31 SER HA H 185 4.695 4.695 4.727 -0.032 17569 9152 1 15 . 1 1 31 31 SER CA C 185 59.747 59.747 58.879 0.869 17569 9153 1 15 . 1 1 31 31 SER CB C 185 65.198 65.198 63.504 1.694 17569 9154 1 15 . 1 1 31 31 SER H H 185 7.933 7.933 8.674 -0.741 17569 9155 1 15 . 1 1 32 32 ILE N N 186 113.394 113.394 116.504 -3.110 17569 9156 1 15 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.124 -0.238 17569 9157 1 15 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.272 -0.693 17569 9158 1 15 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.803 1.009 17569 9159 1 15 . 1 1 32 32 ILE H H 186 7.105 7.105 7.604 -0.499 17569 9160 1 15 . 1 1 33 33 TYR N N 187 119.098 119.098 120.611 -1.513 17569 9161 1 15 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.126 -0.603 17569 9162 1 15 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.286 0.974 17569 9163 1 15 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.550 2.890 17569 9164 1 15 . 1 1 33 33 TYR H H 187 8.954 8.954 7.927 1.027 17569 9165 1 15 . 1 1 34 34 ARG N N 188 118.502 118.502 122.587 -4.085 17569 9166 1 15 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.843 -0.206 17569 9167 1 15 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.291 -1.539 17569 9168 1 15 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.130 1.121 17569 9169 1 15 . 1 1 34 34 ARG H H 188 8.412 8.412 8.554 -0.142 17569 9170 1 15 . 1 1 35 35 HIS N N 189 126.596 126.596 127.688 -1.092 17569 9171 1 15 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.916 -0.324 17569 9172 1 15 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.881 -0.160 17569 9173 1 15 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.133 1.339 17569 9174 1 15 . 1 1 35 35 HIS H H 189 9.813 9.813 9.086 0.727 17569 9175 1 15 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.561 -0.263 17569 9176 1 15 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.853 0.423 17569 9177 1 15 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.215 0.636 17569 9178 1 15 . 1 1 37 37 SER N N 191 110.003 110.003 113.554 -3.551 17569 9179 1 15 . 1 1 37 37 SER HA H 191 4.918 4.918 4.327 0.591 17569 9180 1 15 . 1 1 37 37 SER CA C 191 59.031 59.031 61.370 -2.339 17569 9181 1 15 . 1 1 37 37 SER CB C 191 65.104 65.104 63.361 1.742 17569 9182 1 15 . 1 1 37 37 SER H H 191 8.934 8.934 8.634 0.300 17569 9183 1 15 . 1 1 38 38 LEU N N 192 120.959 120.959 113.748 7.211 17569 9184 1 15 . 1 1 38 38 LEU HA H 192 4.129 4.129 5.039 -0.910 17569 9185 1 15 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.148 1.998 17569 9186 1 15 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.431 1.565 17569 9187 1 15 . 1 1 38 38 LEU H H 192 8.649 8.649 7.009 1.640 17569 9188 1 15 . 1 1 39 39 GLN N N 193 108.600 108.600 119.437 -10.837 17569 9189 1 15 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.109 -0.204 17569 9190 1 15 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.612 0.202 17569 9191 1 15 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.226 -2.192 17569 9192 1 15 . 1 1 39 39 GLN H H 193 8.465 8.465 7.865 0.600 17569 9193 1 15 . 1 1 40 40 VAL N N 194 105.325 105.325 118.602 -13.277 17569 9194 1 15 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.499 0.051 17569 9195 1 15 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.847 -1.206 17569 9196 1 15 . 1 1 40 40 VAL H H 194 6.256 6.256 7.890 -1.634 17569 9197 1 15 . 1 1 41 41 LEU N N 195 123.100 123.100 122.157 0.943 17569 9198 1 15 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.775 0.041 17569 9199 1 15 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.403 3.779 17569 9200 1 15 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.121 0.449 17569 9201 1 15 . 1 1 41 41 LEU H H 195 9.154 9.154 8.508 0.646 17569 9202 1 15 . 1 1 42 42 ILE N N 196 124.396 124.396 116.963 7.433 17569 9203 1 15 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.829 1.523 17569 9204 1 15 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.301 0.929 17569 9205 1 15 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.877 1.393 17569 9206 1 15 . 1 1 42 42 ILE H H 196 9.766 9.766 7.798 1.968 17569 9207 1 15 . 1 1 43 43 CYS N N 197 121.500 121.500 114.906 6.594 17569 9208 1 15 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.286 -0.024 17569 9209 1 15 . 1 1 43 43 CYS CA C 197 56.703 56.703 55.911 0.792 17569 9210 1 15 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.044 2.256 17569 9211 1 15 . 1 1 43 43 CYS H H 197 9.882 9.882 8.322 1.560 17569 9212 1 15 . 1 1 44 44 LYS N N 198 117.995 117.995 121.945 -3.950 17569 9213 1 15 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.167 -0.178 17569 9214 1 15 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.261 -0.601 17569 9215 1 15 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.515 0.185 17569 9216 1 15 . 1 1 44 44 LYS H H 198 8.089 8.089 8.582 -0.493 17569 9217 1 15 . 1 1 45 45 ASN N N 199 119.200 119.200 117.665 1.535 17569 9218 1 15 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.552 -0.038 17569 9219 1 15 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.465 0.255 17569 9220 1 15 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.407 -0.240 17569 9221 1 15 . 1 1 45 45 ASN H H 199 8.356 8.356 8.683 -0.327 17569 9222 1 15 . 1 1 46 46 CYS N N 200 126.600 126.600 118.399 8.201 17569 9223 1 15 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.986 0.195 17569 9224 1 15 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.280 2.215 17569 9225 1 15 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.064 2.118 17569 9226 1 15 . 1 1 46 46 CYS H H 200 9.189 9.189 7.740 1.449 17569 9227 1 15 . 1 1 47 47 PHE N N 201 121.962 121.962 120.314 1.648 17569 9228 1 15 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.136 -0.266 17569 9229 1 15 . 1 1 47 47 PHE CA C 201 62.269 62.269 61.043 1.226 17569 9230 1 15 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.547 0.620 17569 9231 1 15 . 1 1 47 47 PHE H H 201 8.826 8.826 7.765 1.061 17569 9232 1 15 . 1 1 48 48 LYS N N 202 117.400 117.400 120.041 -2.641 17569 9233 1 15 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.942 -0.244 17569 9234 1 15 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.623 -0.671 17569 9235 1 15 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.011 -0.469 17569 9236 1 15 . 1 1 48 48 LYS H H 202 8.512 8.512 8.195 0.317 17569 9237 1 15 . 1 1 49 49 TYR N N 203 120.400 120.400 121.617 -1.217 17569 9238 1 15 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.305 0.109 17569 9239 1 15 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.428 -0.656 17569 9240 1 15 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.837 -0.391 17569 9241 1 15 . 1 1 49 49 TYR H H 203 8.133 8.133 7.814 0.319 17569 9242 1 15 . 1 1 50 50 TYR N N 204 121.783 121.783 118.100 3.683 17569 9243 1 15 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.595 -1.100 17569 9244 1 15 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.140 2.810 17569 9245 1 15 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.565 0.927 17569 9246 1 15 . 1 1 50 50 TYR H H 204 8.765 8.765 7.686 1.079 17569 9247 1 15 . 1 1 51 51 MET N N 205 110.800 110.800 115.044 -4.244 17569 9248 1 15 . 1 1 51 51 MET HA H 205 4.349 4.349 4.189 0.160 17569 9249 1 15 . 1 1 51 51 MET CA C 205 53.505 53.505 57.849 -4.344 17569 9250 1 15 . 1 1 51 51 MET CB C 205 30.384 30.384 33.577 -3.193 17569 9251 1 15 . 1 1 51 51 MET H H 205 7.771 7.771 8.413 -0.642 17569 9252 1 15 . 1 1 52 52 SER N N 206 116.800 116.800 113.337 3.463 17569 9253 1 15 . 1 1 52 52 SER HA H 206 3.919 3.919 4.319 -0.400 17569 9254 1 15 . 1 1 52 52 SER CA C 206 61.621 61.621 59.928 1.693 17569 9255 1 15 . 1 1 52 52 SER CB C 206 62.611 62.611 64.302 -1.690 17569 9256 1 15 . 1 1 52 52 SER H H 206 7.581 7.581 8.154 -0.573 17569 9257 1 15 . 1 1 53 53 ASP N N 207 117.400 117.400 122.391 -4.991 17569 9258 1 15 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.767 -0.195 17569 9259 1 15 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.604 -0.505 17569 9260 1 15 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.844 0.344 17569 9261 1 15 . 1 1 53 53 ASP H H 207 7.085 7.085 8.133 -1.048 17569 9262 1 15 . 1 1 54 54 ASP N N 208 119.405 119.405 122.528 -3.123 17569 9263 1 15 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.945 -0.556 17569 9264 1 15 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.441 0.459 17569 9265 1 15 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.654 -1.305 17569 9266 1 15 . 1 1 54 54 ASP H H 208 8.439 8.439 8.417 0.022 17569 9267 1 15 . 1 1 55 55 ILE N N 209 124.698 124.698 120.599 4.099 17569 9268 1 15 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.267 -0.267 17569 9269 1 15 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.696 1.582 17569 9270 1 15 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.249 1.042 17569 9271 1 15 . 1 1 55 55 ILE H H 209 8.128 8.128 8.337 -0.209 17569 9272 1 15 . 1 1 56 56 SER N N 210 126.703 126.703 118.646 8.057 17569 9273 1 15 . 1 1 56 56 SER HA H 210 4.365 4.365 4.753 -0.388 17569 9274 1 15 . 1 1 56 56 SER CA C 210 57.769 57.769 57.425 0.344 17569 9275 1 15 . 1 1 56 56 SER CB C 210 64.991 64.991 64.685 0.306 17569 9276 1 15 . 1 1 56 56 SER H H 210 8.815 8.815 8.730 0.085 17569 9277 1 15 . 1 1 57 57 ARG N N 211 116.885 116.885 120.504 -3.619 17569 9278 1 15 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.970 0.072 17569 9279 1 15 . 1 1 57 57 ARG CA C 211 54.400 54.400 54.656 -0.256 17569 9280 1 15 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.541 2.743 17569 9281 1 15 . 1 1 57 57 ARG H H 211 8.365 8.365 8.391 -0.026 17569 9282 1 15 . 1 1 58 58 ASP N N 212 121.982 121.982 124.729 -2.747 17569 9283 1 15 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.516 0.099 17569 9284 1 15 . 1 1 58 58 ASP CA C 212 52.222 52.222 55.049 -2.827 17569 9285 1 15 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.451 -0.949 17569 9286 1 15 . 1 1 58 58 ASP H H 212 8.706 8.706 8.251 0.455 17569 9287 1 15 . 1 1 59 59 SER N N 213 114.164 114.164 115.944 -1.780 17569 9288 1 15 . 1 1 59 59 SER HA H 213 4.212 4.212 4.189 0.023 17569 9289 1 15 . 1 1 59 59 SER CA C 213 60.840 60.840 60.503 0.337 17569 9290 1 15 . 1 1 59 59 SER CB C 213 62.714 62.714 63.409 -0.695 17569 9291 1 15 . 1 1 59 59 SER H H 213 8.687 8.687 8.804 -0.117 17569 9292 1 15 . 1 1 60 60 ASP N N 214 120.899 120.899 119.793 1.106 17569 9293 1 15 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.660 0.165 17569 9294 1 15 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.333 0.878 17569 9295 1 15 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.735 0.823 17569 9296 1 15 . 1 1 60 60 ASP H H 214 8.193 8.193 7.913 0.280 17569 9297 1 15 . 1 1 61 61 GLY N N 215 108.300 108.300 108.089 0.211 17569 9298 1 15 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.996 -0.599 17569 9299 1 15 . 1 1 61 61 GLY H H 215 8.234 8.234 8.165 0.069 17569 9300 1 15 . 1 1 62 62 MET N N 216 120.002 120.002 117.629 2.373 17569 9301 1 15 . 1 1 62 62 MET HA H 216 4.972 4.972 4.531 0.441 17569 9302 1 15 . 1 1 62 62 MET CA C 216 53.151 53.151 54.946 -1.795 17569 9303 1 15 . 1 1 62 62 MET CB C 216 32.311 32.311 35.309 -2.998 17569 9304 1 15 . 1 1 62 62 MET H H 216 8.376 8.376 7.330 1.046 17569 9305 1 15 . 1 1 63 63 ASP N N 217 127.300 127.300 119.727 7.573 17569 9306 1 15 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.823 0.143 17569 9307 1 15 . 1 1 63 63 ASP CA C 217 55.569 55.569 54.162 1.407 17569 9308 1 15 . 1 1 63 63 ASP H H 217 9.368 9.368 8.415 0.953 17569 9309 1 15 . 1 1 64 64 GLU N N 218 114.400 114.400 125.953 -11.553 17569 9310 1 15 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.504 -0.348 17569 9311 1 15 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.687 0.163 17569 9312 1 15 . 1 1 64 64 GLU H H 218 8.583 8.583 8.650 -0.067 17569 9313 1 15 . 1 1 65 65 GLN N N 219 115.500 115.500 117.016 -1.516 17569 9314 1 15 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.477 -0.166 17569 9315 1 15 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.347 -0.001 17569 9316 1 15 . 1 1 65 65 GLN H H 219 7.158 7.158 7.621 -0.463 17569 9317 1 15 . 1 1 66 66 CYS N N 220 122.600 122.600 117.651 4.949 17569 9318 1 15 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.449 -1.372 17569 9319 1 15 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.648 0.881 17569 9320 1 15 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.272 1.700 17569 9321 1 15 . 1 1 66 66 CYS H H 220 8.248 8.248 8.378 -0.130 17569 9322 1 15 . 1 1 67 67 ARG N N 221 130.363 130.363 124.282 6.081 17569 9323 1 15 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.508 -0.441 17569 9324 1 15 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.505 -2.490 17569 9325 1 15 . 1 1 67 67 ARG H H 221 9.145 9.145 8.872 0.273 17569 9326 1 15 . 1 1 68 68 TRP N N 222 124.200 124.200 120.495 3.705 17569 9327 1 15 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.752 -0.316 17569 9328 1 15 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.239 0.841 17569 9329 1 15 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.667 0.527 17569 9330 1 15 . 1 1 68 68 TRP H H 222 9.689 9.689 8.263 1.426 17569 9331 1 15 . 1 1 69 69 CYS N N 223 116.297 116.297 110.662 5.635 17569 9332 1 15 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.048 0.043 17569 9333 1 15 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.982 3.120 17569 9334 1 15 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.674 4.664 17569 9335 1 15 . 1 1 69 69 CYS H H 223 8.822 8.822 7.706 1.116 17569 9336 1 15 . 1 1 70 70 ALA N N 224 123.112 123.112 123.824 -0.712 17569 9337 1 15 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.340 0.066 17569 9338 1 15 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.081 -0.230 17569 9339 1 15 . 1 1 70 70 ALA CB C 224 17.720 17.720 18.009 -0.289 17569 9340 1 15 . 1 1 70 70 ALA H H 224 8.787 8.787 8.210 0.577 17569 9341 1 15 . 1 1 71 71 GLU N N 225 118.300 118.300 120.073 -1.773 17569 9342 1 15 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.497 0.811 17569 9343 1 15 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.924 -2.625 17569 9344 1 15 . 1 1 71 71 GLU H H 225 8.541 8.541 8.185 0.356 17569 9345 1 15 . 1 1 72 72 GLY N N 226 111.995 111.995 110.392 1.603 17569 9346 1 15 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.127 -0.724 17569 9347 1 15 . 1 1 72 72 GLY H H 226 9.837 9.837 8.491 1.346 17569 9348 1 15 . 1 1 73 73 GLY N N 227 106.600 106.600 106.846 -0.246 17569 9349 1 15 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.977 0.994 17569 9350 1 15 . 1 1 73 73 GLY H H 227 7.772 7.772 8.320 -0.548 17569 9351 1 15 . 1 1 74 74 ASN N N 228 124.277 124.277 119.107 5.170 17569 9352 1 15 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.460 0.621 17569 9353 1 15 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.901 -0.801 17569 9354 1 15 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.336 -0.252 17569 9355 1 15 . 1 1 74 74 ASN H H 228 8.876 8.876 8.544 0.332 17569 9356 1 15 . 1 1 75 75 LEU N N 229 123.050 123.050 122.114 0.936 17569 9357 1 15 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.808 -0.208 17569 9358 1 15 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.387 0.975 17569 9359 1 15 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.511 -0.011 17569 9360 1 15 . 1 1 75 75 LEU H H 229 8.901 8.901 8.014 0.887 17569 9361 1 15 . 1 1 76 76 ILE N N 230 123.552 123.552 123.587 -0.035 17569 9362 1 15 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.175 0.310 17569 9363 1 15 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.099 -0.399 17569 9364 1 15 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.818 -0.419 17569 9365 1 15 . 1 1 76 76 ILE H H 230 9.406 9.406 9.141 0.265 17569 9366 1 15 . 1 1 77 77 CYS N N 231 124.637 124.637 124.786 -0.149 17569 9367 1 15 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.508 -0.633 17569 9368 1 15 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.082 1.277 17569 9369 1 15 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.127 0.307 17569 9370 1 15 . 1 1 77 77 CYS H H 231 8.809 8.809 8.604 0.205 17569 9371 1 15 . 1 1 78 78 CYS N N 232 125.697 125.697 122.277 3.420 17569 9372 1 15 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.902 -0.618 17569 9373 1 15 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.625 3.259 17569 9374 1 15 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.710 1.460 17569 9375 1 15 . 1 1 78 78 CYS H H 232 8.579 8.579 8.590 -0.011 17569 9376 1 15 . 1 1 79 79 ASP N N 233 123.600 123.600 124.962 -1.362 17569 9377 1 15 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.644 0.113 17569 9378 1 15 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.300 2.689 17569 9379 1 15 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.765 0.864 17569 9380 1 15 . 1 1 79 79 ASP H H 233 8.577 8.577 8.345 0.232 17569 9381 1 15 . 1 1 80 80 PHE N N 234 122.100 122.100 116.639 5.461 17569 9382 1 15 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.548 -0.022 17569 9383 1 15 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.189 1.720 17569 9384 1 15 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.376 1.473 17569 9385 1 15 . 1 1 80 80 PHE H H 234 10.432 10.432 7.335 3.097 17569 9386 1 15 . 1 1 81 81 CYS N N 235 124.300 124.300 117.543 6.757 17569 9387 1 15 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.708 0.448 17569 9388 1 15 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.010 0.035 17569 9389 1 15 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.726 3.681 17569 9390 1 15 . 1 1 81 81 CYS H H 235 8.476 8.476 7.957 0.519 17569 9391 1 15 . 1 1 82 82 HIS N N 236 112.598 112.598 118.755 -6.157 17569 9392 1 15 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.174 0.809 17569 9393 1 15 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.671 -1.273 17569 9394 1 15 . 1 1 82 82 HIS CB C 236 30.257 30.257 28.109 2.148 17569 9395 1 15 . 1 1 82 82 HIS H H 236 6.699 6.699 7.992 -1.293 17569 9396 1 15 . 1 1 83 83 ASN N N 237 123.600 123.600 119.250 4.350 17569 9397 1 15 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.839 -0.038 17569 9398 1 15 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.820 2.796 17569 9399 1 15 . 1 1 83 83 ASN H H 237 9.097 9.097 7.959 1.138 17569 9400 1 15 . 1 1 84 84 ALA N N 238 122.000 122.000 124.692 -2.692 17569 9401 1 15 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.233 0.176 17569 9402 1 15 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.097 0.267 17569 9403 1 15 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.061 3.009 17569 9404 1 15 . 1 1 84 84 ALA H H 238 9.885 9.885 8.448 1.437 17569 9405 1 15 . 1 1 85 85 PHE N N 239 116.707 116.707 121.630 -4.923 17569 9406 1 15 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.159 0.869 17569 9407 1 15 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.021 0.196 17569 9408 1 15 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.320 2.344 17569 9409 1 15 . 1 1 85 85 PHE H H 239 9.450 9.450 9.118 0.332 17569 9410 1 15 . 1 1 86 86 CYS N N 240 126.682 126.682 124.835 1.847 17569 9411 1 15 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.762 0.860 17569 9412 1 15 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.879 -0.537 17569 9413 1 15 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.133 3.124 17569 9414 1 15 . 1 1 86 86 CYS H H 240 11.309 11.309 9.542 1.767 17569 9415 1 15 . 1 1 87 87 LYS N N 241 117.865 117.865 124.296 -6.431 17569 9416 1 15 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.933 -0.084 17569 9417 1 15 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.030 0.040 17569 9418 1 15 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.466 0.332 17569 9419 1 15 . 1 1 87 87 LYS H H 241 8.230 8.230 8.859 -0.629 17569 9420 1 15 . 1 1 88 88 LYS N N 242 117.949 117.949 118.395 -0.446 17569 9421 1 15 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.107 -0.129 17569 9422 1 15 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.091 1.279 17569 9423 1 15 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.118 0.198 17569 9424 1 15 . 1 1 88 88 LYS H H 242 7.945 7.945 8.521 -0.576 17569 9425 1 15 . 1 1 89 89 CYS N N 243 125.305 125.305 117.329 7.976 17569 9426 1 15 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.269 -0.527 17569 9427 1 15 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.223 2.604 17569 9428 1 15 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.405 0.836 17569 9429 1 15 . 1 1 89 89 CYS H H 243 9.297 9.297 7.673 1.624 17569 9430 1 15 . 1 1 90 90 ILE N N 244 119.687 119.687 121.672 -1.985 17569 9431 1 15 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.009 -0.402 17569 9432 1 15 . 1 1 90 90 ILE CA C 244 65.950 65.950 64.183 1.767 17569 9433 1 15 . 1 1 90 90 ILE H H 244 7.997 7.997 7.657 0.340 17569 9434 1 15 . 1 1 91 91 LEU N N 245 120.280 120.280 121.393 -1.113 17569 9435 1 15 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.236 -0.551 17569 9436 1 15 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.816 0.419 17569 9437 1 15 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.998 -0.040 17569 9438 1 15 . 1 1 91 91 LEU H H 245 8.810 8.810 8.864 -0.054 17569 9439 1 15 . 1 1 92 92 ARG N N 246 116.901 116.901 116.753 0.148 17569 9440 1 15 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.117 -0.300 17569 9441 1 15 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.651 1.329 17569 9442 1 15 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.060 0.540 17569 9443 1 15 . 1 1 92 92 ARG H H 246 8.086 8.086 7.718 0.368 17569 9444 1 15 . 1 1 93 93 ASN N N 247 111.200 111.200 116.387 -5.187 17569 9445 1 15 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.485 0.118 17569 9446 1 15 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.641 1.167 17569 9447 1 15 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.084 3.400 17569 9448 1 15 . 1 1 93 93 ASN H H 247 7.136 7.136 8.197 -1.061 17569 9449 1 15 . 1 1 94 94 LEU N N 248 118.807 118.807 117.476 1.331 17569 9450 1 15 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.682 0.132 17569 9451 1 15 . 1 1 94 94 LEU CA C 248 55.189 55.189 54.974 0.215 17569 9452 1 15 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.659 0.039 17569 9453 1 15 . 1 1 94 94 LEU H H 248 8.515 8.515 7.931 0.584 17569 9454 1 15 . 1 1 95 95 GLY N N 249 108.000 108.000 106.175 1.825 17569 9455 1 15 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.692 -0.064 17569 9456 1 15 . 1 1 95 95 GLY H H 249 7.955 7.955 7.862 0.093 17569 9457 1 15 . 1 1 96 96 ARG N N 250 117.797 117.797 122.186 -4.389 17569 9458 1 15 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.275 -0.432 17569 9459 1 15 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.094 0.588 17569 9460 1 15 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.161 -0.301 17569 9461 1 15 . 1 1 96 96 ARG H H 250 8.559 8.559 8.598 -0.039 17569 9462 1 15 . 1 1 97 97 LYS N N 251 120.900 120.900 119.721 1.179 17569 9463 1 15 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.046 0.110 17569 9464 1 15 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.514 -0.358 17569 9465 1 15 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.643 -0.283 17569 9466 1 15 . 1 1 97 97 LYS H H 251 8.655 8.655 8.512 0.143 17569 9467 1 15 . 1 1 98 98 GLU N N 252 122.000 122.000 118.787 3.213 17569 9468 1 15 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.102 0.249 17569 9469 1 15 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.195 -0.613 17569 9470 1 15 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.401 -1.000 17569 9471 1 15 . 1 1 98 98 GLU H H 252 7.705 7.705 8.332 -0.627 17569 9472 1 15 . 1 1 99 99 LEU N N 253 117.400 117.400 120.706 -3.306 17569 9473 1 15 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.794 0.123 17569 9474 1 15 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.048 -0.050 17569 9475 1 15 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.840 -0.358 17569 9476 1 15 . 1 1 99 99 LEU H H 253 7.285 7.285 7.701 -0.416 17569 9477 1 15 . 1 1 100 100 SER N N 254 112.100 112.100 113.990 -1.890 17569 9478 1 15 . 1 1 100 100 SER HA H 254 4.107 4.107 4.099 0.008 17569 9479 1 15 . 1 1 100 100 SER CA C 254 61.603 61.603 61.806 -0.203 17569 9480 1 15 . 1 1 100 100 SER CB C 254 62.622 62.622 63.084 -0.461 17569 9481 1 15 . 1 1 100 100 SER H H 254 8.326 8.326 7.883 0.443 17569 9482 1 15 . 1 1 101 101 THR N N 255 118.151 118.151 118.523 -0.372 17569 9483 1 15 . 1 1 101 101 THR HA H 255 4.026 4.026 4.028 -0.002 17569 9484 1 15 . 1 1 101 101 THR CA C 255 66.261 66.261 66.392 -0.131 17569 9485 1 15 . 1 1 101 101 THR CB C 255 68.735 68.735 68.863 -0.128 17569 9486 1 15 . 1 1 101 101 THR H H 255 7.972 7.972 7.720 0.252 17569 9487 1 15 . 1 1 102 102 ILE N N 256 120.100 120.100 122.716 -2.616 17569 9488 1 15 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.627 -0.164 17569 9489 1 15 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.885 -0.110 17569 9490 1 15 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.449 0.292 17569 9491 1 15 . 1 1 102 102 ILE H H 256 7.868 7.868 8.521 -0.653 17569 9492 1 15 . 1 1 103 103 MET N N 257 114.876 114.876 116.065 -1.189 17569 9493 1 15 . 1 1 103 103 MET HA H 257 4.211 4.211 4.071 0.140 17569 9494 1 15 . 1 1 103 103 MET CA C 257 55.691 55.691 58.269 -2.578 17569 9495 1 15 . 1 1 103 103 MET CB C 257 32.000 32.000 32.625 -0.625 17569 9496 1 15 . 1 1 103 103 MET H H 257 7.606 7.606 7.268 0.338 17569 9497 1 15 . 1 1 104 104 ASP N N 258 119.976 119.976 118.656 1.320 17569 9498 1 15 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.766 -0.228 17569 9499 1 15 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.690 1.222 17569 9500 1 15 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.646 0.854 17569 9501 1 15 . 1 1 104 104 ASP H H 258 7.444 7.444 7.610 -0.166 17569 9502 1 15 . 1 1 105 105 GLU N N 259 124.388 124.388 123.451 0.937 17569 9503 1 15 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.558 -0.271 17569 9504 1 15 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.801 2.770 17569 9505 1 15 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.486 0.056 17569 9506 1 15 . 1 1 105 105 GLU H H 259 8.559 8.559 8.260 0.299 17569 9507 1 15 . 1 1 106 106 ASN N N 260 117.201 117.201 118.590 -1.389 17569 9508 1 15 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.419 0.323 17569 9509 1 15 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.972 -0.229 17569 9510 1 15 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.861 1.056 17569 9511 1 15 . 1 1 106 106 ASN H H 260 8.673 8.673 8.788 -0.115 17569 9512 1 15 . 1 1 107 107 ASN N N 261 117.900 117.900 112.106 5.794 17569 9513 1 15 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.272 0.713 17569 9514 1 15 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.742 -2.440 17569 9515 1 15 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.125 3.489 17569 9516 1 15 . 1 1 107 107 ASN H H 261 7.956 7.956 8.745 -0.789 17569 9517 1 15 . 1 1 108 108 GLN N N 262 121.500 121.500 115.401 6.099 17569 9518 1 15 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.110 0.498 17569 9519 1 15 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.503 1.273 17569 9520 1 15 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.838 0.720 17569 9521 1 15 . 1 1 108 108 GLN H H 262 8.493 8.493 7.766 0.727 17569 9522 1 15 . 1 1 109 109 TRP N N 263 128.056 128.056 123.393 4.663 17569 9523 1 15 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.634 0.337 17569 9524 1 15 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.647 0.450 17569 9525 1 15 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.551 0.942 17569 9526 1 15 . 1 1 109 109 TRP H H 263 10.497 10.497 8.282 2.215 17569 9527 1 15 . 1 1 110 110 TYR N N 264 126.600 126.600 126.192 0.408 17569 9528 1 15 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.234 0.168 17569 9529 1 15 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.985 -3.314 17569 9530 1 15 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.680 -0.672 17569 9531 1 15 . 1 1 110 110 TYR H H 264 7.545 7.545 8.096 -0.551 17569 9532 1 15 . 1 1 111 111 CYS N N 265 124.622 124.622 114.217 10.405 17569 9533 1 15 . 1 1 111 111 CYS H H 265 8.586 8.586 8.426 0.160 17569 9534 1 15 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.836 -0.644 17569 9535 1 15 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.795 0.920 17569 9536 1 15 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.694 1.226 17569 9537 1 15 . 1 1 113 113 ILE N N 267 119.504 119.504 119.792 -0.288 17569 9538 1 15 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.729 -0.779 17569 9539 1 15 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.967 0.282 17569 9540 1 15 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.538 -3.005 17569 9541 1 15 . 1 1 113 113 ILE H H 267 9.160 9.160 7.510 1.650 17569 9542 1 15 . 1 1 114 114 CYS N N 268 124.100 124.100 118.339 5.761 17569 9543 1 15 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.163 -0.349 17569 9544 1 15 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.659 3.641 17569 9545 1 15 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.063 2.658 17569 9546 1 15 . 1 1 114 114 CYS H H 268 7.818 7.818 8.238 -0.420 17569 9547 1 15 . 1 1 115 115 HIS N N 269 117.127 117.127 111.165 5.962 17569 9548 1 15 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.660 0.469 17569 9549 1 15 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.039 -0.878 17569 9550 1 15 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.802 2.390 17569 9551 1 15 . 1 1 115 115 HIS H H 269 8.953 8.953 7.786 1.167 17569 9552 1 15 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.451 0.491 17569 9553 1 15 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.503 -0.195 17569 9554 1 15 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.530 1.112 17569 9555 1 15 . 1 1 117 117 GLU N N 271 123.504 123.504 122.871 0.633 17569 9556 1 15 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.402 -0.382 17569 9557 1 15 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.846 4.023 17569 9558 1 15 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.028 -1.977 17569 9559 1 15 . 1 1 117 117 GLU H H 271 8.402 8.402 8.156 0.246 17569 9560 1 15 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.519 0.023 17569 9561 1 15 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.523 1.836 17569 9562 1 15 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.335 0.807 17569 9563 1 15 . 1 1 119 119 LEU N N 273 112.296 112.296 114.647 -2.351 17569 9564 1 15 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.920 -0.446 17569 9565 1 15 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.441 0.101 17569 9566 1 15 . 1 1 119 119 LEU H H 273 8.090 8.090 7.462 0.628 17569 9567 1 15 . 1 1 120 120 LEU N N 274 121.388 121.388 123.881 -2.493 17569 9568 1 15 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.920 0.107 17569 9569 1 15 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.943 -0.642 17569 9570 1 15 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.427 0.673 17569 9571 1 15 . 1 1 120 120 LEU H H 274 7.823 7.823 8.388 -0.565 17569 9572 1 15 . 1 1 121 121 ASP N N 275 118.600 118.600 118.669 -0.069 17569 9573 1 15 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.344 0.197 17569 9574 1 15 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.744 -0.041 17569 9575 1 15 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.522 -1.079 17569 9576 1 15 . 1 1 121 121 ASP H H 275 8.694 8.694 8.559 0.135 17569 9577 1 15 . 1 1 122 122 LEU N N 276 123.192 123.192 119.805 3.387 17569 9578 1 15 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.871 0.521 17569 9579 1 15 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.722 0.249 17569 9580 1 15 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.023 0.519 17569 9581 1 15 . 1 1 122 122 LEU H H 276 8.013 8.013 7.332 0.681 17569 9582 1 15 . 1 1 123 123 VAL N N 277 126.898 126.898 118.534 8.364 17569 9583 1 15 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.716 0.139 17569 9584 1 15 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.321 0.342 17569 9585 1 15 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.702 1.356 17569 9586 1 15 . 1 1 123 123 VAL H H 277 8.781 8.781 7.981 0.800 17569 9587 1 15 . 1 1 124 124 THR N N 278 117.500 117.500 116.470 1.030 17569 9588 1 15 . 1 1 124 124 THR HA H 278 4.030 4.030 3.948 0.082 17569 9589 1 15 . 1 1 124 124 THR CA C 278 66.589 66.589 66.785 -0.196 17569 9590 1 15 . 1 1 124 124 THR CB C 278 68.410 68.410 68.041 0.369 17569 9591 1 15 . 1 1 124 124 THR H H 278 8.722 8.722 8.539 0.183 17569 9592 1 15 . 1 1 125 125 ALA N N 279 124.700 124.700 123.656 1.044 17569 9593 1 15 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.137 0.124 17569 9594 1 15 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.002 0.294 17569 9595 1 15 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.953 -0.004 17569 9596 1 15 . 1 1 125 125 ALA H H 279 8.239 8.239 7.811 0.428 17569 9597 1 15 . 1 1 126 126 CYS N N 280 119.276 119.276 117.470 1.806 17569 9598 1 15 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.833 0.281 17569 9599 1 15 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.736 -1.633 17569 9600 1 15 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.706 -1.210 17569 9601 1 15 . 1 1 126 126 CYS H H 280 8.128 8.128 7.922 0.206 17569 9602 1 15 . 1 1 127 127 ASN N N 281 118.000 118.000 118.181 -0.181 17569 9603 1 15 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.612 -0.052 17569 9604 1 15 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.643 -0.504 17569 9605 1 15 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.044 -1.079 17569 9606 1 15 . 1 1 127 127 ASN H H 281 8.725 8.725 7.994 0.731 17569 9607 1 15 . 1 1 128 128 SER N N 282 116.601 116.601 117.285 -0.684 17569 9608 1 15 . 1 1 128 128 SER HA H 282 4.363 4.363 4.215 0.148 17569 9609 1 15 . 1 1 128 128 SER CA C 282 61.899 61.899 62.319 -0.420 17569 9610 1 15 . 1 1 128 128 SER CB C 282 62.630 62.630 63.006 -0.376 17569 9611 1 15 . 1 1 128 128 SER H H 282 8.542 8.542 7.641 0.901 17569 9612 1 15 . 1 1 129 129 VAL N N 283 123.272 123.272 122.027 1.245 17569 9613 1 15 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.578 0.099 17569 9614 1 15 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.486 0.022 17569 9615 1 15 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.080 0.138 17569 9616 1 15 . 1 1 129 129 VAL H H 283 7.990 7.990 8.298 -0.308 17569 9617 1 15 . 1 1 130 130 PHE N N 284 118.594 118.594 119.007 -0.413 17569 9618 1 15 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.272 -0.259 17569 9619 1 15 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.448 2.052 17569 9620 1 15 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.386 0.610 17569 9621 1 15 . 1 1 130 130 PHE H H 284 8.190 8.190 7.964 0.226 17569 9622 1 15 . 1 1 131 131 GLU N N 285 120.905 120.905 120.210 0.695 17569 9623 1 15 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.020 0.185 17569 9624 1 15 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.047 -0.833 17569 9625 1 15 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.579 -0.079 17569 9626 1 15 . 1 1 131 131 GLU H H 285 8.699 8.699 8.976 -0.277 17569 9627 1 15 . 1 1 132 132 ASN N N 286 117.997 117.997 118.337 -0.340 17569 9628 1 15 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.671 -0.076 17569 9629 1 15 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.788 -0.173 17569 9630 1 15 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.654 0.198 17569 9631 1 15 . 1 1 132 132 ASN H H 286 8.082 8.082 8.391 -0.309 17569 9632 1 15 . 1 1 133 133 LEU N N 287 120.800 120.800 122.772 -1.972 17569 9633 1 15 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.323 -0.206 17569 9634 1 15 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.217 -0.419 17569 9635 1 15 . 1 1 133 133 LEU H H 287 7.904 7.904 8.881 -0.977 17569 9636 1 15 . 1 1 134 134 GLU N N 288 118.200 118.200 118.950 -0.750 17569 9637 1 15 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.961 0.118 17569 9638 1 15 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.164 -1.167 17569 9639 1 15 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.221 0.021 17569 9640 1 15 . 1 1 134 134 GLU H H 288 8.157 8.157 8.462 -0.305 17569 9641 1 15 . 1 1 135 135 GLN N N 289 117.400 117.400 118.131 -0.731 17569 9642 1 15 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.094 0.080 17569 9643 1 15 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.291 -0.302 17569 9644 1 15 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.539 -0.459 17569 9645 1 15 . 1 1 135 135 GLN H H 289 7.869 7.869 7.676 0.193 17569 9646 1 15 . 1 1 136 136 LEU N N 290 121.000 121.000 121.665 -0.665 17569 9647 1 15 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.826 0.347 17569 9648 1 15 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.903 -0.765 17569 9649 1 15 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.717 0.283 17569 9650 1 15 . 1 1 136 136 LEU H H 290 7.968 7.968 7.733 0.235 17569 9651 1 15 . 1 1 137 137 LEU N N 291 118.900 118.900 119.865 -0.965 17569 9652 1 15 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.052 0.189 17569 9653 1 15 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.396 -1.036 17569 9654 1 15 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.300 -0.828 17569 9655 1 15 . 1 1 137 137 LEU H H 291 8.154 8.154 7.701 0.453 17569 9656 1 15 . 1 1 138 138 GLN N N 292 117.993 117.993 114.742 3.251 17569 9657 1 15 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.521 -0.249 17569 9658 1 15 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.995 1.637 17569 9659 1 15 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.319 -0.735 17569 9660 1 15 . 1 1 138 138 GLN H H 292 7.896 7.896 7.558 0.338 17569 9661 1 15 . 1 1 139 139 GLN N N 293 118.889 118.889 120.770 -1.881 17569 9662 1 15 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.478 -0.209 17569 9663 1 15 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.534 0.920 17569 9664 1 15 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.011 0.058 17569 9665 1 15 . 1 1 139 139 GLN H H 293 8.091 8.091 7.485 0.606 17569 9666 1 15 . 1 1 140 140 ASN N N 294 118.604 118.604 119.394 -0.790 17569 9667 1 15 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.857 -0.098 17569 9668 1 15 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.193 0.028 17569 9669 1 15 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.882 -2.149 17569 9670 1 15 . 1 1 140 140 ASN H H 294 8.273 8.273 8.289 -0.016 17569 9671 1 15 . 1 1 141 141 LYS N N 295 121.685 121.685 121.486 0.199 17569 9672 1 15 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.623 -0.264 17569 9673 1 15 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.226 -0.053 17569 9674 1 15 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.618 -1.083 17569 9675 1 15 . 1 1 141 141 LYS H H 295 8.089 8.089 8.475 -0.386 17569 9676 1 16 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.894 -0.507 17569 9677 1 16 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.135 0.310 17569 9678 1 16 . 1 1 2 2 ALA CB C 156 19.256 19.256 18.869 0.387 17569 9679 1 16 . 1 1 3 3 MET HA H 157 4.476 4.476 4.677 -0.201 17569 9680 1 16 . 1 1 3 3 MET CA C 157 55.401 55.401 54.523 0.878 17569 9681 1 16 . 1 1 4 4 ALA N N 158 124.828 124.828 123.530 1.298 17569 9682 1 16 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.588 -0.274 17569 9683 1 16 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.967 0.544 17569 9684 1 16 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.430 -0.429 17569 9685 1 16 . 1 1 4 4 ALA H H 158 8.382 8.382 8.464 -0.082 17569 9686 1 16 . 1 1 5 5 ASP N N 159 119.418 119.418 122.229 -2.811 17569 9687 1 16 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.708 -0.118 17569 9688 1 16 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.267 -0.131 17569 9689 1 16 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.129 -1.114 17569 9690 1 16 . 1 1 5 5 ASP H H 159 8.312 8.312 8.657 -0.345 17569 9691 1 16 . 1 1 6 6 LYS N N 160 121.604 121.604 119.764 1.840 17569 9692 1 16 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.524 -0.181 17569 9693 1 16 . 1 1 6 6 LYS H H 160 8.274 8.274 7.819 0.455 17569 9694 1 16 . 1 1 7 7 ARG N N 161 121.611 121.611 120.958 0.653 17569 9695 1 16 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.631 -0.304 17569 9696 1 16 . 1 1 7 7 ARG H H 161 8.430 8.430 9.096 -0.666 17569 9697 1 16 . 1 1 8 8 GLY N N 162 109.606 109.606 109.278 0.328 17569 9698 1 16 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.617 0.430 17569 9699 1 16 . 1 1 8 8 GLY H H 162 8.473 8.473 8.277 0.196 17569 9700 1 16 . 1 1 9 9 ASP N N 163 120.187 120.187 119.539 0.648 17569 9701 1 16 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.753 -0.104 17569 9702 1 16 . 1 1 9 9 ASP CA C 163 54.151 54.151 54.071 0.080 17569 9703 1 16 . 1 1 9 9 ASP H H 163 8.296 8.296 7.818 0.478 17569 9704 1 16 . 1 1 10 10 GLY N N 164 108.816 108.816 109.614 -0.798 17569 9705 1 16 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.119 0.248 17569 9706 1 16 . 1 1 10 10 GLY H H 164 8.458 8.458 8.743 -0.285 17569 9707 1 16 . 1 1 11 11 LEU N N 165 121.195 121.195 122.607 -1.412 17569 9708 1 16 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.709 -0.393 17569 9709 1 16 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.528 0.472 17569 9710 1 16 . 1 1 11 11 LEU CB C 165 41.932 41.932 43.374 -1.442 17569 9711 1 16 . 1 1 11 11 LEU H H 165 8.137 8.137 7.826 0.311 17569 9712 1 16 . 1 1 12 12 HIS N N 166 119.387 119.387 122.530 -3.143 17569 9713 1 16 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.776 -0.121 17569 9714 1 16 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.710 0.559 17569 9715 1 16 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.204 -0.507 17569 9716 1 16 . 1 1 12 12 HIS H H 166 8.270 8.270 8.687 -0.417 17569 9717 1 16 . 1 1 13 13 GLY N N 167 109.899 109.899 110.746 -0.847 17569 9718 1 16 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.483 0.622 17569 9719 1 16 . 1 1 13 13 GLY H H 167 8.276 8.276 8.318 -0.042 17569 9720 1 16 . 1 1 14 14 ILE N N 168 119.597 119.597 120.092 -0.495 17569 9721 1 16 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.225 0.098 17569 9722 1 16 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.351 0.249 17569 9723 1 16 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.390 -2.440 17569 9724 1 16 . 1 1 14 14 ILE H H 168 7.962 7.962 8.269 -0.307 17569 9725 1 16 . 1 1 15 15 VAL N N 169 127.578 127.578 124.748 2.830 17569 9726 1 16 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.031 0.249 17569 9727 1 16 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.368 -1.051 17569 9728 1 16 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.855 2.547 17569 9729 1 16 . 1 1 15 15 VAL H H 169 9.011 9.011 8.367 0.644 17569 9730 1 16 . 1 1 16 16 SER N N 170 118.596 118.596 119.751 -1.155 17569 9731 1 16 . 1 1 16 16 SER HA H 170 5.140 5.140 4.754 0.386 17569 9732 1 16 . 1 1 16 16 SER CA C 170 55.985 55.985 56.022 -0.037 17569 9733 1 16 . 1 1 16 16 SER CB C 170 65.261 65.261 65.742 -0.481 17569 9734 1 16 . 1 1 16 16 SER H H 170 8.242 8.242 7.711 0.531 17569 9735 1 16 . 1 1 17 17 CYS N N 171 123.783 123.783 122.740 1.043 17569 9736 1 16 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.139 0.042 17569 9737 1 16 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.427 -0.583 17569 9738 1 16 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.875 2.498 17569 9739 1 16 . 1 1 17 17 CYS H H 171 8.894 8.894 8.521 0.373 17569 9740 1 16 . 1 1 18 18 THR N N 172 121.703 121.703 117.668 4.035 17569 9741 1 16 . 1 1 18 18 THR HA H 172 4.386 4.386 4.104 0.282 17569 9742 1 16 . 1 1 18 18 THR CA C 172 64.667 64.667 64.474 0.193 17569 9743 1 16 . 1 1 18 18 THR CB C 172 69.498 69.498 68.845 0.653 17569 9744 1 16 . 1 1 18 18 THR H H 172 8.788 8.788 8.240 0.548 17569 9745 1 16 . 1 1 19 19 ALA N N 173 131.364 131.364 121.846 9.518 17569 9746 1 16 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.029 0.467 17569 9747 1 16 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.630 0.395 17569 9748 1 16 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.855 3.326 17569 9749 1 16 . 1 1 19 19 ALA H H 173 9.680 9.680 7.753 1.927 17569 9750 1 16 . 1 1 20 20 CYS N N 174 115.498 115.498 114.803 0.695 17569 9751 1 16 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.602 0.366 17569 9752 1 16 . 1 1 20 20 CYS CA C 174 58.094 58.094 58.624 -0.530 17569 9753 1 16 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.729 4.516 17569 9754 1 16 . 1 1 20 20 CYS H H 174 8.470 8.470 7.530 0.940 17569 9755 1 16 . 1 1 21 21 GLY N N 175 112.464 112.464 109.230 3.234 17569 9756 1 16 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.075 0.631 17569 9757 1 16 . 1 1 21 21 GLY H H 175 7.884 7.884 7.986 -0.102 17569 9758 1 16 . 1 1 22 22 GLN N N 176 121.784 121.784 117.892 3.892 17569 9759 1 16 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.459 -0.083 17569 9760 1 16 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.542 1.749 17569 9761 1 16 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.165 -2.824 17569 9762 1 16 . 1 1 22 22 GLN H H 176 8.723 8.723 7.888 0.835 17569 9763 1 16 . 1 1 23 23 GLN N N 177 122.900 122.900 122.679 0.221 17569 9764 1 16 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.261 0.269 17569 9765 1 16 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.872 -0.322 17569 9766 1 16 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.257 -0.797 17569 9767 1 16 . 1 1 23 23 GLN H H 177 8.721 8.721 8.534 0.187 17569 9768 1 16 . 1 1 24 24 VAL N N 178 121.000 121.000 123.335 -2.335 17569 9769 1 16 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.002 0.522 17569 9770 1 16 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.022 -1.145 17569 9771 1 16 . 1 1 24 24 VAL H H 178 8.689 8.689 7.906 0.783 17569 9772 1 16 . 1 1 25 25 ASN N N 179 121.392 121.392 123.236 -1.844 17569 9773 1 16 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.441 0.435 17569 9774 1 16 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.003 -1.854 17569 9775 1 16 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.087 -0.110 17569 9776 1 16 . 1 1 25 25 ASN H H 179 8.635 8.635 8.230 0.405 17569 9777 1 16 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.415 0.045 17569 9778 1 16 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.622 -1.624 17569 9779 1 16 . 1 1 27 27 PHE CB C 181 38.393 38.393 37.896 0.497 17569 9780 1 16 . 1 1 28 28 GLN N N 182 119.300 119.300 125.928 -6.628 17569 9781 1 16 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.665 -0.147 17569 9782 1 16 . 1 1 28 28 GLN CA C 182 54.342 54.342 54.944 -0.602 17569 9783 1 16 . 1 1 28 28 GLN CB C 182 30.350 30.350 31.278 -0.928 17569 9784 1 16 . 1 1 28 28 GLN H H 182 7.494 7.494 7.987 -0.493 17569 9785 1 16 . 1 1 29 29 LYS N N 183 124.516 124.516 126.702 -2.186 17569 9786 1 16 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.525 -0.603 17569 9787 1 16 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.592 1.720 17569 9788 1 16 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.433 -0.147 17569 9789 1 16 . 1 1 29 29 LYS H H 183 8.779 8.779 8.850 -0.071 17569 9790 1 16 . 1 1 30 30 ASP N N 184 116.500 116.500 119.112 -2.612 17569 9791 1 16 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.768 -0.309 17569 9792 1 16 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.484 0.052 17569 9793 1 16 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.234 -1.263 17569 9794 1 16 . 1 1 30 30 ASP H H 184 8.556 8.556 8.396 0.160 17569 9795 1 16 . 1 1 31 31 SER N N 185 111.505 111.505 113.187 -1.682 17569 9796 1 16 . 1 1 31 31 SER HA H 185 4.695 4.695 4.702 -0.007 17569 9797 1 16 . 1 1 31 31 SER CA C 185 59.747 59.747 58.180 1.567 17569 9798 1 16 . 1 1 31 31 SER CB C 185 65.198 65.198 63.867 1.331 17569 9799 1 16 . 1 1 31 31 SER H H 185 7.933 7.933 8.287 -0.354 17569 9800 1 16 . 1 1 32 32 ILE N N 186 113.394 113.394 116.344 -2.950 17569 9801 1 16 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.069 -0.183 17569 9802 1 16 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.605 -1.026 17569 9803 1 16 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.838 0.974 17569 9804 1 16 . 1 1 32 32 ILE H H 186 7.105 7.105 7.559 -0.454 17569 9805 1 16 . 1 1 33 33 TYR N N 187 119.098 119.098 120.569 -1.471 17569 9806 1 16 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.145 -0.622 17569 9807 1 16 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.884 1.376 17569 9808 1 16 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.621 2.819 17569 9809 1 16 . 1 1 33 33 TYR H H 187 8.954 8.954 7.874 1.080 17569 9810 1 16 . 1 1 34 34 ARG N N 188 118.502 118.502 122.836 -4.334 17569 9811 1 16 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.810 -0.173 17569 9812 1 16 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.348 -1.596 17569 9813 1 16 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.075 1.176 17569 9814 1 16 . 1 1 34 34 ARG H H 188 8.412 8.412 8.573 -0.161 17569 9815 1 16 . 1 1 35 35 HIS N N 189 126.596 126.596 127.737 -1.141 17569 9816 1 16 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.901 -0.309 17569 9817 1 16 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.810 -0.089 17569 9818 1 16 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.054 1.418 17569 9819 1 16 . 1 1 35 35 HIS H H 189 9.813 9.813 9.085 0.728 17569 9820 1 16 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.641 -0.343 17569 9821 1 16 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.972 0.304 17569 9822 1 16 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.481 0.370 17569 9823 1 16 . 1 1 37 37 SER N N 191 110.003 110.003 113.525 -3.522 17569 9824 1 16 . 1 1 37 37 SER HA H 191 4.918 4.918 4.319 0.599 17569 9825 1 16 . 1 1 37 37 SER CA C 191 59.031 59.031 60.495 -1.464 17569 9826 1 16 . 1 1 37 37 SER CB C 191 65.104 65.104 63.322 1.782 17569 9827 1 16 . 1 1 37 37 SER H H 191 8.934 8.934 8.438 0.496 17569 9828 1 16 . 1 1 38 38 LEU N N 192 120.959 120.959 114.063 6.896 17569 9829 1 16 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.934 -0.805 17569 9830 1 16 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.322 1.824 17569 9831 1 16 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.483 1.513 17569 9832 1 16 . 1 1 38 38 LEU H H 192 8.649 8.649 7.015 1.634 17569 9833 1 16 . 1 1 39 39 GLN N N 193 108.600 108.600 119.014 -10.414 17569 9834 1 16 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.080 -0.174 17569 9835 1 16 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.690 0.124 17569 9836 1 16 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.572 -1.538 17569 9837 1 16 . 1 1 39 39 GLN H H 193 8.465 8.465 7.854 0.611 17569 9838 1 16 . 1 1 40 40 VAL N N 194 105.325 105.325 117.553 -12.228 17569 9839 1 16 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.494 0.056 17569 9840 1 16 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.653 -1.012 17569 9841 1 16 . 1 1 40 40 VAL H H 194 6.256 6.256 7.852 -1.596 17569 9842 1 16 . 1 1 41 41 LEU N N 195 123.100 123.100 121.996 1.104 17569 9843 1 16 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.784 0.032 17569 9844 1 16 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.506 3.676 17569 9845 1 16 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.731 0.839 17569 9846 1 16 . 1 1 41 41 LEU H H 195 9.154 9.154 8.525 0.629 17569 9847 1 16 . 1 1 42 42 ILE N N 196 124.396 124.396 117.469 6.927 17569 9848 1 16 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.854 1.498 17569 9849 1 16 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.212 1.018 17569 9850 1 16 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.910 1.360 17569 9851 1 16 . 1 1 42 42 ILE H H 196 9.766 9.766 7.819 1.947 17569 9852 1 16 . 1 1 43 43 CYS N N 197 121.500 121.500 114.694 6.806 17569 9853 1 16 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.270 -0.008 17569 9854 1 16 . 1 1 43 43 CYS CA C 197 56.703 56.703 55.978 0.725 17569 9855 1 16 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.426 1.874 17569 9856 1 16 . 1 1 43 43 CYS H H 197 9.882 9.882 8.274 1.608 17569 9857 1 16 . 1 1 44 44 LYS N N 198 117.995 117.995 122.070 -4.075 17569 9858 1 16 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.147 -0.158 17569 9859 1 16 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.142 -0.481 17569 9860 1 16 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.285 0.415 17569 9861 1 16 . 1 1 44 44 LYS H H 198 8.089 8.089 8.533 -0.444 17569 9862 1 16 . 1 1 45 45 ASN N N 199 119.200 119.200 117.562 1.638 17569 9863 1 16 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.609 -0.095 17569 9864 1 16 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.874 0.846 17569 9865 1 16 . 1 1 45 45 ASN CB C 199 38.167 38.167 37.986 0.181 17569 9866 1 16 . 1 1 45 45 ASN H H 199 8.356 8.356 8.581 -0.225 17569 9867 1 16 . 1 1 46 46 CYS N N 200 126.600 126.600 118.467 8.133 17569 9868 1 16 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.010 0.171 17569 9869 1 16 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.087 2.408 17569 9870 1 16 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.199 1.983 17569 9871 1 16 . 1 1 46 46 CYS H H 200 9.189 9.189 7.876 1.313 17569 9872 1 16 . 1 1 47 47 PHE N N 201 121.962 121.962 120.333 1.629 17569 9873 1 16 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.135 -0.265 17569 9874 1 16 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.516 1.754 17569 9875 1 16 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.565 0.602 17569 9876 1 16 . 1 1 47 47 PHE H H 201 8.826 8.826 7.903 0.923 17569 9877 1 16 . 1 1 48 48 LYS N N 202 117.400 117.400 120.311 -2.911 17569 9878 1 16 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.870 -0.172 17569 9879 1 16 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.164 -1.212 17569 9880 1 16 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.304 -0.763 17569 9881 1 16 . 1 1 48 48 LYS H H 202 8.512 8.512 8.027 0.485 17569 9882 1 16 . 1 1 49 49 TYR N N 203 120.400 120.400 120.490 -0.090 17569 9883 1 16 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.243 0.171 17569 9884 1 16 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.299 -0.527 17569 9885 1 16 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.683 -0.237 17569 9886 1 16 . 1 1 49 49 TYR H H 203 8.133 8.133 7.765 0.368 17569 9887 1 16 . 1 1 50 50 TYR N N 204 121.783 121.783 118.011 3.772 17569 9888 1 16 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.677 -1.182 17569 9889 1 16 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.931 3.019 17569 9890 1 16 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.596 0.896 17569 9891 1 16 . 1 1 50 50 TYR H H 204 8.765 8.765 7.519 1.246 17569 9892 1 16 . 1 1 51 51 MET N N 205 110.800 110.800 114.916 -4.116 17569 9893 1 16 . 1 1 51 51 MET HA H 205 4.349 4.349 4.210 0.139 17569 9894 1 16 . 1 1 51 51 MET CA C 205 53.505 53.505 58.048 -4.543 17569 9895 1 16 . 1 1 51 51 MET CB C 205 30.384 30.384 33.263 -2.879 17569 9896 1 16 . 1 1 51 51 MET H H 205 7.771 7.771 8.473 -0.702 17569 9897 1 16 . 1 1 52 52 SER N N 206 116.800 116.800 113.362 3.438 17569 9898 1 16 . 1 1 52 52 SER HA H 206 3.919 3.919 4.371 -0.452 17569 9899 1 16 . 1 1 52 52 SER CA C 206 61.621 61.621 59.221 2.400 17569 9900 1 16 . 1 1 52 52 SER CB C 206 62.611 62.611 64.308 -1.697 17569 9901 1 16 . 1 1 52 52 SER H H 206 7.581 7.581 8.243 -0.662 17569 9902 1 16 . 1 1 53 53 ASP N N 207 117.400 117.400 121.346 -3.946 17569 9903 1 16 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.783 -0.211 17569 9904 1 16 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.738 -0.639 17569 9905 1 16 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.759 0.429 17569 9906 1 16 . 1 1 53 53 ASP H H 207 7.085 7.085 8.095 -1.010 17569 9907 1 16 . 1 1 54 54 ASP N N 208 119.405 119.405 122.585 -3.180 17569 9908 1 16 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.967 -0.578 17569 9909 1 16 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.461 0.439 17569 9910 1 16 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.845 -1.496 17569 9911 1 16 . 1 1 54 54 ASP H H 208 8.439 8.439 8.501 -0.062 17569 9912 1 16 . 1 1 55 55 ILE N N 209 124.698 124.698 121.027 3.671 17569 9913 1 16 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.325 -0.325 17569 9914 1 16 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.155 2.123 17569 9915 1 16 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.854 1.437 17569 9916 1 16 . 1 1 55 55 ILE H H 209 8.128 8.128 8.464 -0.336 17569 9917 1 16 . 1 1 56 56 SER N N 210 126.703 126.703 123.944 2.759 17569 9918 1 16 . 1 1 56 56 SER HA H 210 4.365 4.365 4.560 -0.195 17569 9919 1 16 . 1 1 56 56 SER CA C 210 57.769 57.769 57.040 0.729 17569 9920 1 16 . 1 1 56 56 SER CB C 210 64.991 64.991 62.119 2.872 17569 9921 1 16 . 1 1 56 56 SER H H 210 8.815 8.815 8.663 0.152 17569 9922 1 16 . 1 1 57 57 ARG N N 211 116.885 116.885 121.272 -4.387 17569 9923 1 16 . 1 1 57 57 ARG HA H 211 5.042 5.042 3.999 1.043 17569 9924 1 16 . 1 1 57 57 ARG CA C 211 54.400 54.400 56.852 -2.452 17569 9925 1 16 . 1 1 57 57 ARG CB C 211 34.284 34.284 30.456 3.828 17569 9926 1 16 . 1 1 57 57 ARG H H 211 8.365 8.365 7.463 0.902 17569 9927 1 16 . 1 1 58 58 ASP N N 212 121.982 121.982 116.326 5.656 17569 9928 1 16 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.283 0.332 17569 9929 1 16 . 1 1 58 58 ASP CA C 212 52.222 52.222 55.836 -3.614 17569 9930 1 16 . 1 1 58 58 ASP CB C 212 41.502 41.502 40.153 1.349 17569 9931 1 16 . 1 1 58 58 ASP H H 212 8.706 8.706 8.294 0.412 17569 9932 1 16 . 1 1 59 59 SER N N 213 114.164 114.164 115.141 -0.977 17569 9933 1 16 . 1 1 59 59 SER HA H 213 4.212 4.212 4.273 -0.061 17569 9934 1 16 . 1 1 59 59 SER CA C 213 60.840 60.840 60.991 -0.151 17569 9935 1 16 . 1 1 59 59 SER CB C 213 62.714 62.714 63.346 -0.631 17569 9936 1 16 . 1 1 59 59 SER H H 213 8.687 8.687 8.286 0.401 17569 9937 1 16 . 1 1 60 60 ASP N N 214 120.899 120.899 119.302 1.597 17569 9938 1 16 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.831 -0.006 17569 9939 1 16 . 1 1 60 60 ASP CA C 214 54.211 54.211 52.946 1.265 17569 9940 1 16 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.583 0.975 17569 9941 1 16 . 1 1 60 60 ASP H H 214 8.193 8.193 7.931 0.262 17569 9942 1 16 . 1 1 61 61 GLY N N 215 108.300 108.300 108.322 -0.022 17569 9943 1 16 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.916 -0.519 17569 9944 1 16 . 1 1 61 61 GLY H H 215 8.234 8.234 7.843 0.391 17569 9945 1 16 . 1 1 62 62 MET N N 216 120.002 120.002 111.628 8.374 17569 9946 1 16 . 1 1 62 62 MET HA H 216 4.972 4.972 4.034 0.938 17569 9947 1 16 . 1 1 62 62 MET CA C 216 53.151 53.151 53.186 -0.035 17569 9948 1 16 . 1 1 62 62 MET CB C 216 32.311 32.311 34.126 -1.815 17569 9949 1 16 . 1 1 62 62 MET H H 216 8.376 8.376 7.288 1.088 17569 9950 1 16 . 1 1 63 63 ASP N N 217 127.300 127.300 120.836 6.464 17569 9951 1 16 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.323 0.643 17569 9952 1 16 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.792 -0.223 17569 9953 1 16 . 1 1 63 63 ASP H H 217 9.368 9.368 8.487 0.881 17569 9954 1 16 . 1 1 64 64 GLU N N 218 114.400 114.400 125.342 -10.942 17569 9955 1 16 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.361 -0.205 17569 9956 1 16 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.629 0.221 17569 9957 1 16 . 1 1 64 64 GLU H H 218 8.583 8.583 8.493 0.090 17569 9958 1 16 . 1 1 65 65 GLN N N 219 115.500 115.500 116.746 -1.246 17569 9959 1 16 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.459 -0.148 17569 9960 1 16 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.159 0.187 17569 9961 1 16 . 1 1 65 65 GLN H H 219 7.158 7.158 7.453 -0.295 17569 9962 1 16 . 1 1 66 66 CYS N N 220 122.600 122.600 117.446 5.154 17569 9963 1 16 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.212 -1.135 17569 9964 1 16 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.563 0.966 17569 9965 1 16 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.028 1.944 17569 9966 1 16 . 1 1 66 66 CYS H H 220 8.248 8.248 8.361 -0.114 17569 9967 1 16 . 1 1 67 67 ARG N N 221 130.363 130.363 124.390 5.973 17569 9968 1 16 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.328 -0.261 17569 9969 1 16 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.534 -2.518 17569 9970 1 16 . 1 1 67 67 ARG H H 221 9.145 9.145 8.513 0.632 17569 9971 1 16 . 1 1 68 68 TRP N N 222 124.200 124.200 120.437 3.763 17569 9972 1 16 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.754 -0.318 17569 9973 1 16 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.265 0.815 17569 9974 1 16 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.587 0.607 17569 9975 1 16 . 1 1 68 68 TRP H H 222 9.689 9.689 8.126 1.563 17569 9976 1 16 . 1 1 69 69 CYS N N 223 116.297 116.297 111.064 5.233 17569 9977 1 16 . 1 1 69 69 CYS HA H 223 5.091 5.091 4.918 0.173 17569 9978 1 16 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.051 3.051 17569 9979 1 16 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.024 5.314 17569 9980 1 16 . 1 1 69 69 CYS H H 223 8.822 8.822 7.792 1.030 17569 9981 1 16 . 1 1 70 70 ALA N N 224 123.112 123.112 123.534 -0.422 17569 9982 1 16 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.246 0.160 17569 9983 1 16 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.097 -0.246 17569 9984 1 16 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.697 0.023 17569 9985 1 16 . 1 1 70 70 ALA H H 224 8.787 8.787 8.158 0.629 17569 9986 1 16 . 1 1 71 71 GLU N N 225 118.300 118.300 120.747 -2.447 17569 9987 1 16 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.533 0.775 17569 9988 1 16 . 1 1 71 71 GLU CA C 225 53.299 53.299 56.065 -2.766 17569 9989 1 16 . 1 1 71 71 GLU H H 225 8.541 8.541 7.859 0.682 17569 9990 1 16 . 1 1 72 72 GLY N N 226 111.995 111.995 109.667 2.328 17569 9991 1 16 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.574 -0.171 17569 9992 1 16 . 1 1 72 72 GLY H H 226 9.837 9.837 8.597 1.240 17569 9993 1 16 . 1 1 73 73 GLY N N 227 106.600 106.600 107.142 -0.542 17569 9994 1 16 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.161 0.810 17569 9995 1 16 . 1 1 73 73 GLY H H 227 7.772 7.772 8.260 -0.488 17569 9996 1 16 . 1 1 74 74 ASN N N 228 124.277 124.277 119.662 4.615 17569 9997 1 16 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.393 0.688 17569 9998 1 16 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.493 -0.393 17569 9999 1 16 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.684 -0.601 17569 10000 1 16 . 1 1 74 74 ASN H H 228 8.876 8.876 8.549 0.327 17569 10001 1 16 . 1 1 75 75 LEU N N 229 123.050 123.050 121.849 1.201 17569 10002 1 16 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.842 -0.242 17569 10003 1 16 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.128 1.234 17569 10004 1 16 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.826 -0.326 17569 10005 1 16 . 1 1 75 75 LEU H H 229 8.901 8.901 8.040 0.861 17569 10006 1 16 . 1 1 76 76 ILE N N 230 123.552 123.552 123.297 0.255 17569 10007 1 16 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.026 0.459 17569 10008 1 16 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.780 -1.080 17569 10009 1 16 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.999 -0.600 17569 10010 1 16 . 1 1 76 76 ILE H H 230 9.406 9.406 9.233 0.173 17569 10011 1 16 . 1 1 77 77 CYS N N 231 124.637 124.637 125.937 -1.300 17569 10012 1 16 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.478 -0.603 17569 10013 1 16 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.646 -0.287 17569 10014 1 16 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.565 -0.131 17569 10015 1 16 . 1 1 77 77 CYS H H 231 8.809 8.809 8.502 0.307 17569 10016 1 16 . 1 1 78 78 CYS N N 232 125.697 125.697 122.467 3.230 17569 10017 1 16 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.825 -0.541 17569 10018 1 16 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.912 3.972 17569 10019 1 16 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.975 1.195 17569 10020 1 16 . 1 1 78 78 CYS H H 232 8.579 8.579 8.915 -0.336 17569 10021 1 16 . 1 1 79 79 ASP N N 233 123.600 123.600 127.036 -3.436 17569 10022 1 16 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.581 0.176 17569 10023 1 16 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.445 2.544 17569 10024 1 16 . 1 1 79 79 ASP CB C 233 41.629 41.629 39.702 1.927 17569 10025 1 16 . 1 1 79 79 ASP H H 233 8.577 8.577 8.182 0.395 17569 10026 1 16 . 1 1 80 80 PHE N N 234 122.100 122.100 116.976 5.124 17569 10027 1 16 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.629 -0.103 17569 10028 1 16 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.315 1.594 17569 10029 1 16 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.258 1.591 17569 10030 1 16 . 1 1 80 80 PHE H H 234 10.432 10.432 7.377 3.055 17569 10031 1 16 . 1 1 81 81 CYS N N 235 124.300 124.300 117.932 6.368 17569 10032 1 16 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.786 0.370 17569 10033 1 16 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.226 -0.181 17569 10034 1 16 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.734 3.673 17569 10035 1 16 . 1 1 81 81 CYS H H 235 8.476 8.476 8.106 0.370 17569 10036 1 16 . 1 1 82 82 HIS N N 236 112.598 112.598 119.885 -7.287 17569 10037 1 16 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.140 0.843 17569 10038 1 16 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.766 -1.368 17569 10039 1 16 . 1 1 82 82 HIS CB C 236 30.257 30.257 28.231 2.026 17569 10040 1 16 . 1 1 82 82 HIS H H 236 6.699 6.699 8.346 -1.647 17569 10041 1 16 . 1 1 83 83 ASN N N 237 123.600 123.600 120.499 3.101 17569 10042 1 16 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.847 -0.046 17569 10043 1 16 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.207 2.409 17569 10044 1 16 . 1 1 83 83 ASN H H 237 9.097 9.097 8.080 1.017 17569 10045 1 16 . 1 1 84 84 ALA N N 238 122.000 122.000 124.061 -2.061 17569 10046 1 16 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.356 0.053 17569 10047 1 16 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.229 0.135 17569 10048 1 16 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.471 2.599 17569 10049 1 16 . 1 1 84 84 ALA H H 238 9.885 9.885 8.906 0.979 17569 10050 1 16 . 1 1 85 85 PHE N N 239 116.707 116.707 121.092 -4.385 17569 10051 1 16 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.148 0.880 17569 10052 1 16 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.793 -0.576 17569 10053 1 16 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.134 1.530 17569 10054 1 16 . 1 1 85 85 PHE H H 239 9.450 9.450 9.239 0.211 17569 10055 1 16 . 1 1 86 86 CYS N N 240 126.682 126.682 124.444 2.238 17569 10056 1 16 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.694 0.928 17569 10057 1 16 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.891 -0.549 17569 10058 1 16 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.110 3.147 17569 10059 1 16 . 1 1 86 86 CYS H H 240 11.309 11.309 9.433 1.876 17569 10060 1 16 . 1 1 87 87 LYS N N 241 117.865 117.865 124.111 -6.246 17569 10061 1 16 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.903 -0.054 17569 10062 1 16 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.255 -0.185 17569 10063 1 16 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.495 0.303 17569 10064 1 16 . 1 1 87 87 LYS H H 241 8.230 8.230 8.815 -0.585 17569 10065 1 16 . 1 1 88 88 LYS N N 242 117.949 117.949 118.233 -0.284 17569 10066 1 16 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.121 -0.143 17569 10067 1 16 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.976 1.394 17569 10068 1 16 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.026 0.290 17569 10069 1 16 . 1 1 88 88 LYS H H 242 7.945 7.945 8.477 -0.532 17569 10070 1 16 . 1 1 89 89 CYS N N 243 125.305 125.305 117.483 7.822 17569 10071 1 16 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.277 -0.535 17569 10072 1 16 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.934 1.893 17569 10073 1 16 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.106 1.135 17569 10074 1 16 . 1 1 89 89 CYS H H 243 9.297 9.297 7.591 1.706 17569 10075 1 16 . 1 1 90 90 ILE N N 244 119.687 119.687 121.541 -1.854 17569 10076 1 16 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.949 -0.342 17569 10077 1 16 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.642 0.308 17569 10078 1 16 . 1 1 90 90 ILE H H 244 7.997 7.997 7.664 0.333 17569 10079 1 16 . 1 1 91 91 LEU N N 245 120.280 120.280 120.640 -0.360 17569 10080 1 16 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.314 -0.629 17569 10081 1 16 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.451 0.784 17569 10082 1 16 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.192 -0.234 17569 10083 1 16 . 1 1 91 91 LEU H H 245 8.810 8.810 8.747 0.063 17569 10084 1 16 . 1 1 92 92 ARG N N 246 116.901 116.901 118.019 -1.118 17569 10085 1 16 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.135 -0.318 17569 10086 1 16 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.270 0.710 17569 10087 1 16 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.088 0.512 17569 10088 1 16 . 1 1 92 92 ARG H H 246 8.086 8.086 7.637 0.449 17569 10089 1 16 . 1 1 93 93 ASN N N 247 111.200 111.200 116.575 -5.375 17569 10090 1 16 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.521 0.082 17569 10091 1 16 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.768 1.040 17569 10092 1 16 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.086 3.398 17569 10093 1 16 . 1 1 93 93 ASN H H 247 7.136 7.136 8.206 -1.070 17569 10094 1 16 . 1 1 94 94 LEU N N 248 118.807 118.807 117.490 1.317 17569 10095 1 16 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.418 0.396 17569 10096 1 16 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.171 0.018 17569 10097 1 16 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.614 0.084 17569 10098 1 16 . 1 1 94 94 LEU H H 248 8.515 8.515 7.968 0.547 17569 10099 1 16 . 1 1 95 95 GLY N N 249 108.000 108.000 106.335 1.665 17569 10100 1 16 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.548 0.080 17569 10101 1 16 . 1 1 95 95 GLY H H 249 7.955 7.955 7.723 0.232 17569 10102 1 16 . 1 1 96 96 ARG N N 250 117.797 117.797 121.120 -3.323 17569 10103 1 16 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.316 -0.473 17569 10104 1 16 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.141 0.541 17569 10105 1 16 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.170 -0.310 17569 10106 1 16 . 1 1 96 96 ARG H H 250 8.559 8.559 8.705 -0.146 17569 10107 1 16 . 1 1 97 97 LYS N N 251 120.900 120.900 119.619 1.281 17569 10108 1 16 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.084 0.072 17569 10109 1 16 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.299 -0.143 17569 10110 1 16 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.727 -0.367 17569 10111 1 16 . 1 1 97 97 LYS H H 251 8.655 8.655 8.514 0.141 17569 10112 1 16 . 1 1 98 98 GLU N N 252 122.000 122.000 118.807 3.193 17569 10113 1 16 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.117 0.234 17569 10114 1 16 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.406 -0.824 17569 10115 1 16 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.357 -0.957 17569 10116 1 16 . 1 1 98 98 GLU H H 252 7.705 7.705 8.323 -0.618 17569 10117 1 16 . 1 1 99 99 LEU N N 253 117.400 117.400 121.092 -3.692 17569 10118 1 16 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.807 0.110 17569 10119 1 16 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.097 -0.099 17569 10120 1 16 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.833 -0.351 17569 10121 1 16 . 1 1 99 99 LEU H H 253 7.285 7.285 7.600 -0.315 17569 10122 1 16 . 1 1 100 100 SER N N 254 112.100 112.100 114.295 -2.195 17569 10123 1 16 . 1 1 100 100 SER HA H 254 4.107 4.107 4.084 0.023 17569 10124 1 16 . 1 1 100 100 SER CA C 254 61.603 61.603 61.675 -0.072 17569 10125 1 16 . 1 1 100 100 SER CB C 254 62.622 62.622 62.999 -0.377 17569 10126 1 16 . 1 1 100 100 SER H H 254 8.326 8.326 8.012 0.314 17569 10127 1 16 . 1 1 101 101 THR N N 255 118.151 118.151 118.632 -0.481 17569 10128 1 16 . 1 1 101 101 THR HA H 255 4.026 4.026 4.045 -0.019 17569 10129 1 16 . 1 1 101 101 THR CA C 255 66.261 66.261 67.035 -0.774 17569 10130 1 16 . 1 1 101 101 THR CB C 255 68.735 68.735 68.845 -0.110 17569 10131 1 16 . 1 1 101 101 THR H H 255 7.972 7.972 7.658 0.314 17569 10132 1 16 . 1 1 102 102 ILE N N 256 120.100 120.100 122.764 -2.664 17569 10133 1 16 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.783 -0.320 17569 10134 1 16 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.825 -0.051 17569 10135 1 16 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.482 0.259 17569 10136 1 16 . 1 1 102 102 ILE H H 256 7.868 7.868 8.475 -0.607 17569 10137 1 16 . 1 1 103 103 MET N N 257 114.876 114.876 117.150 -2.274 17569 10138 1 16 . 1 1 103 103 MET HA H 257 4.211 4.211 4.063 0.148 17569 10139 1 16 . 1 1 103 103 MET CA C 257 55.691 55.691 58.441 -2.750 17569 10140 1 16 . 1 1 103 103 MET CB C 257 32.000 32.000 32.979 -0.979 17569 10141 1 16 . 1 1 103 103 MET H H 257 7.606 7.606 7.369 0.237 17569 10142 1 16 . 1 1 104 104 ASP N N 258 119.976 119.976 118.655 1.321 17569 10143 1 16 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.815 -0.277 17569 10144 1 16 . 1 1 104 104 ASP CA C 258 54.912 54.912 54.076 0.836 17569 10145 1 16 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.317 1.183 17569 10146 1 16 . 1 1 104 104 ASP H H 258 7.444 7.444 7.616 -0.172 17569 10147 1 16 . 1 1 105 105 GLU N N 259 124.388 124.388 120.364 4.024 17569 10148 1 16 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.550 -0.263 17569 10149 1 16 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.793 1.778 17569 10150 1 16 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.156 -0.614 17569 10151 1 16 . 1 1 105 105 GLU H H 259 8.559 8.559 8.159 0.400 17569 10152 1 16 . 1 1 106 106 ASN N N 260 117.201 117.201 116.898 0.303 17569 10153 1 16 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.418 0.324 17569 10154 1 16 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.987 -0.244 17569 10155 1 16 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.510 1.408 17569 10156 1 16 . 1 1 106 106 ASN H H 260 8.673 8.673 8.674 -0.001 17569 10157 1 16 . 1 1 107 107 ASN N N 261 117.900 117.900 112.786 5.114 17569 10158 1 16 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.309 0.676 17569 10159 1 16 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.675 -2.373 17569 10160 1 16 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.538 3.076 17569 10161 1 16 . 1 1 107 107 ASN H H 261 7.956 7.956 8.737 -0.781 17569 10162 1 16 . 1 1 108 108 GLN N N 262 121.500 121.500 115.286 6.214 17569 10163 1 16 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.059 0.549 17569 10164 1 16 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.889 0.887 17569 10165 1 16 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.840 0.719 17569 10166 1 16 . 1 1 108 108 GLN H H 262 8.493 8.493 7.708 0.785 17569 10167 1 16 . 1 1 109 109 TRP N N 263 128.056 128.056 123.652 4.404 17569 10168 1 16 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.979 -0.008 17569 10169 1 16 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.473 0.624 17569 10170 1 16 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.274 0.219 17569 10171 1 16 . 1 1 109 109 TRP H H 263 10.497 10.497 7.920 2.577 17569 10172 1 16 . 1 1 110 110 TYR N N 264 126.600 126.600 124.868 1.732 17569 10173 1 16 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.413 -0.011 17569 10174 1 16 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.602 -1.931 17569 10175 1 16 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.561 -1.553 17569 10176 1 16 . 1 1 110 110 TYR H H 264 7.545 7.545 8.140 -0.595 17569 10177 1 16 . 1 1 111 111 CYS N N 265 124.622 124.622 114.391 10.231 17569 10178 1 16 . 1 1 111 111 CYS H H 265 8.586 8.586 8.084 0.502 17569 10179 1 16 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.797 -0.605 17569 10180 1 16 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.595 1.120 17569 10181 1 16 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.576 1.344 17569 10182 1 16 . 1 1 113 113 ILE N N 267 119.504 119.504 119.740 -0.236 17569 10183 1 16 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.711 -0.761 17569 10184 1 16 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.973 0.276 17569 10185 1 16 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.555 -3.022 17569 10186 1 16 . 1 1 113 113 ILE H H 267 9.160 9.160 7.484 1.676 17569 10187 1 16 . 1 1 114 114 CYS N N 268 124.100 124.100 118.371 5.729 17569 10188 1 16 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.174 -0.360 17569 10189 1 16 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.669 3.631 17569 10190 1 16 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.091 2.630 17569 10191 1 16 . 1 1 114 114 CYS H H 268 7.818 7.818 8.247 -0.429 17569 10192 1 16 . 1 1 115 115 HIS N N 269 117.127 117.127 111.127 6.000 17569 10193 1 16 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.660 0.469 17569 10194 1 16 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.054 -0.893 17569 10195 1 16 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.795 2.397 17569 10196 1 16 . 1 1 115 115 HIS H H 269 8.953 8.953 7.794 1.159 17569 10197 1 16 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.464 0.478 17569 10198 1 16 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.561 -0.253 17569 10199 1 16 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.391 1.251 17569 10200 1 16 . 1 1 117 117 GLU N N 271 123.504 123.504 122.723 0.781 17569 10201 1 16 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.297 -0.277 17569 10202 1 16 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.527 3.342 17569 10203 1 16 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.807 -1.756 17569 10204 1 16 . 1 1 117 117 GLU H H 271 8.402 8.402 8.101 0.301 17569 10205 1 16 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.531 0.011 17569 10206 1 16 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.803 1.556 17569 10207 1 16 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.549 0.592 17569 10208 1 16 . 1 1 119 119 LEU N N 273 112.296 112.296 114.205 -1.909 17569 10209 1 16 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.911 -0.437 17569 10210 1 16 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.272 0.270 17569 10211 1 16 . 1 1 119 119 LEU H H 273 8.090 8.090 7.470 0.620 17569 10212 1 16 . 1 1 120 120 LEU N N 274 121.388 121.388 122.759 -1.371 17569 10213 1 16 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.910 0.117 17569 10214 1 16 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.121 0.180 17569 10215 1 16 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.737 0.363 17569 10216 1 16 . 1 1 120 120 LEU H H 274 7.823 7.823 7.887 -0.064 17569 10217 1 16 . 1 1 121 121 ASP N N 275 118.600 118.600 118.871 -0.271 17569 10218 1 16 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.346 0.195 17569 10219 1 16 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.459 0.243 17569 10220 1 16 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.193 -0.750 17569 10221 1 16 . 1 1 121 121 ASP H H 275 8.694 8.694 8.433 0.261 17569 10222 1 16 . 1 1 122 122 LEU N N 276 123.192 123.192 120.922 2.270 17569 10223 1 16 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.948 0.444 17569 10224 1 16 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.146 -0.175 17569 10225 1 16 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.049 0.493 17569 10226 1 16 . 1 1 122 122 LEU H H 276 8.013 8.013 7.412 0.601 17569 10227 1 16 . 1 1 123 123 VAL N N 277 126.898 126.898 118.365 8.533 17569 10228 1 16 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.535 0.320 17569 10229 1 16 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.997 -0.334 17569 10230 1 16 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.467 0.591 17569 10231 1 16 . 1 1 123 123 VAL H H 277 8.781 8.781 7.786 0.995 17569 10232 1 16 . 1 1 124 124 THR N N 278 117.500 117.500 116.298 1.202 17569 10233 1 16 . 1 1 124 124 THR HA H 278 4.030 4.030 3.876 0.154 17569 10234 1 16 . 1 1 124 124 THR CA C 278 66.589 66.589 66.943 -0.354 17569 10235 1 16 . 1 1 124 124 THR CB C 278 68.410 68.410 68.528 -0.117 17569 10236 1 16 . 1 1 124 124 THR H H 278 8.722 8.722 7.922 0.800 17569 10237 1 16 . 1 1 125 125 ALA N N 279 124.700 124.700 124.088 0.612 17569 10238 1 16 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.065 0.196 17569 10239 1 16 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.010 0.287 17569 10240 1 16 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.026 -0.077 17569 10241 1 16 . 1 1 125 125 ALA H H 279 8.239 8.239 8.079 0.160 17569 10242 1 16 . 1 1 126 126 CYS N N 280 119.276 119.276 117.433 1.843 17569 10243 1 16 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.852 0.262 17569 10244 1 16 . 1 1 126 126 CYS CA C 280 62.103 62.103 64.067 -1.964 17569 10245 1 16 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.895 -1.399 17569 10246 1 16 . 1 1 126 126 CYS H H 280 8.128 8.128 7.787 0.341 17569 10247 1 16 . 1 1 127 127 ASN N N 281 118.000 118.000 118.103 -0.103 17569 10248 1 16 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.535 0.025 17569 10249 1 16 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.646 -0.507 17569 10250 1 16 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.952 -0.987 17569 10251 1 16 . 1 1 127 127 ASN H H 281 8.725 8.725 8.011 0.714 17569 10252 1 16 . 1 1 128 128 SER N N 282 116.601 116.601 116.412 0.189 17569 10253 1 16 . 1 1 128 128 SER HA H 282 4.363 4.363 4.159 0.204 17569 10254 1 16 . 1 1 128 128 SER CA C 282 61.899 61.899 61.347 0.552 17569 10255 1 16 . 1 1 128 128 SER CB C 282 62.630 62.630 62.891 -0.261 17569 10256 1 16 . 1 1 128 128 SER H H 282 8.542 8.542 7.751 0.791 17569 10257 1 16 . 1 1 129 129 VAL N N 283 123.272 123.272 121.817 1.455 17569 10258 1 16 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.571 0.106 17569 10259 1 16 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.200 0.308 17569 10260 1 16 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.155 0.063 17569 10261 1 16 . 1 1 129 129 VAL H H 283 7.990 7.990 8.134 -0.144 17569 10262 1 16 . 1 1 130 130 PHE N N 284 118.594 118.594 119.243 -0.649 17569 10263 1 16 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.306 -0.293 17569 10264 1 16 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.383 2.117 17569 10265 1 16 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.373 0.623 17569 10266 1 16 . 1 1 130 130 PHE H H 284 8.190 8.190 8.204 -0.014 17569 10267 1 16 . 1 1 131 131 GLU N N 285 120.905 120.905 120.175 0.730 17569 10268 1 16 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.028 0.177 17569 10269 1 16 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.892 -0.679 17569 10270 1 16 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.424 0.076 17569 10271 1 16 . 1 1 131 131 GLU H H 285 8.699 8.699 8.851 -0.152 17569 10272 1 16 . 1 1 132 132 ASN N N 286 117.997 117.997 118.463 -0.466 17569 10273 1 16 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.653 -0.058 17569 10274 1 16 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.830 -0.215 17569 10275 1 16 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.527 0.325 17569 10276 1 16 . 1 1 132 132 ASN H H 286 8.082 8.082 8.242 -0.160 17569 10277 1 16 . 1 1 133 133 LEU N N 287 120.800 120.800 122.267 -1.467 17569 10278 1 16 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.336 -0.219 17569 10279 1 16 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.476 -0.678 17569 10280 1 16 . 1 1 133 133 LEU H H 287 7.904 7.904 8.584 -0.680 17569 10281 1 16 . 1 1 134 134 GLU N N 288 118.200 118.200 119.250 -1.050 17569 10282 1 16 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.898 0.181 17569 10283 1 16 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.110 -1.113 17569 10284 1 16 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.434 -0.192 17569 10285 1 16 . 1 1 134 134 GLU H H 288 8.157 8.157 8.402 -0.245 17569 10286 1 16 . 1 1 135 135 GLN N N 289 117.400 117.400 118.655 -1.255 17569 10287 1 16 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.121 0.053 17569 10288 1 16 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.447 -0.458 17569 10289 1 16 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.441 -0.361 17569 10290 1 16 . 1 1 135 135 GLN H H 289 7.869 7.869 7.772 0.097 17569 10291 1 16 . 1 1 136 136 LEU N N 290 121.000 121.000 121.655 -0.655 17569 10292 1 16 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.800 0.373 17569 10293 1 16 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.748 -0.610 17569 10294 1 16 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.738 0.262 17569 10295 1 16 . 1 1 136 136 LEU H H 290 7.968 7.968 7.795 0.173 17569 10296 1 16 . 1 1 137 137 LEU N N 291 118.900 118.900 119.734 -0.834 17569 10297 1 16 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.058 0.183 17569 10298 1 16 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.520 -1.159 17569 10299 1 16 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.430 -0.958 17569 10300 1 16 . 1 1 137 137 LEU H H 291 8.154 8.154 7.971 0.183 17569 10301 1 16 . 1 1 138 138 GLN N N 292 117.993 117.993 115.540 2.453 17569 10302 1 16 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.403 -0.131 17569 10303 1 16 . 1 1 138 138 GLN CA C 292 56.632 56.632 54.760 1.872 17569 10304 1 16 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.079 -0.496 17569 10305 1 16 . 1 1 138 138 GLN H H 292 7.896 7.896 7.595 0.301 17569 10306 1 16 . 1 1 139 139 GLN N N 293 118.889 118.889 119.737 -0.848 17569 10307 1 16 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.421 -0.152 17569 10308 1 16 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.560 0.894 17569 10309 1 16 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.756 -0.687 17569 10310 1 16 . 1 1 139 139 GLN H H 293 8.091 8.091 7.402 0.689 17569 10311 1 16 . 1 1 140 140 ASN N N 294 118.604 118.604 122.625 -4.021 17569 10312 1 16 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.864 -0.105 17569 10313 1 16 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.596 0.625 17569 10314 1 16 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.035 -1.302 17569 10315 1 16 . 1 1 140 140 ASN H H 294 8.273 8.273 8.493 -0.220 17569 10316 1 16 . 1 1 141 141 LYS N N 295 121.685 121.685 120.361 1.324 17569 10317 1 16 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.871 -0.511 17569 10318 1 16 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.690 0.483 17569 10319 1 16 . 1 1 141 141 LYS CB C 295 32.535 32.535 34.508 -1.973 17569 10320 1 16 . 1 1 141 141 LYS H H 295 8.089 8.089 8.361 -0.272 17569 10321 1 17 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.900 -0.513 17569 10322 1 17 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.163 0.282 17569 10323 1 17 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.175 -0.919 17569 10324 1 17 . 1 1 3 3 MET HA H 157 4.476 4.476 4.740 -0.264 17569 10325 1 17 . 1 1 3 3 MET CA C 157 55.401 55.401 55.006 0.395 17569 10326 1 17 . 1 1 4 4 ALA N N 158 124.828 124.828 123.105 1.723 17569 10327 1 17 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.659 -0.345 17569 10328 1 17 . 1 1 4 4 ALA CA C 158 52.511 52.511 52.116 0.395 17569 10329 1 17 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.938 -0.937 17569 10330 1 17 . 1 1 4 4 ALA H H 158 8.382 8.382 8.339 0.043 17569 10331 1 17 . 1 1 5 5 ASP N N 159 119.418 119.418 120.700 -1.282 17569 10332 1 17 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.669 -0.079 17569 10333 1 17 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.697 -0.560 17569 10334 1 17 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.775 -0.760 17569 10335 1 17 . 1 1 5 5 ASP H H 159 8.312 8.312 8.593 -0.281 17569 10336 1 17 . 1 1 6 6 LYS N N 160 121.604 121.604 120.786 0.818 17569 10337 1 17 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.504 -0.161 17569 10338 1 17 . 1 1 6 6 LYS H H 160 8.274 8.274 8.173 0.101 17569 10339 1 17 . 1 1 7 7 ARG N N 161 121.611 121.611 124.474 -2.863 17569 10340 1 17 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.440 -0.113 17569 10341 1 17 . 1 1 7 7 ARG H H 161 8.430 8.430 8.958 -0.528 17569 10342 1 17 . 1 1 8 8 GLY N N 162 109.606 109.606 109.865 -0.259 17569 10343 1 17 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.708 0.339 17569 10344 1 17 . 1 1 8 8 GLY H H 162 8.473 8.473 8.367 0.106 17569 10345 1 17 . 1 1 9 9 ASP N N 163 120.187 120.187 118.976 1.211 17569 10346 1 17 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.768 -0.119 17569 10347 1 17 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.431 0.720 17569 10348 1 17 . 1 1 9 9 ASP H H 163 8.296 8.296 7.885 0.411 17569 10349 1 17 . 1 1 10 10 GLY N N 164 108.816 108.816 110.022 -1.206 17569 10350 1 17 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.384 -0.017 17569 10351 1 17 . 1 1 10 10 GLY H H 164 8.458 8.458 8.511 -0.053 17569 10352 1 17 . 1 1 11 11 LEU N N 165 121.195 121.195 121.019 0.176 17569 10353 1 17 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.747 -0.431 17569 10354 1 17 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.021 0.979 17569 10355 1 17 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.477 -2.546 17569 10356 1 17 . 1 1 11 11 LEU H H 165 8.137 8.137 7.918 0.219 17569 10357 1 17 . 1 1 12 12 HIS N N 166 119.387 119.387 118.097 1.290 17569 10358 1 17 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.724 -0.069 17569 10359 1 17 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.785 0.484 17569 10360 1 17 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.058 -0.361 17569 10361 1 17 . 1 1 12 12 HIS H H 166 8.270 8.270 8.682 -0.412 17569 10362 1 17 . 1 1 13 13 GLY N N 167 109.899 109.899 113.570 -3.671 17569 10363 1 17 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.877 0.228 17569 10364 1 17 . 1 1 13 13 GLY H H 167 8.276 8.276 8.563 -0.287 17569 10365 1 17 . 1 1 14 14 ILE N N 168 119.597 119.597 121.645 -2.048 17569 10366 1 17 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.335 -0.012 17569 10367 1 17 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.923 0.677 17569 10368 1 17 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.220 -2.270 17569 10369 1 17 . 1 1 14 14 ILE H H 168 7.962 7.962 8.122 -0.160 17569 10370 1 17 . 1 1 15 15 VAL N N 169 127.578 127.578 125.624 1.954 17569 10371 1 17 . 1 1 15 15 VAL HA H 169 4.280 4.280 3.977 0.303 17569 10372 1 17 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.651 -1.334 17569 10373 1 17 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.831 2.571 17569 10374 1 17 . 1 1 15 15 VAL H H 169 9.011 9.011 8.490 0.521 17569 10375 1 17 . 1 1 16 16 SER N N 170 118.596 118.596 120.337 -1.741 17569 10376 1 17 . 1 1 16 16 SER HA H 170 5.140 5.140 4.769 0.371 17569 10377 1 17 . 1 1 16 16 SER CA C 170 55.985 55.985 56.430 -0.445 17569 10378 1 17 . 1 1 16 16 SER CB C 170 65.261 65.261 65.670 -0.409 17569 10379 1 17 . 1 1 16 16 SER H H 170 8.242 8.242 7.697 0.545 17569 10380 1 17 . 1 1 17 17 CYS N N 171 123.783 123.783 122.742 1.041 17569 10381 1 17 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.147 0.034 17569 10382 1 17 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.480 -0.636 17569 10383 1 17 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.865 2.508 17569 10384 1 17 . 1 1 17 17 CYS H H 171 8.894 8.894 8.491 0.403 17569 10385 1 17 . 1 1 18 18 THR N N 172 121.703 121.703 117.711 3.992 17569 10386 1 17 . 1 1 18 18 THR HA H 172 4.386 4.386 4.094 0.292 17569 10387 1 17 . 1 1 18 18 THR CA C 172 64.667 64.667 64.650 0.017 17569 10388 1 17 . 1 1 18 18 THR CB C 172 69.498 69.498 68.827 0.671 17569 10389 1 17 . 1 1 18 18 THR H H 172 8.788 8.788 8.214 0.574 17569 10390 1 17 . 1 1 19 19 ALA N N 173 131.364 131.364 121.737 9.627 17569 10391 1 17 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.131 0.365 17569 10392 1 17 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.681 0.344 17569 10393 1 17 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.712 3.470 17569 10394 1 17 . 1 1 19 19 ALA H H 173 9.680 9.680 7.884 1.796 17569 10395 1 17 . 1 1 20 20 CYS N N 174 115.498 115.498 114.818 0.680 17569 10396 1 17 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.441 0.527 17569 10397 1 17 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.387 -1.293 17569 10398 1 17 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.155 4.089 17569 10399 1 17 . 1 1 20 20 CYS H H 174 8.470 8.470 7.551 0.919 17569 10400 1 17 . 1 1 21 21 GLY N N 175 112.464 112.464 108.638 3.826 17569 10401 1 17 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.112 0.594 17569 10402 1 17 . 1 1 21 21 GLY H H 175 7.884 7.884 7.910 -0.026 17569 10403 1 17 . 1 1 22 22 GLN N N 176 121.784 121.784 118.195 3.589 17569 10404 1 17 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.461 -0.085 17569 10405 1 17 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.403 1.888 17569 10406 1 17 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.992 -2.651 17569 10407 1 17 . 1 1 22 22 GLN H H 176 8.723 8.723 7.864 0.859 17569 10408 1 17 . 1 1 23 23 GLN N N 177 122.900 122.900 122.993 -0.093 17569 10409 1 17 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.236 0.294 17569 10410 1 17 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.732 -0.182 17569 10411 1 17 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.164 -0.704 17569 10412 1 17 . 1 1 23 23 GLN H H 177 8.721 8.721 8.512 0.209 17569 10413 1 17 . 1 1 24 24 VAL N N 178 121.000 121.000 124.122 -3.122 17569 10414 1 17 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.043 0.481 17569 10415 1 17 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.051 -1.174 17569 10416 1 17 . 1 1 24 24 VAL H H 178 8.689 8.689 7.862 0.827 17569 10417 1 17 . 1 1 25 25 ASN N N 179 121.392 121.392 123.960 -2.568 17569 10418 1 17 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.370 0.505 17569 10419 1 17 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.691 -2.542 17569 10420 1 17 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.704 -0.727 17569 10421 1 17 . 1 1 25 25 ASN H H 179 8.635 8.635 8.225 0.410 17569 10422 1 17 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.082 0.378 17569 10423 1 17 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.769 -1.771 17569 10424 1 17 . 1 1 27 27 PHE CB C 181 38.393 38.393 37.707 0.686 17569 10425 1 17 . 1 1 28 28 GLN N N 182 119.300 119.300 119.419 -0.119 17569 10426 1 17 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.393 0.125 17569 10427 1 17 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.328 -1.986 17569 10428 1 17 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.335 0.015 17569 10429 1 17 . 1 1 28 28 GLN H H 182 7.494 7.494 7.709 -0.215 17569 10430 1 17 . 1 1 29 29 LYS N N 183 124.516 124.516 126.183 -1.667 17569 10431 1 17 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.512 -0.590 17569 10432 1 17 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.701 1.611 17569 10433 1 17 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.187 0.099 17569 10434 1 17 . 1 1 29 29 LYS H H 183 8.779 8.779 8.622 0.157 17569 10435 1 17 . 1 1 30 30 ASP N N 184 116.500 116.500 118.636 -2.136 17569 10436 1 17 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.802 -0.343 17569 10437 1 17 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.579 -0.043 17569 10438 1 17 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.907 -0.936 17569 10439 1 17 . 1 1 30 30 ASP H H 184 8.556 8.556 8.184 0.372 17569 10440 1 17 . 1 1 31 31 SER N N 185 111.505 111.505 115.061 -3.556 17569 10441 1 17 . 1 1 31 31 SER HA H 185 4.695 4.695 4.751 -0.056 17569 10442 1 17 . 1 1 31 31 SER CA C 185 59.747 59.747 58.687 1.060 17569 10443 1 17 . 1 1 31 31 SER CB C 185 65.198 65.198 64.203 0.995 17569 10444 1 17 . 1 1 31 31 SER H H 185 7.933 7.933 8.681 -0.748 17569 10445 1 17 . 1 1 32 32 ILE N N 186 113.394 113.394 116.563 -3.169 17569 10446 1 17 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.075 -0.189 17569 10447 1 17 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.278 -0.699 17569 10448 1 17 . 1 1 32 32 ILE CB C 186 41.812 41.812 41.030 0.782 17569 10449 1 17 . 1 1 32 32 ILE H H 186 7.105 7.105 7.616 -0.511 17569 10450 1 17 . 1 1 33 33 TYR N N 187 119.098 119.098 121.000 -1.902 17569 10451 1 17 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.135 -0.612 17569 10452 1 17 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.173 1.087 17569 10453 1 17 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.669 2.771 17569 10454 1 17 . 1 1 33 33 TYR H H 187 8.954 8.954 7.911 1.043 17569 10455 1 17 . 1 1 34 34 ARG N N 188 118.502 118.502 122.738 -4.236 17569 10456 1 17 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.832 -0.195 17569 10457 1 17 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.331 -1.579 17569 10458 1 17 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.087 1.165 17569 10459 1 17 . 1 1 34 34 ARG H H 188 8.412 8.412 8.568 -0.156 17569 10460 1 17 . 1 1 35 35 HIS N N 189 126.596 126.596 127.805 -1.209 17569 10461 1 17 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.933 -0.341 17569 10462 1 17 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.934 -0.213 17569 10463 1 17 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.199 1.273 17569 10464 1 17 . 1 1 35 35 HIS H H 189 9.813 9.813 9.104 0.709 17569 10465 1 17 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.593 -0.295 17569 10466 1 17 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.912 0.364 17569 10467 1 17 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.068 0.784 17569 10468 1 17 . 1 1 37 37 SER N N 191 110.003 110.003 113.819 -3.816 17569 10469 1 17 . 1 1 37 37 SER HA H 191 4.918 4.918 4.314 0.604 17569 10470 1 17 . 1 1 37 37 SER CA C 191 59.031 59.031 61.521 -2.490 17569 10471 1 17 . 1 1 37 37 SER CB C 191 65.104 65.104 63.268 1.836 17569 10472 1 17 . 1 1 37 37 SER H H 191 8.934 8.934 8.651 0.283 17569 10473 1 17 . 1 1 38 38 LEU N N 192 120.959 120.959 114.248 6.711 17569 10474 1 17 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.921 -0.792 17569 10475 1 17 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.272 1.874 17569 10476 1 17 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.383 1.613 17569 10477 1 17 . 1 1 38 38 LEU H H 192 8.649 8.649 7.023 1.626 17569 10478 1 17 . 1 1 39 39 GLN N N 193 108.600 108.600 119.148 -10.548 17569 10479 1 17 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.093 -0.188 17569 10480 1 17 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.691 0.123 17569 10481 1 17 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.586 -1.552 17569 10482 1 17 . 1 1 39 39 GLN H H 193 8.465 8.465 7.840 0.625 17569 10483 1 17 . 1 1 40 40 VAL N N 194 105.325 105.325 117.683 -12.358 17569 10484 1 17 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.502 0.048 17569 10485 1 17 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.638 -0.997 17569 10486 1 17 . 1 1 40 40 VAL H H 194 6.256 6.256 7.858 -1.602 17569 10487 1 17 . 1 1 41 41 LEU N N 195 123.100 123.100 122.107 0.993 17569 10488 1 17 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.771 0.045 17569 10489 1 17 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.622 3.560 17569 10490 1 17 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.970 0.600 17569 10491 1 17 . 1 1 41 41 LEU H H 195 9.154 9.154 8.542 0.612 17569 10492 1 17 . 1 1 42 42 ILE N N 196 124.396 124.396 117.375 7.021 17569 10493 1 17 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.849 1.503 17569 10494 1 17 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.222 1.008 17569 10495 1 17 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.890 1.380 17569 10496 1 17 . 1 1 42 42 ILE H H 196 9.766 9.766 7.840 1.926 17569 10497 1 17 . 1 1 43 43 CYS N N 197 121.500 121.500 114.947 6.553 17569 10498 1 17 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.245 0.017 17569 10499 1 17 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.109 0.594 17569 10500 1 17 . 1 1 43 43 CYS CB C 197 33.300 33.300 30.986 2.314 17569 10501 1 17 . 1 1 43 43 CYS H H 197 9.882 9.882 8.333 1.549 17569 10502 1 17 . 1 1 44 44 LYS N N 198 117.995 117.995 122.563 -4.568 17569 10503 1 17 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.186 -0.197 17569 10504 1 17 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.438 -0.778 17569 10505 1 17 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.423 0.277 17569 10506 1 17 . 1 1 44 44 LYS H H 198 8.089 8.089 8.775 -0.686 17569 10507 1 17 . 1 1 45 45 ASN N N 199 119.200 119.200 117.291 1.909 17569 10508 1 17 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.572 -0.058 17569 10509 1 17 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.866 0.854 17569 10510 1 17 . 1 1 45 45 ASN CB C 199 38.167 38.167 37.945 0.222 17569 10511 1 17 . 1 1 45 45 ASN H H 199 8.356 8.356 8.463 -0.107 17569 10512 1 17 . 1 1 46 46 CYS N N 200 126.600 126.600 118.314 8.286 17569 10513 1 17 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.006 0.175 17569 10514 1 17 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.090 2.405 17569 10515 1 17 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.210 1.972 17569 10516 1 17 . 1 1 46 46 CYS H H 200 9.189 9.189 7.812 1.377 17569 10517 1 17 . 1 1 47 47 PHE N N 201 121.962 121.962 120.350 1.612 17569 10518 1 17 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.127 -0.257 17569 10519 1 17 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.773 1.496 17569 10520 1 17 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.600 0.567 17569 10521 1 17 . 1 1 47 47 PHE H H 201 8.826 8.826 7.823 1.003 17569 10522 1 17 . 1 1 48 48 LYS N N 202 117.400 117.400 120.007 -2.607 17569 10523 1 17 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.890 -0.192 17569 10524 1 17 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.265 -1.313 17569 10525 1 17 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.260 -0.718 17569 10526 1 17 . 1 1 48 48 LYS H H 202 8.512 8.512 8.087 0.425 17569 10527 1 17 . 1 1 49 49 TYR N N 203 120.400 120.400 120.786 -0.386 17569 10528 1 17 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.224 0.190 17569 10529 1 17 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.547 -0.775 17569 10530 1 17 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.712 -0.266 17569 10531 1 17 . 1 1 49 49 TYR H H 203 8.133 8.133 7.746 0.387 17569 10532 1 17 . 1 1 50 50 TYR N N 204 121.783 121.783 117.690 4.093 17569 10533 1 17 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.697 -1.202 17569 10534 1 17 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.981 2.969 17569 10535 1 17 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.593 0.899 17569 10536 1 17 . 1 1 50 50 TYR H H 204 8.765 8.765 7.509 1.256 17569 10537 1 17 . 1 1 51 51 MET N N 205 110.800 110.800 114.795 -3.995 17569 10538 1 17 . 1 1 51 51 MET HA H 205 4.349 4.349 4.152 0.197 17569 10539 1 17 . 1 1 51 51 MET CA C 205 53.505 53.505 58.095 -4.590 17569 10540 1 17 . 1 1 51 51 MET CB C 205 30.384 30.384 33.281 -2.897 17569 10541 1 17 . 1 1 51 51 MET H H 205 7.771 7.771 8.405 -0.634 17569 10542 1 17 . 1 1 52 52 SER N N 206 116.800 116.800 113.317 3.483 17569 10543 1 17 . 1 1 52 52 SER HA H 206 3.919 3.919 4.395 -0.476 17569 10544 1 17 . 1 1 52 52 SER CA C 206 61.621 61.621 59.278 2.344 17569 10545 1 17 . 1 1 52 52 SER CB C 206 62.611 62.611 64.189 -1.578 17569 10546 1 17 . 1 1 52 52 SER H H 206 7.581 7.581 8.222 -0.641 17569 10547 1 17 . 1 1 53 53 ASP N N 207 117.400 117.400 121.305 -3.905 17569 10548 1 17 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.819 -0.247 17569 10549 1 17 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.796 -0.697 17569 10550 1 17 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.143 0.045 17569 10551 1 17 . 1 1 53 53 ASP H H 207 7.085 7.085 8.016 -0.931 17569 10552 1 17 . 1 1 54 54 ASP N N 208 119.405 119.405 122.296 -2.891 17569 10553 1 17 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.953 -0.564 17569 10554 1 17 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.459 0.441 17569 10555 1 17 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.903 -1.554 17569 10556 1 17 . 1 1 54 54 ASP H H 208 8.439 8.439 8.435 0.004 17569 10557 1 17 . 1 1 55 55 ILE N N 209 124.698 124.698 121.616 3.082 17569 10558 1 17 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.374 -0.374 17569 10559 1 17 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.970 1.308 17569 10560 1 17 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.340 1.951 17569 10561 1 17 . 1 1 55 55 ILE H H 209 8.128 8.128 8.482 -0.354 17569 10562 1 17 . 1 1 56 56 SER N N 210 126.703 126.703 123.202 3.501 17569 10563 1 17 . 1 1 56 56 SER HA H 210 4.365 4.365 4.835 -0.470 17569 10564 1 17 . 1 1 56 56 SER CA C 210 57.769 57.769 56.882 0.887 17569 10565 1 17 . 1 1 56 56 SER CB C 210 64.991 64.991 64.799 0.192 17569 10566 1 17 . 1 1 56 56 SER H H 210 8.815 8.815 8.643 0.172 17569 10567 1 17 . 1 1 57 57 ARG N N 211 116.885 116.885 120.203 -3.318 17569 10568 1 17 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.642 0.400 17569 10569 1 17 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.947 -1.547 17569 10570 1 17 . 1 1 57 57 ARG CB C 211 34.284 34.284 30.776 3.508 17569 10571 1 17 . 1 1 57 57 ARG H H 211 8.365 8.365 8.457 -0.092 17569 10572 1 17 . 1 1 58 58 ASP N N 212 121.982 121.982 123.096 -1.114 17569 10573 1 17 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.793 -0.178 17569 10574 1 17 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.177 -1.955 17569 10575 1 17 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.880 -1.378 17569 10576 1 17 . 1 1 58 58 ASP H H 212 8.706 8.706 8.627 0.079 17569 10577 1 17 . 1 1 59 59 SER N N 213 114.164 114.164 115.675 -1.511 17569 10578 1 17 . 1 1 59 59 SER HA H 213 4.212 4.212 4.245 -0.033 17569 10579 1 17 . 1 1 59 59 SER CA C 213 60.840 60.840 60.749 0.091 17569 10580 1 17 . 1 1 59 59 SER CB C 213 62.714 62.714 63.092 -0.378 17569 10581 1 17 . 1 1 59 59 SER H H 213 8.687 8.687 8.797 -0.110 17569 10582 1 17 . 1 1 60 60 ASP N N 214 120.899 120.899 120.856 0.043 17569 10583 1 17 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.754 0.071 17569 10584 1 17 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.629 0.582 17569 10585 1 17 . 1 1 60 60 ASP CB C 214 41.558 41.558 39.877 1.681 17569 10586 1 17 . 1 1 60 60 ASP H H 214 8.193 8.193 7.842 0.351 17569 10587 1 17 . 1 1 61 61 GLY N N 215 108.300 108.300 109.093 -0.793 17569 10588 1 17 . 1 1 61 61 GLY CA C 215 45.397 45.397 46.062 -0.665 17569 10589 1 17 . 1 1 61 61 GLY H H 215 8.234 8.234 8.027 0.207 17569 10590 1 17 . 1 1 62 62 MET N N 216 120.002 120.002 118.314 1.688 17569 10591 1 17 . 1 1 62 62 MET HA H 216 4.972 4.972 4.593 0.379 17569 10592 1 17 . 1 1 62 62 MET CA C 216 53.151 53.151 54.435 -1.284 17569 10593 1 17 . 1 1 62 62 MET CB C 216 32.311 32.311 36.007 -3.696 17569 10594 1 17 . 1 1 62 62 MET H H 216 8.376 8.376 7.452 0.924 17569 10595 1 17 . 1 1 63 63 ASP N N 217 127.300 127.300 126.807 0.493 17569 10596 1 17 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.687 0.279 17569 10597 1 17 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.581 -0.012 17569 10598 1 17 . 1 1 63 63 ASP H H 217 9.368 9.368 8.705 0.663 17569 10599 1 17 . 1 1 64 64 GLU N N 218 114.400 114.400 125.412 -11.012 17569 10600 1 17 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.523 -0.367 17569 10601 1 17 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.410 0.440 17569 10602 1 17 . 1 1 64 64 GLU H H 218 8.583 8.583 8.564 0.019 17569 10603 1 17 . 1 1 65 65 GLN N N 219 115.500 115.500 117.513 -2.013 17569 10604 1 17 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.681 -0.370 17569 10605 1 17 . 1 1 65 65 GLN CA C 219 55.346 55.346 54.747 0.599 17569 10606 1 17 . 1 1 65 65 GLN H H 219 7.158 7.158 8.058 -0.900 17569 10607 1 17 . 1 1 66 66 CYS N N 220 122.600 122.600 117.173 5.427 17569 10608 1 17 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.472 -1.395 17569 10609 1 17 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.527 1.002 17569 10610 1 17 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.211 1.761 17569 10611 1 17 . 1 1 66 66 CYS H H 220 8.248 8.248 8.382 -0.134 17569 10612 1 17 . 1 1 67 67 ARG N N 221 130.363 130.363 123.740 6.623 17569 10613 1 17 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.377 -0.310 17569 10614 1 17 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.076 -2.060 17569 10615 1 17 . 1 1 67 67 ARG H H 221 9.145 9.145 8.675 0.470 17569 10616 1 17 . 1 1 68 68 TRP N N 222 124.200 124.200 120.551 3.649 17569 10617 1 17 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.701 -0.265 17569 10618 1 17 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.285 0.795 17569 10619 1 17 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.596 0.598 17569 10620 1 17 . 1 1 68 68 TRP H H 222 9.689 9.689 8.213 1.476 17569 10621 1 17 . 1 1 69 69 CYS N N 223 116.297 116.297 110.722 5.575 17569 10622 1 17 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.041 0.050 17569 10623 1 17 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.955 3.147 17569 10624 1 17 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.474 4.864 17569 10625 1 17 . 1 1 69 69 CYS H H 223 8.822 8.822 7.705 1.117 17569 10626 1 17 . 1 1 70 70 ALA N N 224 123.112 123.112 123.924 -0.812 17569 10627 1 17 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.315 0.091 17569 10628 1 17 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.150 -0.299 17569 10629 1 17 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.863 -0.143 17569 10630 1 17 . 1 1 70 70 ALA H H 224 8.787 8.787 8.180 0.607 17569 10631 1 17 . 1 1 71 71 GLU N N 225 118.300 118.300 120.663 -2.363 17569 10632 1 17 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.502 0.806 17569 10633 1 17 . 1 1 71 71 GLU CA C 225 53.299 53.299 56.008 -2.709 17569 10634 1 17 . 1 1 71 71 GLU H H 225 8.541 8.541 8.069 0.471 17569 10635 1 17 . 1 1 72 72 GLY N N 226 111.995 111.995 109.102 2.893 17569 10636 1 17 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.631 -0.228 17569 10637 1 17 . 1 1 72 72 GLY H H 226 9.837 9.837 8.460 1.377 17569 10638 1 17 . 1 1 73 73 GLY N N 227 106.600 106.600 107.624 -1.024 17569 10639 1 17 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.064 0.907 17569 10640 1 17 . 1 1 73 73 GLY H H 227 7.772 7.772 8.493 -0.721 17569 10641 1 17 . 1 1 74 74 ASN N N 228 124.277 124.277 119.232 5.045 17569 10642 1 17 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.467 0.614 17569 10643 1 17 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.884 -0.784 17569 10644 1 17 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.404 -0.320 17569 10645 1 17 . 1 1 74 74 ASN H H 228 8.876 8.876 8.513 0.363 17569 10646 1 17 . 1 1 75 75 LEU N N 229 123.050 123.050 122.172 0.878 17569 10647 1 17 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.908 -0.308 17569 10648 1 17 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.415 0.947 17569 10649 1 17 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.217 -0.717 17569 10650 1 17 . 1 1 75 75 LEU H H 229 8.901 8.901 7.995 0.906 17569 10651 1 17 . 1 1 76 76 ILE N N 230 123.552 123.552 123.885 -0.333 17569 10652 1 17 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.154 0.331 17569 10653 1 17 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.089 -0.389 17569 10654 1 17 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.737 -0.338 17569 10655 1 17 . 1 1 76 76 ILE H H 230 9.406 9.406 9.240 0.166 17569 10656 1 17 . 1 1 77 77 CYS N N 231 124.637 124.637 125.888 -1.251 17569 10657 1 17 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.508 -0.633 17569 10658 1 17 . 1 1 77 77 CYS CA C 231 58.359 58.359 56.974 1.385 17569 10659 1 17 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.546 0.888 17569 10660 1 17 . 1 1 77 77 CYS H H 231 8.809 8.809 8.480 0.329 17569 10661 1 17 . 1 1 78 78 CYS N N 232 125.697 125.697 122.303 3.394 17569 10662 1 17 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.720 -0.436 17569 10663 1 17 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.917 3.967 17569 10664 1 17 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.726 1.444 17569 10665 1 17 . 1 1 78 78 CYS H H 232 8.579 8.579 8.720 -0.141 17569 10666 1 17 . 1 1 79 79 ASP N N 233 123.600 123.600 126.223 -2.623 17569 10667 1 17 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.500 0.257 17569 10668 1 17 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.246 2.743 17569 10669 1 17 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.096 1.533 17569 10670 1 17 . 1 1 79 79 ASP H H 233 8.577 8.577 8.087 0.490 17569 10671 1 17 . 1 1 80 80 PHE N N 234 122.100 122.100 116.385 5.715 17569 10672 1 17 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.574 -0.048 17569 10673 1 17 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.086 1.823 17569 10674 1 17 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.248 1.601 17569 10675 1 17 . 1 1 80 80 PHE H H 234 10.432 10.432 7.175 3.257 17569 10676 1 17 . 1 1 81 81 CYS N N 235 124.300 124.300 117.573 6.727 17569 10677 1 17 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.714 0.442 17569 10678 1 17 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.857 0.188 17569 10679 1 17 . 1 1 81 81 CYS CB C 235 31.407 31.407 26.822 4.585 17569 10680 1 17 . 1 1 81 81 CYS H H 235 8.476 8.476 7.928 0.548 17569 10681 1 17 . 1 1 82 82 HIS N N 236 112.598 112.598 119.396 -6.798 17569 10682 1 17 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.145 0.838 17569 10683 1 17 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.352 -1.954 17569 10684 1 17 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.995 2.261 17569 10685 1 17 . 1 1 82 82 HIS H H 236 6.699 6.699 8.168 -1.469 17569 10686 1 17 . 1 1 83 83 ASN N N 237 123.600 123.600 118.412 5.188 17569 10687 1 17 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.868 -0.067 17569 10688 1 17 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.486 3.130 17569 10689 1 17 . 1 1 83 83 ASN H H 237 9.097 9.097 7.969 1.128 17569 10690 1 17 . 1 1 84 84 ALA N N 238 122.000 122.000 124.033 -2.033 17569 10691 1 17 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.286 0.123 17569 10692 1 17 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.255 0.109 17569 10693 1 17 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.103 2.967 17569 10694 1 17 . 1 1 84 84 ALA H H 238 9.885 9.885 8.492 1.393 17569 10695 1 17 . 1 1 85 85 PHE N N 239 116.707 116.707 122.115 -5.408 17569 10696 1 17 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.166 0.862 17569 10697 1 17 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.321 -0.104 17569 10698 1 17 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.235 2.429 17569 10699 1 17 . 1 1 85 85 PHE H H 239 9.450 9.450 9.102 0.348 17569 10700 1 17 . 1 1 86 86 CYS N N 240 126.682 126.682 124.828 1.854 17569 10701 1 17 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.770 0.852 17569 10702 1 17 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.783 -0.441 17569 10703 1 17 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.080 3.177 17569 10704 1 17 . 1 1 86 86 CYS H H 240 11.309 11.309 9.496 1.813 17569 10705 1 17 . 1 1 87 87 LYS N N 241 117.865 117.865 124.253 -6.388 17569 10706 1 17 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.935 -0.086 17569 10707 1 17 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.124 -0.055 17569 10708 1 17 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.511 0.287 17569 10709 1 17 . 1 1 87 87 LYS H H 241 8.230 8.230 8.871 -0.641 17569 10710 1 17 . 1 1 88 88 LYS N N 242 117.949 117.949 118.220 -0.271 17569 10711 1 17 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.100 -0.122 17569 10712 1 17 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.223 1.147 17569 10713 1 17 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.992 0.324 17569 10714 1 17 . 1 1 88 88 LYS H H 242 7.945 7.945 8.579 -0.634 17569 10715 1 17 . 1 1 89 89 CYS N N 243 125.305 125.305 117.918 7.387 17569 10716 1 17 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.271 -0.529 17569 10717 1 17 . 1 1 89 89 CYS CA C 243 64.827 64.827 61.907 2.920 17569 10718 1 17 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.011 1.230 17569 10719 1 17 . 1 1 89 89 CYS H H 243 9.297 9.297 7.756 1.541 17569 10720 1 17 . 1 1 90 90 ILE N N 244 119.687 119.687 121.548 -1.861 17569 10721 1 17 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.064 -0.457 17569 10722 1 17 . 1 1 90 90 ILE CA C 244 65.950 65.950 63.559 2.391 17569 10723 1 17 . 1 1 90 90 ILE H H 244 7.997 7.997 7.661 0.336 17569 10724 1 17 . 1 1 91 91 LEU N N 245 120.280 120.280 121.541 -1.261 17569 10725 1 17 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.402 -0.717 17569 10726 1 17 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.681 0.554 17569 10727 1 17 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.890 0.068 17569 10728 1 17 . 1 1 91 91 LEU H H 245 8.810 8.810 8.830 -0.020 17569 10729 1 17 . 1 1 92 92 ARG N N 246 116.901 116.901 116.863 0.038 17569 10730 1 17 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.152 -0.335 17569 10731 1 17 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.897 1.083 17569 10732 1 17 . 1 1 92 92 ARG CB C 246 30.600 30.600 29.978 0.622 17569 10733 1 17 . 1 1 92 92 ARG H H 246 8.086 8.086 7.660 0.426 17569 10734 1 17 . 1 1 93 93 ASN N N 247 111.200 111.200 116.105 -4.905 17569 10735 1 17 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.536 0.067 17569 10736 1 17 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.290 1.518 17569 10737 1 17 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.233 3.252 17569 10738 1 17 . 1 1 93 93 ASN H H 247 7.136 7.136 8.210 -1.074 17569 10739 1 17 . 1 1 94 94 LEU N N 248 118.807 118.807 117.191 1.616 17569 10740 1 17 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.405 0.409 17569 10741 1 17 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.074 0.115 17569 10742 1 17 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.755 -0.057 17569 10743 1 17 . 1 1 94 94 LEU H H 248 8.515 8.515 7.979 0.536 17569 10744 1 17 . 1 1 95 95 GLY N N 249 108.000 108.000 105.539 2.461 17569 10745 1 17 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.977 -0.349 17569 10746 1 17 . 1 1 95 95 GLY H H 249 7.955 7.955 8.113 -0.158 17569 10747 1 17 . 1 1 96 96 ARG N N 250 117.797 117.797 122.595 -4.798 17569 10748 1 17 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.339 -0.496 17569 10749 1 17 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.148 0.534 17569 10750 1 17 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.314 -0.454 17569 10751 1 17 . 1 1 96 96 ARG H H 250 8.559 8.559 8.692 -0.133 17569 10752 1 17 . 1 1 97 97 LYS N N 251 120.900 120.900 120.936 -0.036 17569 10753 1 17 . 1 1 97 97 LYS HA H 251 4.156 4.156 3.969 0.187 17569 10754 1 17 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.989 -0.833 17569 10755 1 17 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.561 -0.201 17569 10756 1 17 . 1 1 97 97 LYS H H 251 8.655 8.655 8.591 0.064 17569 10757 1 17 . 1 1 98 98 GLU N N 252 122.000 122.000 118.725 3.275 17569 10758 1 17 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.075 0.276 17569 10759 1 17 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.544 -0.962 17569 10760 1 17 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.242 -0.842 17569 10761 1 17 . 1 1 98 98 GLU H H 252 7.705 7.705 8.398 -0.693 17569 10762 1 17 . 1 1 99 99 LEU N N 253 117.400 117.400 120.873 -3.473 17569 10763 1 17 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.827 0.090 17569 10764 1 17 . 1 1 99 99 LEU CA C 253 57.998 57.998 57.992 0.006 17569 10765 1 17 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.795 -0.313 17569 10766 1 17 . 1 1 99 99 LEU H H 253 7.285 7.285 7.916 -0.631 17569 10767 1 17 . 1 1 100 100 SER N N 254 112.100 112.100 114.429 -2.329 17569 10768 1 17 . 1 1 100 100 SER HA H 254 4.107 4.107 4.186 -0.079 17569 10769 1 17 . 1 1 100 100 SER CA C 254 61.603 61.603 62.066 -0.464 17569 10770 1 17 . 1 1 100 100 SER CB C 254 62.622 62.622 63.171 -0.549 17569 10771 1 17 . 1 1 100 100 SER H H 254 8.326 8.326 8.518 -0.192 17569 10772 1 17 . 1 1 101 101 THR N N 255 118.151 118.151 118.580 -0.429 17569 10773 1 17 . 1 1 101 101 THR HA H 255 4.026 4.026 4.074 -0.048 17569 10774 1 17 . 1 1 101 101 THR CA C 255 66.261 66.261 66.971 -0.710 17569 10775 1 17 . 1 1 101 101 THR CB C 255 68.735 68.735 68.851 -0.116 17569 10776 1 17 . 1 1 101 101 THR H H 255 7.972 7.972 8.181 -0.209 17569 10777 1 17 . 1 1 102 102 ILE N N 256 120.100 120.100 122.486 -2.386 17569 10778 1 17 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.554 -0.091 17569 10779 1 17 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.700 0.074 17569 10780 1 17 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.483 0.258 17569 10781 1 17 . 1 1 102 102 ILE H H 256 7.868 7.868 8.517 -0.649 17569 10782 1 17 . 1 1 103 103 MET N N 257 114.876 114.876 117.534 -2.658 17569 10783 1 17 . 1 1 103 103 MET HA H 257 4.211 4.211 4.048 0.163 17569 10784 1 17 . 1 1 103 103 MET CA C 257 55.691 55.691 58.332 -2.641 17569 10785 1 17 . 1 1 103 103 MET CB C 257 32.000 32.000 32.889 -0.889 17569 10786 1 17 . 1 1 103 103 MET H H 257 7.606 7.606 7.207 0.399 17569 10787 1 17 . 1 1 104 104 ASP N N 258 119.976 119.976 119.459 0.517 17569 10788 1 17 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.791 -0.253 17569 10789 1 17 . 1 1 104 104 ASP CA C 258 54.912 54.912 54.075 0.837 17569 10790 1 17 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.442 1.058 17569 10791 1 17 . 1 1 104 104 ASP H H 258 7.444 7.444 7.669 -0.225 17569 10792 1 17 . 1 1 105 105 GLU N N 259 124.388 124.388 120.193 4.195 17569 10793 1 17 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.534 -0.247 17569 10794 1 17 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.937 2.634 17569 10795 1 17 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.890 -0.348 17569 10796 1 17 . 1 1 105 105 GLU H H 259 8.559 8.559 8.125 0.434 17569 10797 1 17 . 1 1 106 106 ASN N N 260 117.201 117.201 117.402 -0.201 17569 10798 1 17 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.383 0.359 17569 10799 1 17 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.785 -0.042 17569 10800 1 17 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.657 1.261 17569 10801 1 17 . 1 1 106 106 ASN H H 260 8.673 8.673 8.375 0.298 17569 10802 1 17 . 1 1 107 107 ASN N N 261 117.900 117.900 114.296 3.604 17569 10803 1 17 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.282 0.703 17569 10804 1 17 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.699 -2.397 17569 10805 1 17 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.613 3.001 17569 10806 1 17 . 1 1 107 107 ASN H H 261 7.956 7.956 8.737 -0.781 17569 10807 1 17 . 1 1 108 108 GLN N N 262 121.500 121.500 116.132 5.368 17569 10808 1 17 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.007 0.601 17569 10809 1 17 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.713 1.063 17569 10810 1 17 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.637 0.921 17569 10811 1 17 . 1 1 108 108 GLN H H 262 8.493 8.493 7.616 0.877 17569 10812 1 17 . 1 1 109 109 TRP N N 263 128.056 128.056 122.508 5.548 17569 10813 1 17 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.668 0.303 17569 10814 1 17 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.744 0.353 17569 10815 1 17 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.950 0.543 17569 10816 1 17 . 1 1 109 109 TRP H H 263 10.497 10.497 7.831 2.666 17569 10817 1 17 . 1 1 110 110 TYR N N 264 126.600 126.600 125.308 1.292 17569 10818 1 17 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.334 0.068 17569 10819 1 17 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.644 -1.973 17569 10820 1 17 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.429 -1.421 17569 10821 1 17 . 1 1 110 110 TYR H H 264 7.545 7.545 8.140 -0.595 17569 10822 1 17 . 1 1 111 111 CYS N N 265 124.622 124.622 114.475 10.147 17569 10823 1 17 . 1 1 111 111 CYS H H 265 8.586 8.586 8.407 0.179 17569 10824 1 17 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.811 -0.619 17569 10825 1 17 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.880 0.835 17569 10826 1 17 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.668 1.252 17569 10827 1 17 . 1 1 113 113 ILE N N 267 119.504 119.504 119.686 -0.182 17569 10828 1 17 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.697 -0.747 17569 10829 1 17 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.985 0.264 17569 10830 1 17 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.572 -3.039 17569 10831 1 17 . 1 1 113 113 ILE H H 267 9.160 9.160 7.507 1.653 17569 10832 1 17 . 1 1 114 114 CYS N N 268 124.100 124.100 118.352 5.748 17569 10833 1 17 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.172 -0.358 17569 10834 1 17 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.641 3.659 17569 10835 1 17 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.087 2.634 17569 10836 1 17 . 1 1 114 114 CYS H H 268 7.818 7.818 8.248 -0.430 17569 10837 1 17 . 1 1 115 115 HIS N N 269 117.127 117.127 111.297 5.830 17569 10838 1 17 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.665 0.464 17569 10839 1 17 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.038 -0.877 17569 10840 1 17 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.784 2.408 17569 10841 1 17 . 1 1 115 115 HIS H H 269 8.953 8.953 7.806 1.147 17569 10842 1 17 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.448 0.494 17569 10843 1 17 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.482 -0.174 17569 10844 1 17 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.608 1.034 17569 10845 1 17 . 1 1 117 117 GLU N N 271 123.504 123.504 123.133 0.371 17569 10846 1 17 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.402 -0.382 17569 10847 1 17 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.702 4.167 17569 10848 1 17 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.050 -1.999 17569 10849 1 17 . 1 1 117 117 GLU H H 271 8.402 8.402 8.164 0.238 17569 10850 1 17 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.589 -0.047 17569 10851 1 17 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.587 1.772 17569 10852 1 17 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.350 0.792 17569 10853 1 17 . 1 1 119 119 LEU N N 273 112.296 112.296 114.712 -2.416 17569 10854 1 17 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.913 -0.439 17569 10855 1 17 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.610 -0.068 17569 10856 1 17 . 1 1 119 119 LEU H H 273 8.090 8.090 7.457 0.633 17569 10857 1 17 . 1 1 120 120 LEU N N 274 121.388 121.388 124.091 -2.703 17569 10858 1 17 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.929 0.098 17569 10859 1 17 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.809 -0.508 17569 10860 1 17 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.209 0.891 17569 10861 1 17 . 1 1 120 120 LEU H H 274 7.823 7.823 8.482 -0.659 17569 10862 1 17 . 1 1 121 121 ASP N N 275 118.600 118.600 118.234 0.366 17569 10863 1 17 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.336 0.205 17569 10864 1 17 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.946 -0.243 17569 10865 1 17 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.089 -0.646 17569 10866 1 17 . 1 1 121 121 ASP H H 275 8.694 8.694 8.599 0.095 17569 10867 1 17 . 1 1 122 122 LEU N N 276 123.192 123.192 120.545 2.647 17569 10868 1 17 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.972 0.420 17569 10869 1 17 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.981 -0.010 17569 10870 1 17 . 1 1 122 122 LEU CB C 276 42.542 42.542 41.984 0.558 17569 10871 1 17 . 1 1 122 122 LEU H H 276 8.013 8.013 7.307 0.706 17569 10872 1 17 . 1 1 123 123 VAL N N 277 126.898 126.898 118.767 8.131 17569 10873 1 17 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.665 0.190 17569 10874 1 17 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.665 -0.002 17569 10875 1 17 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.963 1.095 17569 10876 1 17 . 1 1 123 123 VAL H H 277 8.781 8.781 7.868 0.913 17569 10877 1 17 . 1 1 124 124 THR N N 278 117.500 117.500 116.351 1.149 17569 10878 1 17 . 1 1 124 124 THR HA H 278 4.030 4.030 3.902 0.128 17569 10879 1 17 . 1 1 124 124 THR CA C 278 66.589 66.589 67.106 -0.517 17569 10880 1 17 . 1 1 124 124 THR CB C 278 68.410 68.410 68.502 -0.092 17569 10881 1 17 . 1 1 124 124 THR H H 278 8.722 8.722 8.539 0.183 17569 10882 1 17 . 1 1 125 125 ALA N N 279 124.700 124.700 123.983 0.717 17569 10883 1 17 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.055 0.206 17569 10884 1 17 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.106 0.190 17569 10885 1 17 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.972 -0.023 17569 10886 1 17 . 1 1 125 125 ALA H H 279 8.239 8.239 7.840 0.399 17569 10887 1 17 . 1 1 126 126 CYS N N 280 119.276 119.276 117.798 1.478 17569 10888 1 17 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.921 0.193 17569 10889 1 17 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.103 -1.000 17569 10890 1 17 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.095 -0.599 17569 10891 1 17 . 1 1 126 126 CYS H H 280 8.128 8.128 7.755 0.373 17569 10892 1 17 . 1 1 127 127 ASN N N 281 118.000 118.000 118.742 -0.742 17569 10893 1 17 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.619 -0.059 17569 10894 1 17 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.306 -0.167 17569 10895 1 17 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.907 -0.942 17569 10896 1 17 . 1 1 127 127 ASN H H 281 8.725 8.725 7.994 0.731 17569 10897 1 17 . 1 1 128 128 SER N N 282 116.601 116.601 117.395 -0.794 17569 10898 1 17 . 1 1 128 128 SER HA H 282 4.363 4.363 4.179 0.184 17569 10899 1 17 . 1 1 128 128 SER CA C 282 61.899 61.899 61.643 0.256 17569 10900 1 17 . 1 1 128 128 SER CB C 282 62.630 62.630 63.177 -0.547 17569 10901 1 17 . 1 1 128 128 SER H H 282 8.542 8.542 7.661 0.881 17569 10902 1 17 . 1 1 129 129 VAL N N 283 123.272 123.272 121.814 1.458 17569 10903 1 17 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.564 0.113 17569 10904 1 17 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.547 -0.039 17569 10905 1 17 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.072 0.146 17569 10906 1 17 . 1 1 129 129 VAL H H 283 7.990 7.990 8.097 -0.107 17569 10907 1 17 . 1 1 130 130 PHE N N 284 118.594 118.594 119.250 -0.656 17569 10908 1 17 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.296 -0.283 17569 10909 1 17 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.356 2.144 17569 10910 1 17 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.262 0.734 17569 10911 1 17 . 1 1 130 130 PHE H H 284 8.190 8.190 8.036 0.154 17569 10912 1 17 . 1 1 131 131 GLU N N 285 120.905 120.905 120.352 0.553 17569 10913 1 17 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.984 0.221 17569 10914 1 17 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.951 -0.737 17569 10915 1 17 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.592 -0.092 17569 10916 1 17 . 1 1 131 131 GLU H H 285 8.699 8.699 8.877 -0.178 17569 10917 1 17 . 1 1 132 132 ASN N N 286 117.997 117.997 118.324 -0.327 17569 10918 1 17 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.664 -0.069 17569 10919 1 17 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.065 -0.450 17569 10920 1 17 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.462 0.390 17569 10921 1 17 . 1 1 132 132 ASN H H 286 8.082 8.082 8.123 -0.041 17569 10922 1 17 . 1 1 133 133 LEU N N 287 120.800 120.800 122.612 -1.812 17569 10923 1 17 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.329 -0.212 17569 10924 1 17 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.618 -0.820 17569 10925 1 17 . 1 1 133 133 LEU H H 287 7.904 7.904 8.565 -0.661 17569 10926 1 17 . 1 1 134 134 GLU N N 288 118.200 118.200 118.707 -0.507 17569 10927 1 17 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.910 0.169 17569 10928 1 17 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.022 -1.025 17569 10929 1 17 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.293 -0.051 17569 10930 1 17 . 1 1 134 134 GLU H H 288 8.157 8.157 8.493 -0.336 17569 10931 1 17 . 1 1 135 135 GLN N N 289 117.400 117.400 119.231 -1.831 17569 10932 1 17 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.084 0.090 17569 10933 1 17 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.812 -0.823 17569 10934 1 17 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.542 -0.462 17569 10935 1 17 . 1 1 135 135 GLN H H 289 7.869 7.869 7.724 0.145 17569 10936 1 17 . 1 1 136 136 LEU N N 290 121.000 121.000 121.394 -0.394 17569 10937 1 17 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.825 0.348 17569 10938 1 17 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.935 -0.797 17569 10939 1 17 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.757 0.243 17569 10940 1 17 . 1 1 136 136 LEU H H 290 7.968 7.968 7.632 0.336 17569 10941 1 17 . 1 1 137 137 LEU N N 291 118.900 118.900 119.465 -0.565 17569 10942 1 17 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.021 0.220 17569 10943 1 17 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.449 -1.089 17569 10944 1 17 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.308 -0.836 17569 10945 1 17 . 1 1 137 137 LEU H H 291 8.154 8.154 7.857 0.297 17569 10946 1 17 . 1 1 138 138 GLN N N 292 117.993 117.993 115.311 2.682 17569 10947 1 17 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.270 0.002 17569 10948 1 17 . 1 1 138 138 GLN CA C 292 56.632 56.632 55.757 0.875 17569 10949 1 17 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.951 -1.367 17569 10950 1 17 . 1 1 138 138 GLN H H 292 7.896 7.896 7.487 0.409 17569 10951 1 17 . 1 1 139 139 GLN N N 293 118.889 118.889 118.788 0.101 17569 10952 1 17 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.023 0.246 17569 10953 1 17 . 1 1 139 139 GLN CA C 293 56.454 56.454 56.561 -0.107 17569 10954 1 17 . 1 1 139 139 GLN CB C 293 29.069 29.069 28.415 0.654 17569 10955 1 17 . 1 1 139 139 GLN H H 293 8.091 8.091 8.155 -0.064 17569 10956 1 17 . 1 1 140 140 ASN N N 294 118.604 118.604 121.867 -3.263 17569 10957 1 17 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.704 0.055 17569 10958 1 17 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.714 -0.493 17569 10959 1 17 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.657 -0.924 17569 10960 1 17 . 1 1 140 140 ASN H H 294 8.273 8.273 8.476 -0.203 17569 10961 1 17 . 1 1 141 141 LYS N N 295 121.685 121.685 121.831 -0.146 17569 10962 1 17 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.435 -0.075 17569 10963 1 17 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.533 -0.360 17569 10964 1 17 . 1 1 141 141 LYS CB C 295 32.535 32.535 32.337 0.197 17569 10965 1 17 . 1 1 141 141 LYS H H 295 8.089 8.089 8.015 0.074 17569 10966 1 18 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.849 -0.462 17569 10967 1 18 . 1 1 2 2 ALA CA C 156 52.445 52.445 51.403 1.042 17569 10968 1 18 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.428 -1.172 17569 10969 1 18 . 1 1 3 3 MET HA H 157 4.476 4.476 4.781 -0.305 17569 10970 1 18 . 1 1 3 3 MET CA C 157 55.401 55.401 55.515 -0.114 17569 10971 1 18 . 1 1 4 4 ALA N N 158 124.828 124.828 127.623 -2.795 17569 10972 1 18 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.794 -0.480 17569 10973 1 18 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.513 0.998 17569 10974 1 18 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.410 -1.409 17569 10975 1 18 . 1 1 4 4 ALA H H 158 8.382 8.382 8.683 -0.301 17569 10976 1 18 . 1 1 5 5 ASP N N 159 119.418 119.418 120.003 -0.585 17569 10977 1 18 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.796 -0.206 17569 10978 1 18 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.777 0.359 17569 10979 1 18 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.845 -0.830 17569 10980 1 18 . 1 1 5 5 ASP H H 159 8.312 8.312 8.425 -0.113 17569 10981 1 18 . 1 1 6 6 LYS N N 160 121.604 121.604 120.276 1.328 17569 10982 1 18 . 1 1 6 6 LYS HA H 160 4.343 4.343 3.975 0.368 17569 10983 1 18 . 1 1 6 6 LYS H H 160 8.274 8.274 8.633 -0.359 17569 10984 1 18 . 1 1 7 7 ARG N N 161 121.611 121.611 118.993 2.618 17569 10985 1 18 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.552 -0.225 17569 10986 1 18 . 1 1 7 7 ARG H H 161 8.430 8.430 8.794 -0.364 17569 10987 1 18 . 1 1 8 8 GLY N N 162 109.606 109.606 109.363 0.243 17569 10988 1 18 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.051 -0.004 17569 10989 1 18 . 1 1 8 8 GLY H H 162 8.473 8.473 8.126 0.347 17569 10990 1 18 . 1 1 9 9 ASP N N 163 120.187 120.187 121.234 -1.047 17569 10991 1 18 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.836 -0.187 17569 10992 1 18 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.686 0.465 17569 10993 1 18 . 1 1 9 9 ASP H H 163 8.296 8.296 7.816 0.480 17569 10994 1 18 . 1 1 10 10 GLY N N 164 108.816 108.816 109.091 -0.275 17569 10995 1 18 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.920 0.447 17569 10996 1 18 . 1 1 10 10 GLY H H 164 8.458 8.458 8.481 -0.023 17569 10997 1 18 . 1 1 11 11 LEU N N 165 121.195 121.195 124.565 -3.370 17569 10998 1 18 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.715 -0.399 17569 10999 1 18 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.897 0.103 17569 11000 1 18 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.768 -0.836 17569 11001 1 18 . 1 1 11 11 LEU H H 165 8.137 8.137 8.078 0.059 17569 11002 1 18 . 1 1 12 12 HIS N N 166 119.387 119.387 122.857 -3.470 17569 11003 1 18 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.784 -0.129 17569 11004 1 18 . 1 1 12 12 HIS CA C 166 56.269 56.269 56.131 0.138 17569 11005 1 18 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.259 -0.562 17569 11006 1 18 . 1 1 12 12 HIS H H 166 8.270 8.270 8.316 -0.046 17569 11007 1 18 . 1 1 13 13 GLY N N 167 109.899 109.899 115.267 -5.368 17569 11008 1 18 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.644 0.461 17569 11009 1 18 . 1 1 13 13 GLY H H 167 8.276 8.276 8.411 -0.135 17569 11010 1 18 . 1 1 14 14 ILE N N 168 119.597 119.597 123.670 -4.073 17569 11011 1 18 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.349 -0.026 17569 11012 1 18 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.557 1.043 17569 11013 1 18 . 1 1 14 14 ILE CB C 168 38.950 38.950 38.214 0.736 17569 11014 1 18 . 1 1 14 14 ILE H H 168 7.962 7.962 8.193 -0.231 17569 11015 1 18 . 1 1 15 15 VAL N N 169 127.578 127.578 128.952 -1.374 17569 11016 1 18 . 1 1 15 15 VAL HA H 169 4.280 4.280 3.957 0.323 17569 11017 1 18 . 1 1 15 15 VAL CA C 169 61.317 61.317 61.920 -0.603 17569 11018 1 18 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.728 2.674 17569 11019 1 18 . 1 1 15 15 VAL H H 169 9.011 9.011 8.304 0.707 17569 11020 1 18 . 1 1 16 16 SER N N 170 118.596 118.596 121.987 -3.391 17569 11021 1 18 . 1 1 16 16 SER HA H 170 5.140 5.140 4.758 0.382 17569 11022 1 18 . 1 1 16 16 SER CA C 170 55.985 55.985 56.182 -0.197 17569 11023 1 18 . 1 1 16 16 SER CB C 170 65.261 65.261 65.673 -0.412 17569 11024 1 18 . 1 1 16 16 SER H H 170 8.242 8.242 7.752 0.490 17569 11025 1 18 . 1 1 17 17 CYS N N 171 123.783 123.783 122.807 0.976 17569 11026 1 18 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.160 0.021 17569 11027 1 18 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.408 -0.564 17569 11028 1 18 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.517 2.857 17569 11029 1 18 . 1 1 17 17 CYS H H 171 8.894 8.894 8.429 0.465 17569 11030 1 18 . 1 1 18 18 THR N N 172 121.703 121.703 117.630 4.073 17569 11031 1 18 . 1 1 18 18 THR HA H 172 4.386 4.386 4.073 0.313 17569 11032 1 18 . 1 1 18 18 THR CA C 172 64.667 64.667 64.179 0.488 17569 11033 1 18 . 1 1 18 18 THR CB C 172 69.498 69.498 68.493 1.005 17569 11034 1 18 . 1 1 18 18 THR H H 172 8.788 8.788 8.243 0.545 17569 11035 1 18 . 1 1 19 19 ALA N N 173 131.364 131.364 121.273 10.091 17569 11036 1 18 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.071 0.425 17569 11037 1 18 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.509 0.516 17569 11038 1 18 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.640 3.542 17569 11039 1 18 . 1 1 19 19 ALA H H 173 9.680 9.680 8.099 1.581 17569 11040 1 18 . 1 1 20 20 CYS N N 174 115.498 115.498 114.754 0.744 17569 11041 1 18 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.447 0.521 17569 11042 1 18 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.945 -1.851 17569 11043 1 18 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.385 3.859 17569 11044 1 18 . 1 1 20 20 CYS H H 174 8.470 8.470 7.733 0.737 17569 11045 1 18 . 1 1 21 21 GLY N N 175 112.464 112.464 108.642 3.822 17569 11046 1 18 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.057 0.649 17569 11047 1 18 . 1 1 21 21 GLY H H 175 7.884 7.884 7.937 -0.053 17569 11048 1 18 . 1 1 22 22 GLN N N 176 121.784 121.784 117.995 3.789 17569 11049 1 18 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.432 -0.056 17569 11050 1 18 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.377 1.914 17569 11051 1 18 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.849 -2.508 17569 11052 1 18 . 1 1 22 22 GLN H H 176 8.723 8.723 7.812 0.911 17569 11053 1 18 . 1 1 23 23 GLN N N 177 122.900 122.900 123.420 -0.520 17569 11054 1 18 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.182 0.348 17569 11055 1 18 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.863 -0.313 17569 11056 1 18 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.378 -0.918 17569 11057 1 18 . 1 1 23 23 GLN H H 177 8.721 8.721 8.571 0.150 17569 11058 1 18 . 1 1 24 24 VAL N N 178 121.000 121.000 125.232 -4.232 17569 11059 1 18 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.060 0.464 17569 11060 1 18 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.088 -2.211 17569 11061 1 18 . 1 1 24 24 VAL H H 178 8.689 8.689 7.873 0.816 17569 11062 1 18 . 1 1 25 25 ASN N N 179 121.392 121.392 123.791 -2.399 17569 11063 1 18 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.239 0.637 17569 11064 1 18 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.284 -2.135 17569 11065 1 18 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.515 -0.538 17569 11066 1 18 . 1 1 25 25 ASN H H 179 8.635 8.635 8.345 0.290 17569 11067 1 18 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.766 -0.306 17569 11068 1 18 . 1 1 27 27 PHE CA C 181 56.998 56.998 57.002 -0.004 17569 11069 1 18 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.843 -1.450 17569 11070 1 18 . 1 1 28 28 GLN N N 182 119.300 119.300 121.947 -2.647 17569 11071 1 18 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.395 0.123 17569 11072 1 18 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.182 -1.840 17569 11073 1 18 . 1 1 28 28 GLN CB C 182 30.350 30.350 29.883 0.467 17569 11074 1 18 . 1 1 28 28 GLN H H 182 7.494 7.494 8.253 -0.759 17569 11075 1 18 . 1 1 29 29 LYS N N 183 124.516 124.516 125.081 -0.565 17569 11076 1 18 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.525 -0.603 17569 11077 1 18 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.545 1.767 17569 11078 1 18 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.633 -0.347 17569 11079 1 18 . 1 1 29 29 LYS H H 183 8.779 8.779 8.542 0.237 17569 11080 1 18 . 1 1 30 30 ASP N N 184 116.500 116.500 119.172 -2.672 17569 11081 1 18 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.898 -0.439 17569 11082 1 18 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.730 -0.194 17569 11083 1 18 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.765 -1.794 17569 11084 1 18 . 1 1 30 30 ASP H H 184 8.556 8.556 8.139 0.417 17569 11085 1 18 . 1 1 31 31 SER N N 185 111.505 111.505 114.396 -2.891 17569 11086 1 18 . 1 1 31 31 SER HA H 185 4.695 4.695 4.740 -0.045 17569 11087 1 18 . 1 1 31 31 SER CA C 185 59.747 59.747 58.587 1.160 17569 11088 1 18 . 1 1 31 31 SER CB C 185 65.198 65.198 63.443 1.755 17569 11089 1 18 . 1 1 31 31 SER H H 185 7.933 7.933 8.387 -0.454 17569 11090 1 18 . 1 1 32 32 ILE N N 186 113.394 113.394 116.711 -3.317 17569 11091 1 18 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.951 -0.065 17569 11092 1 18 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.394 -0.815 17569 11093 1 18 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.502 1.310 17569 11094 1 18 . 1 1 32 32 ILE H H 186 7.105 7.105 7.525 -0.420 17569 11095 1 18 . 1 1 33 33 TYR N N 187 119.098 119.098 121.542 -2.444 17569 11096 1 18 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.224 -0.701 17569 11097 1 18 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.927 1.333 17569 11098 1 18 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.293 2.147 17569 11099 1 18 . 1 1 33 33 TYR H H 187 8.954 8.954 7.669 1.285 17569 11100 1 18 . 1 1 34 34 ARG N N 188 118.502 118.502 123.262 -4.760 17569 11101 1 18 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.786 -0.149 17569 11102 1 18 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.208 -1.456 17569 11103 1 18 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.442 0.809 17569 11104 1 18 . 1 1 34 34 ARG H H 188 8.412 8.412 8.672 -0.260 17569 11105 1 18 . 1 1 35 35 HIS N N 189 126.596 126.596 128.742 -2.146 17569 11106 1 18 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.929 -0.337 17569 11107 1 18 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.171 -0.450 17569 11108 1 18 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.204 1.268 17569 11109 1 18 . 1 1 35 35 HIS H H 189 9.813 9.813 9.176 0.637 17569 11110 1 18 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.548 -0.250 17569 11111 1 18 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.913 0.363 17569 11112 1 18 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.219 0.631 17569 11113 1 18 . 1 1 37 37 SER N N 191 110.003 110.003 113.618 -3.615 17569 11114 1 18 . 1 1 37 37 SER HA H 191 4.918 4.918 4.325 0.593 17569 11115 1 18 . 1 1 37 37 SER CA C 191 59.031 59.031 61.387 -2.356 17569 11116 1 18 . 1 1 37 37 SER CB C 191 65.104 65.104 63.325 1.779 17569 11117 1 18 . 1 1 37 37 SER H H 191 8.934 8.934 8.624 0.310 17569 11118 1 18 . 1 1 38 38 LEU N N 192 120.959 120.959 114.078 6.881 17569 11119 1 18 . 1 1 38 38 LEU HA H 192 4.129 4.129 5.042 -0.913 17569 11120 1 18 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.101 2.045 17569 11121 1 18 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.477 1.519 17569 11122 1 18 . 1 1 38 38 LEU H H 192 8.649 8.649 7.006 1.643 17569 11123 1 18 . 1 1 39 39 GLN N N 193 108.600 108.600 119.316 -10.716 17569 11124 1 18 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.079 -0.174 17569 11125 1 18 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.658 0.156 17569 11126 1 18 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.856 -1.822 17569 11127 1 18 . 1 1 39 39 GLN H H 193 8.465 8.465 7.816 0.649 17569 11128 1 18 . 1 1 40 40 VAL N N 194 105.325 105.325 117.527 -12.202 17569 11129 1 18 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.534 0.016 17569 11130 1 18 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.610 -0.969 17569 11131 1 18 . 1 1 40 40 VAL H H 194 6.256 6.256 7.807 -1.551 17569 11132 1 18 . 1 1 41 41 LEU N N 195 123.100 123.100 122.120 0.980 17569 11133 1 18 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.805 0.011 17569 11134 1 18 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.556 3.626 17569 11135 1 18 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.751 0.819 17569 11136 1 18 . 1 1 41 41 LEU H H 195 9.154 9.154 8.536 0.618 17569 11137 1 18 . 1 1 42 42 ILE N N 196 124.396 124.396 117.381 7.015 17569 11138 1 18 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.826 1.526 17569 11139 1 18 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.265 0.965 17569 11140 1 18 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.887 1.383 17569 11141 1 18 . 1 1 42 42 ILE H H 196 9.766 9.766 7.860 1.906 17569 11142 1 18 . 1 1 43 43 CYS N N 197 121.500 121.500 114.820 6.680 17569 11143 1 18 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.188 0.074 17569 11144 1 18 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.009 0.694 17569 11145 1 18 . 1 1 43 43 CYS CB C 197 33.300 33.300 30.935 2.365 17569 11146 1 18 . 1 1 43 43 CYS H H 197 9.882 9.882 8.315 1.567 17569 11147 1 18 . 1 1 44 44 LYS N N 198 117.995 117.995 122.105 -4.110 17569 11148 1 18 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.169 -0.180 17569 11149 1 18 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.281 -0.621 17569 11150 1 18 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.436 0.264 17569 11151 1 18 . 1 1 44 44 LYS H H 198 8.089 8.089 8.927 -0.838 17569 11152 1 18 . 1 1 45 45 ASN N N 199 119.200 119.200 117.183 2.017 17569 11153 1 18 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.579 -0.065 17569 11154 1 18 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.095 0.625 17569 11155 1 18 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.074 0.093 17569 11156 1 18 . 1 1 45 45 ASN H H 199 8.356 8.356 8.609 -0.253 17569 11157 1 18 . 1 1 46 46 CYS N N 200 126.600 126.600 118.410 8.190 17569 11158 1 18 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.037 0.144 17569 11159 1 18 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.040 2.455 17569 11160 1 18 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.244 1.938 17569 11161 1 18 . 1 1 46 46 CYS H H 200 9.189 9.189 7.751 1.438 17569 11162 1 18 . 1 1 47 47 PHE N N 201 121.962 121.962 120.809 1.153 17569 11163 1 18 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.115 -0.245 17569 11164 1 18 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.364 1.905 17569 11165 1 18 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.553 0.614 17569 11166 1 18 . 1 1 47 47 PHE H H 201 8.826 8.826 7.823 1.003 17569 11167 1 18 . 1 1 48 48 LYS N N 202 117.400 117.400 120.417 -3.017 17569 11168 1 18 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.905 -0.207 17569 11169 1 18 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.215 -1.263 17569 11170 1 18 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.249 -0.707 17569 11171 1 18 . 1 1 48 48 LYS H H 202 8.512 8.512 8.050 0.462 17569 11172 1 18 . 1 1 49 49 TYR N N 203 120.400 120.400 120.264 0.136 17569 11173 1 18 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.210 0.204 17569 11174 1 18 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.792 -1.020 17569 11175 1 18 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.633 -0.187 17569 11176 1 18 . 1 1 49 49 TYR H H 203 8.133 8.133 7.660 0.473 17569 11177 1 18 . 1 1 50 50 TYR N N 204 121.783 121.783 118.002 3.781 17569 11178 1 18 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.674 -1.179 17569 11179 1 18 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.702 3.248 17569 11180 1 18 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.453 1.039 17569 11181 1 18 . 1 1 50 50 TYR H H 204 8.765 8.765 7.433 1.332 17569 11182 1 18 . 1 1 51 51 MET N N 205 110.800 110.800 115.389 -4.589 17569 11183 1 18 . 1 1 51 51 MET HA H 205 4.349 4.349 4.206 0.143 17569 11184 1 18 . 1 1 51 51 MET CA C 205 53.505 53.505 56.886 -3.381 17569 11185 1 18 . 1 1 51 51 MET CB C 205 30.384 30.384 33.003 -2.619 17569 11186 1 18 . 1 1 51 51 MET H H 205 7.771 7.771 8.459 -0.688 17569 11187 1 18 . 1 1 52 52 SER N N 206 116.800 116.800 112.972 3.828 17569 11188 1 18 . 1 1 52 52 SER HA H 206 3.919 3.919 4.405 -0.486 17569 11189 1 18 . 1 1 52 52 SER CA C 206 61.621 61.621 60.211 1.410 17569 11190 1 18 . 1 1 52 52 SER CB C 206 62.611 62.611 64.423 -1.812 17569 11191 1 18 . 1 1 52 52 SER H H 206 7.581 7.581 8.227 -0.646 17569 11192 1 18 . 1 1 53 53 ASP N N 207 117.400 117.400 122.015 -4.615 17569 11193 1 18 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.809 -0.237 17569 11194 1 18 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.572 -0.473 17569 11195 1 18 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.450 -0.262 17569 11196 1 18 . 1 1 53 53 ASP H H 207 7.085 7.085 8.004 -0.919 17569 11197 1 18 . 1 1 54 54 ASP N N 208 119.405 119.405 123.066 -3.661 17569 11198 1 18 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.952 -0.563 17569 11199 1 18 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.461 0.439 17569 11200 1 18 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.669 -1.320 17569 11201 1 18 . 1 1 54 54 ASP H H 208 8.439 8.439 8.377 0.062 17569 11202 1 18 . 1 1 55 55 ILE N N 209 124.698 124.698 121.301 3.397 17569 11203 1 18 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.415 -0.415 17569 11204 1 18 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.479 1.799 17569 11205 1 18 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.644 0.647 17569 11206 1 18 . 1 1 55 55 ILE H H 209 8.128 8.128 8.321 -0.193 17569 11207 1 18 . 1 1 56 56 SER N N 210 126.703 126.703 120.658 6.045 17569 11208 1 18 . 1 1 56 56 SER HA H 210 4.365 4.365 4.665 -0.300 17569 11209 1 18 . 1 1 56 56 SER CA C 210 57.769 57.769 57.129 0.640 17569 11210 1 18 . 1 1 56 56 SER CB C 210 64.991 64.991 65.275 -0.284 17569 11211 1 18 . 1 1 56 56 SER H H 210 8.815 8.815 8.253 0.562 17569 11212 1 18 . 1 1 57 57 ARG N N 211 116.885 116.885 119.912 -3.027 17569 11213 1 18 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.689 0.353 17569 11214 1 18 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.984 -1.584 17569 11215 1 18 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.430 2.854 17569 11216 1 18 . 1 1 57 57 ARG H H 211 8.365 8.365 8.546 -0.181 17569 11217 1 18 . 1 1 58 58 ASP N N 212 121.982 121.982 124.413 -2.431 17569 11218 1 18 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.852 -0.237 17569 11219 1 18 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.565 -1.343 17569 11220 1 18 . 1 1 58 58 ASP CB C 212 41.502 41.502 44.755 -3.253 17569 11221 1 18 . 1 1 58 58 ASP H H 212 8.706 8.706 8.591 0.115 17569 11222 1 18 . 1 1 59 59 SER N N 213 114.164 114.164 114.280 -0.116 17569 11223 1 18 . 1 1 59 59 SER HA H 213 4.212 4.212 4.066 0.146 17569 11224 1 18 . 1 1 59 59 SER CA C 213 60.840 60.840 60.781 0.060 17569 11225 1 18 . 1 1 59 59 SER CB C 213 62.714 62.714 62.941 -0.228 17569 11226 1 18 . 1 1 59 59 SER H H 213 8.687 8.687 8.518 0.169 17569 11227 1 18 . 1 1 60 60 ASP N N 214 120.899 120.899 122.242 -1.343 17569 11228 1 18 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.854 -0.029 17569 11229 1 18 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.922 0.288 17569 11230 1 18 . 1 1 60 60 ASP CB C 214 41.558 41.558 41.065 0.493 17569 11231 1 18 . 1 1 60 60 ASP H H 214 8.193 8.193 8.115 0.078 17569 11232 1 18 . 1 1 61 61 GLY N N 215 108.300 108.300 106.767 1.533 17569 11233 1 18 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.499 -0.102 17569 11234 1 18 . 1 1 61 61 GLY H H 215 8.234 8.234 8.424 -0.190 17569 11235 1 18 . 1 1 62 62 MET N N 216 120.002 120.002 113.664 6.338 17569 11236 1 18 . 1 1 62 62 MET HA H 216 4.972 4.972 4.805 0.167 17569 11237 1 18 . 1 1 62 62 MET CA C 216 53.151 53.151 53.679 -0.528 17569 11238 1 18 . 1 1 62 62 MET CB C 216 32.311 32.311 35.542 -3.231 17569 11239 1 18 . 1 1 62 62 MET H H 216 8.376 8.376 7.601 0.775 17569 11240 1 18 . 1 1 63 63 ASP N N 217 127.300 127.300 121.597 5.703 17569 11241 1 18 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.792 0.174 17569 11242 1 18 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.797 -0.228 17569 11243 1 18 . 1 1 63 63 ASP H H 217 9.368 9.368 8.468 0.900 17569 11244 1 18 . 1 1 64 64 GLU N N 218 114.400 114.400 124.100 -9.700 17569 11245 1 18 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.492 -0.336 17569 11246 1 18 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.200 0.650 17569 11247 1 18 . 1 1 64 64 GLU H H 218 8.583 8.583 8.514 0.069 17569 11248 1 18 . 1 1 65 65 GLN N N 219 115.500 115.500 118.144 -2.644 17569 11249 1 18 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.629 -0.318 17569 11250 1 18 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.000 0.346 17569 11251 1 18 . 1 1 65 65 GLN H H 219 7.158 7.158 7.817 -0.659 17569 11252 1 18 . 1 1 66 66 CYS N N 220 122.600 122.600 117.864 4.736 17569 11253 1 18 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.445 -1.368 17569 11254 1 18 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.346 1.183 17569 11255 1 18 . 1 1 66 66 CYS CB C 220 31.972 31.972 29.791 2.181 17569 11256 1 18 . 1 1 66 66 CYS H H 220 8.248 8.248 8.656 -0.408 17569 11257 1 18 . 1 1 67 67 ARG N N 221 130.363 130.363 124.155 6.208 17569 11258 1 18 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.484 -0.417 17569 11259 1 18 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.136 -3.120 17569 11260 1 18 . 1 1 67 67 ARG H H 221 9.145 9.145 8.732 0.413 17569 11261 1 18 . 1 1 68 68 TRP N N 222 124.200 124.200 120.841 3.359 17569 11262 1 18 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.606 -0.170 17569 11263 1 18 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.434 0.647 17569 11264 1 18 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.368 0.826 17569 11265 1 18 . 1 1 68 68 TRP H H 222 9.689 9.689 8.333 1.356 17569 11266 1 18 . 1 1 69 69 CYS N N 223 116.297 116.297 110.463 5.834 17569 11267 1 18 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.087 0.004 17569 11268 1 18 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.881 3.221 17569 11269 1 18 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.480 4.857 17569 11270 1 18 . 1 1 69 69 CYS H H 223 8.822 8.822 7.698 1.124 17569 11271 1 18 . 1 1 70 70 ALA N N 224 123.112 123.112 124.176 -1.064 17569 11272 1 18 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.329 0.077 17569 11273 1 18 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.165 -0.314 17569 11274 1 18 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.802 -0.082 17569 11275 1 18 . 1 1 70 70 ALA H H 224 8.787 8.787 8.308 0.479 17569 11276 1 18 . 1 1 71 71 GLU N N 225 118.300 118.300 120.676 -2.376 17569 11277 1 18 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.483 0.825 17569 11278 1 18 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.929 -2.630 17569 11279 1 18 . 1 1 71 71 GLU H H 225 8.541 8.541 8.129 0.412 17569 11280 1 18 . 1 1 72 72 GLY N N 226 111.995 111.995 110.297 1.698 17569 11281 1 18 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.665 -0.262 17569 11282 1 18 . 1 1 72 72 GLY H H 226 9.837 9.837 8.516 1.321 17569 11283 1 18 . 1 1 73 73 GLY N N 227 106.600 106.600 107.048 -0.448 17569 11284 1 18 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.963 1.008 17569 11285 1 18 . 1 1 73 73 GLY H H 227 7.772 7.772 8.464 -0.692 17569 11286 1 18 . 1 1 74 74 ASN N N 228 124.277 124.277 119.352 4.925 17569 11287 1 18 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.429 0.652 17569 11288 1 18 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.657 -0.557 17569 11289 1 18 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.536 -0.452 17569 11290 1 18 . 1 1 74 74 ASN H H 228 8.876 8.876 8.477 0.399 17569 11291 1 18 . 1 1 75 75 LEU N N 229 123.050 123.050 122.819 0.231 17569 11292 1 18 . 1 1 75 75 LEU HA H 229 4.600 4.600 5.199 -0.599 17569 11293 1 18 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.512 0.850 17569 11294 1 18 . 1 1 75 75 LEU CB C 229 43.500 43.500 45.255 -1.755 17569 11295 1 18 . 1 1 75 75 LEU H H 229 8.901 8.901 8.008 0.893 17569 11296 1 18 . 1 1 76 76 ILE N N 230 123.552 123.552 121.394 2.158 17569 11297 1 18 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.287 0.198 17569 11298 1 18 . 1 1 76 76 ILE CA C 230 60.700 60.700 59.989 0.711 17569 11299 1 18 . 1 1 76 76 ILE CB C 230 37.399 37.399 39.835 -2.436 17569 11300 1 18 . 1 1 76 76 ILE H H 230 9.406 9.406 9.150 0.256 17569 11301 1 18 . 1 1 77 77 CYS N N 231 124.637 124.637 126.821 -2.184 17569 11302 1 18 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.395 -0.520 17569 11303 1 18 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.742 0.617 17569 11304 1 18 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.635 0.799 17569 11305 1 18 . 1 1 77 77 CYS H H 231 8.809 8.809 8.560 0.249 17569 11306 1 18 . 1 1 78 78 CYS N N 232 125.697 125.697 124.506 1.191 17569 11307 1 18 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.879 -0.595 17569 11308 1 18 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.392 4.492 17569 11309 1 18 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.794 1.376 17569 11310 1 18 . 1 1 78 78 CYS H H 232 8.579 8.579 8.704 -0.125 17569 11311 1 18 . 1 1 79 79 ASP N N 233 123.600 123.600 124.953 -1.353 17569 11312 1 18 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.704 0.053 17569 11313 1 18 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.257 2.732 17569 11314 1 18 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.585 1.044 17569 11315 1 18 . 1 1 79 79 ASP H H 233 8.577 8.577 8.584 -0.007 17569 11316 1 18 . 1 1 80 80 PHE N N 234 122.100 122.100 117.053 5.047 17569 11317 1 18 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.659 -0.133 17569 11318 1 18 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.321 1.588 17569 11319 1 18 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.307 1.542 17569 11320 1 18 . 1 1 80 80 PHE H H 234 10.432 10.432 7.452 2.980 17569 11321 1 18 . 1 1 81 81 CYS N N 235 124.300 124.300 117.803 6.497 17569 11322 1 18 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.765 0.391 17569 11323 1 18 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.261 -0.216 17569 11324 1 18 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.637 3.770 17569 11325 1 18 . 1 1 81 81 CYS H H 235 8.476 8.476 8.111 0.365 17569 11326 1 18 . 1 1 82 82 HIS N N 236 112.598 112.598 120.021 -7.423 17569 11327 1 18 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.166 0.817 17569 11328 1 18 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.781 -1.383 17569 11329 1 18 . 1 1 82 82 HIS CB C 236 30.257 30.257 28.267 1.990 17569 11330 1 18 . 1 1 82 82 HIS H H 236 6.699 6.699 8.170 -1.471 17569 11331 1 18 . 1 1 83 83 ASN N N 237 123.600 123.600 120.033 3.567 17569 11332 1 18 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.747 0.054 17569 11333 1 18 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.441 3.175 17569 11334 1 18 . 1 1 83 83 ASN H H 237 9.097 9.097 8.024 1.073 17569 11335 1 18 . 1 1 84 84 ALA N N 238 122.000 122.000 124.034 -2.034 17569 11336 1 18 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.293 0.116 17569 11337 1 18 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.727 -0.363 17569 11338 1 18 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.836 3.234 17569 11339 1 18 . 1 1 84 84 ALA H H 238 9.885 9.885 8.337 1.548 17569 11340 1 18 . 1 1 85 85 PHE N N 239 116.707 116.707 121.287 -4.580 17569 11341 1 18 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.077 0.951 17569 11342 1 18 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.734 -0.517 17569 11343 1 18 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.966 0.698 17569 11344 1 18 . 1 1 85 85 PHE H H 239 9.450 9.450 8.979 0.471 17569 11345 1 18 . 1 1 86 86 CYS N N 240 126.682 126.682 116.972 9.710 17569 11346 1 18 . 1 1 86 86 CYS HA H 240 5.622 5.622 5.294 0.328 17569 11347 1 18 . 1 1 86 86 CYS CA C 240 57.342 57.342 55.639 1.703 17569 11348 1 18 . 1 1 86 86 CYS CB C 240 32.257 32.257 31.314 0.942 17569 11349 1 18 . 1 1 86 86 CYS H H 240 11.309 11.309 8.949 2.360 17569 11350 1 18 . 1 1 87 87 LYS N N 241 117.865 117.865 123.857 -5.992 17569 11351 1 18 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.863 -0.014 17569 11352 1 18 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.784 -0.714 17569 11353 1 18 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.478 0.320 17569 11354 1 18 . 1 1 87 87 LYS H H 241 8.230 8.230 8.329 -0.099 17569 11355 1 18 . 1 1 88 88 LYS N N 242 117.949 117.949 118.368 -0.419 17569 11356 1 18 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.100 -0.122 17569 11357 1 18 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.036 1.334 17569 11358 1 18 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.032 0.284 17569 11359 1 18 . 1 1 88 88 LYS H H 242 7.945 7.945 8.415 -0.470 17569 11360 1 18 . 1 1 89 89 CYS N N 243 125.305 125.305 117.603 7.702 17569 11361 1 18 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.231 -0.489 17569 11362 1 18 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.205 2.622 17569 11363 1 18 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.174 1.067 17569 11364 1 18 . 1 1 89 89 CYS H H 243 9.297 9.297 7.994 1.303 17569 11365 1 18 . 1 1 90 90 ILE N N 244 119.687 119.687 121.532 -1.845 17569 11366 1 18 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.070 -0.463 17569 11367 1 18 . 1 1 90 90 ILE CA C 244 65.950 65.950 64.125 1.825 17569 11368 1 18 . 1 1 90 90 ILE H H 244 7.997 7.997 8.262 -0.265 17569 11369 1 18 . 1 1 91 91 LEU N N 245 120.280 120.280 121.483 -1.203 17569 11370 1 18 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.361 -0.676 17569 11371 1 18 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.610 0.625 17569 11372 1 18 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.892 0.066 17569 11373 1 18 . 1 1 91 91 LEU H H 245 8.810 8.810 8.793 0.017 17569 11374 1 18 . 1 1 92 92 ARG N N 246 116.901 116.901 116.640 0.261 17569 11375 1 18 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.085 -0.268 17569 11376 1 18 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.375 0.605 17569 11377 1 18 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.181 0.419 17569 11378 1 18 . 1 1 92 92 ARG H H 246 8.086 8.086 7.601 0.485 17569 11379 1 18 . 1 1 93 93 ASN N N 247 111.200 111.200 116.198 -4.998 17569 11380 1 18 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.482 0.121 17569 11381 1 18 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.733 1.075 17569 11382 1 18 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.966 3.518 17569 11383 1 18 . 1 1 93 93 ASN H H 247 7.136 7.136 8.112 -0.976 17569 11384 1 18 . 1 1 94 94 LEU N N 248 118.807 118.807 117.425 1.382 17569 11385 1 18 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.681 0.133 17569 11386 1 18 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.025 0.164 17569 11387 1 18 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.680 0.018 17569 11388 1 18 . 1 1 94 94 LEU H H 248 8.515 8.515 7.928 0.587 17569 11389 1 18 . 1 1 95 95 GLY N N 249 108.000 108.000 105.871 2.129 17569 11390 1 18 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.678 -0.051 17569 11391 1 18 . 1 1 95 95 GLY H H 249 7.955 7.955 7.813 0.142 17569 11392 1 18 . 1 1 96 96 ARG N N 250 117.797 117.797 121.709 -3.912 17569 11393 1 18 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.262 -0.419 17569 11394 1 18 . 1 1 96 96 ARG CA C 250 58.682 58.682 57.863 0.819 17569 11395 1 18 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.171 -0.311 17569 11396 1 18 . 1 1 96 96 ARG H H 250 8.559 8.559 8.644 -0.085 17569 11397 1 18 . 1 1 97 97 LYS N N 251 120.900 120.900 119.510 1.390 17569 11398 1 18 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.038 0.118 17569 11399 1 18 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.755 -0.599 17569 11400 1 18 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.767 -0.407 17569 11401 1 18 . 1 1 97 97 LYS H H 251 8.655 8.655 8.591 0.064 17569 11402 1 18 . 1 1 98 98 GLU N N 252 122.000 122.000 119.125 2.875 17569 11403 1 18 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.103 0.248 17569 11404 1 18 . 1 1 98 98 GLU CA C 252 58.582 58.582 58.947 -0.365 17569 11405 1 18 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.399 -0.999 17569 11406 1 18 . 1 1 98 98 GLU H H 252 7.705 7.705 8.273 -0.568 17569 11407 1 18 . 1 1 99 99 LEU N N 253 117.400 117.400 120.597 -3.197 17569 11408 1 18 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.823 0.094 17569 11409 1 18 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.044 -0.046 17569 11410 1 18 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.874 -0.392 17569 11411 1 18 . 1 1 99 99 LEU H H 253 7.285 7.285 7.695 -0.410 17569 11412 1 18 . 1 1 100 100 SER N N 254 112.100 112.100 113.697 -1.597 17569 11413 1 18 . 1 1 100 100 SER HA H 254 4.107 4.107 4.131 -0.024 17569 11414 1 18 . 1 1 100 100 SER CA C 254 61.603 61.603 61.866 -0.263 17569 11415 1 18 . 1 1 100 100 SER CB C 254 62.622 62.622 63.103 -0.481 17569 11416 1 18 . 1 1 100 100 SER H H 254 8.326 8.326 7.784 0.542 17569 11417 1 18 . 1 1 101 101 THR N N 255 118.151 118.151 118.558 -0.407 17569 11418 1 18 . 1 1 101 101 THR HA H 255 4.026 4.026 4.043 -0.017 17569 11419 1 18 . 1 1 101 101 THR CA C 255 66.261 66.261 66.722 -0.461 17569 11420 1 18 . 1 1 101 101 THR CB C 255 68.735 68.735 68.715 0.020 17569 11421 1 18 . 1 1 101 101 THR H H 255 7.972 7.972 7.644 0.328 17569 11422 1 18 . 1 1 102 102 ILE N N 256 120.100 120.100 122.412 -2.312 17569 11423 1 18 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.576 -0.113 17569 11424 1 18 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.855 -0.081 17569 11425 1 18 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.378 0.363 17569 11426 1 18 . 1 1 102 102 ILE H H 256 7.868 7.868 8.408 -0.540 17569 11427 1 18 . 1 1 103 103 MET N N 257 114.876 114.876 116.452 -1.576 17569 11428 1 18 . 1 1 103 103 MET HA H 257 4.211 4.211 4.073 0.138 17569 11429 1 18 . 1 1 103 103 MET CA C 257 55.691 55.691 58.501 -2.810 17569 11430 1 18 . 1 1 103 103 MET CB C 257 32.000 32.000 32.717 -0.717 17569 11431 1 18 . 1 1 103 103 MET H H 257 7.606 7.606 7.236 0.370 17569 11432 1 18 . 1 1 104 104 ASP N N 258 119.976 119.976 118.858 1.118 17569 11433 1 18 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.799 -0.261 17569 11434 1 18 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.943 0.969 17569 11435 1 18 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.258 1.242 17569 11436 1 18 . 1 1 104 104 ASP H H 258 7.444 7.444 7.653 -0.209 17569 11437 1 18 . 1 1 105 105 GLU N N 259 124.388 124.388 120.559 3.829 17569 11438 1 18 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.584 -0.297 17569 11439 1 18 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.299 2.272 17569 11440 1 18 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.209 -0.667 17569 11441 1 18 . 1 1 105 105 GLU H H 259 8.559 8.559 8.153 0.406 17569 11442 1 18 . 1 1 106 106 ASN N N 260 117.201 117.201 116.826 0.375 17569 11443 1 18 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.408 0.334 17569 11444 1 18 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.050 -0.307 17569 11445 1 18 . 1 1 106 106 ASN CB C 260 38.918 38.918 36.857 2.061 17569 11446 1 18 . 1 1 106 106 ASN H H 260 8.673 8.673 8.501 0.172 17569 11447 1 18 . 1 1 107 107 ASN N N 261 117.900 117.900 113.433 4.467 17569 11448 1 18 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.285 0.700 17569 11449 1 18 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.675 -2.373 17569 11450 1 18 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.672 2.942 17569 11451 1 18 . 1 1 107 107 ASN H H 261 7.956 7.956 8.719 -0.763 17569 11452 1 18 . 1 1 108 108 GLN N N 262 121.500 121.500 115.678 5.822 17569 11453 1 18 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.073 0.535 17569 11454 1 18 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.736 1.040 17569 11455 1 18 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.853 0.705 17569 11456 1 18 . 1 1 108 108 GLN H H 262 8.493 8.493 7.730 0.763 17569 11457 1 18 . 1 1 109 109 TRP N N 263 128.056 128.056 123.683 4.373 17569 11458 1 18 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.644 0.327 17569 11459 1 18 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.650 0.447 17569 11460 1 18 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.477 1.016 17569 11461 1 18 . 1 1 109 109 TRP H H 263 10.497 10.497 8.380 2.117 17569 11462 1 18 . 1 1 110 110 TYR N N 264 126.600 126.600 125.993 0.607 17569 11463 1 18 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.289 0.113 17569 11464 1 18 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.785 -3.114 17569 11465 1 18 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.703 -0.695 17569 11466 1 18 . 1 1 110 110 TYR H H 264 7.545 7.545 7.999 -0.454 17569 11467 1 18 . 1 1 111 111 CYS N N 265 124.622 124.622 114.214 10.408 17569 11468 1 18 . 1 1 111 111 CYS H H 265 8.586 8.586 8.085 0.501 17569 11469 1 18 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.853 -0.661 17569 11470 1 18 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.788 0.927 17569 11471 1 18 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.736 1.184 17569 11472 1 18 . 1 1 113 113 ILE N N 267 119.504 119.504 119.818 -0.314 17569 11473 1 18 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.717 -0.767 17569 11474 1 18 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.939 0.310 17569 11475 1 18 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.538 -3.005 17569 11476 1 18 . 1 1 113 113 ILE H H 267 9.160 9.160 7.518 1.642 17569 11477 1 18 . 1 1 114 114 CYS N N 268 124.100 124.100 118.409 5.691 17569 11478 1 18 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.190 -0.376 17569 11479 1 18 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.709 3.591 17569 11480 1 18 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.121 2.600 17569 11481 1 18 . 1 1 114 114 CYS H H 268 7.818 7.818 8.258 -0.440 17569 11482 1 18 . 1 1 115 115 HIS N N 269 117.127 117.127 111.342 5.785 17569 11483 1 18 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.669 0.460 17569 11484 1 18 . 1 1 115 115 HIS CA C 269 52.161 52.161 52.990 -0.829 17569 11485 1 18 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.906 2.286 17569 11486 1 18 . 1 1 115 115 HIS H H 269 8.953 8.953 7.800 1.153 17569 11487 1 18 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.532 0.410 17569 11488 1 18 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.502 -0.194 17569 11489 1 18 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.923 0.719 17569 11490 1 18 . 1 1 117 117 GLU N N 271 123.504 123.504 122.798 0.706 17569 11491 1 18 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.394 -0.374 17569 11492 1 18 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.734 4.135 17569 11493 1 18 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.852 -1.801 17569 11494 1 18 . 1 1 117 117 GLU H H 271 8.402 8.402 8.298 0.104 17569 11495 1 18 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.544 -0.002 17569 11496 1 18 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.565 1.794 17569 11497 1 18 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.270 0.872 17569 11498 1 18 . 1 1 119 119 LEU N N 273 112.296 112.296 113.947 -1.651 17569 11499 1 18 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.924 -0.450 17569 11500 1 18 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.590 -0.048 17569 11501 1 18 . 1 1 119 119 LEU H H 273 8.090 8.090 7.403 0.687 17569 11502 1 18 . 1 1 120 120 LEU N N 274 121.388 121.388 123.295 -1.907 17569 11503 1 18 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.909 0.118 17569 11504 1 18 . 1 1 120 120 LEU CA C 274 59.301 59.301 58.849 0.452 17569 11505 1 18 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.462 0.638 17569 11506 1 18 . 1 1 120 120 LEU H H 274 7.823 7.823 7.972 -0.149 17569 11507 1 18 . 1 1 121 121 ASP N N 275 118.600 118.600 118.937 -0.337 17569 11508 1 18 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.338 0.203 17569 11509 1 18 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.381 0.322 17569 11510 1 18 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.504 -1.061 17569 11511 1 18 . 1 1 121 121 ASP H H 275 8.694 8.694 8.318 0.376 17569 11512 1 18 . 1 1 122 122 LEU N N 276 123.192 123.192 120.202 2.990 17569 11513 1 18 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.978 0.414 17569 11514 1 18 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.169 -0.198 17569 11515 1 18 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.114 0.428 17569 11516 1 18 . 1 1 122 122 LEU H H 276 8.013 8.013 7.344 0.669 17569 11517 1 18 . 1 1 123 123 VAL N N 277 126.898 126.898 118.873 8.025 17569 11518 1 18 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.696 0.159 17569 11519 1 18 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.666 -0.003 17569 11520 1 18 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.930 1.128 17569 11521 1 18 . 1 1 123 123 VAL H H 277 8.781 8.781 8.101 0.680 17569 11522 1 18 . 1 1 124 124 THR N N 278 117.500 117.500 116.585 0.915 17569 11523 1 18 . 1 1 124 124 THR HA H 278 4.030 4.030 3.932 0.098 17569 11524 1 18 . 1 1 124 124 THR CA C 278 66.589 66.589 67.155 -0.566 17569 11525 1 18 . 1 1 124 124 THR CB C 278 68.410 68.410 68.596 -0.186 17569 11526 1 18 . 1 1 124 124 THR H H 278 8.722 8.722 8.668 0.054 17569 11527 1 18 . 1 1 125 125 ALA N N 279 124.700 124.700 124.158 0.542 17569 11528 1 18 . 1 1 125 125 ALA HA H 279 4.261 4.261 3.999 0.262 17569 11529 1 18 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.158 0.138 17569 11530 1 18 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.109 -0.160 17569 11531 1 18 . 1 1 125 125 ALA H H 279 8.239 8.239 8.182 0.057 17569 11532 1 18 . 1 1 126 126 CYS N N 280 119.276 119.276 117.575 1.701 17569 11533 1 18 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.890 0.224 17569 11534 1 18 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.768 -1.665 17569 11535 1 18 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.924 -1.428 17569 11536 1 18 . 1 1 126 126 CYS H H 280 8.128 8.128 7.837 0.291 17569 11537 1 18 . 1 1 127 127 ASN N N 281 118.000 118.000 118.093 -0.093 17569 11538 1 18 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.573 -0.013 17569 11539 1 18 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.549 -0.410 17569 11540 1 18 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.979 -1.014 17569 11541 1 18 . 1 1 127 127 ASN H H 281 8.725 8.725 7.983 0.742 17569 11542 1 18 . 1 1 128 128 SER N N 282 116.601 116.601 116.602 -0.001 17569 11543 1 18 . 1 1 128 128 SER HA H 282 4.363 4.363 4.165 0.198 17569 11544 1 18 . 1 1 128 128 SER CA C 282 61.899 61.899 61.450 0.449 17569 11545 1 18 . 1 1 128 128 SER CB C 282 62.630 62.630 62.855 -0.225 17569 11546 1 18 . 1 1 128 128 SER H H 282 8.542 8.542 7.635 0.907 17569 11547 1 18 . 1 1 129 129 VAL N N 283 123.272 123.272 121.931 1.341 17569 11548 1 18 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.552 0.125 17569 11549 1 18 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.624 -0.116 17569 11550 1 18 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.576 -0.358 17569 11551 1 18 . 1 1 129 129 VAL H H 283 7.990 7.990 8.098 -0.108 17569 11552 1 18 . 1 1 130 130 PHE N N 284 118.594 118.594 119.124 -0.530 17569 11553 1 18 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.284 -0.271 17569 11554 1 18 . 1 1 130 130 PHE CA C 284 63.500 63.500 60.995 2.505 17569 11555 1 18 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.452 0.544 17569 11556 1 18 . 1 1 130 130 PHE H H 284 8.190 8.190 8.239 -0.049 17569 11557 1 18 . 1 1 131 131 GLU N N 285 120.905 120.905 120.282 0.623 17569 11558 1 18 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.974 0.231 17569 11559 1 18 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.054 -0.840 17569 11560 1 18 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.440 0.060 17569 11561 1 18 . 1 1 131 131 GLU H H 285 8.699 8.699 8.789 -0.090 17569 11562 1 18 . 1 1 132 132 ASN N N 286 117.997 117.997 118.032 -0.035 17569 11563 1 18 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.662 -0.067 17569 11564 1 18 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.196 -0.581 17569 11565 1 18 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.667 0.185 17569 11566 1 18 . 1 1 132 132 ASN H H 286 8.082 8.082 7.796 0.286 17569 11567 1 18 . 1 1 133 133 LEU N N 287 120.800 120.800 122.250 -1.450 17569 11568 1 18 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.321 -0.204 17569 11569 1 18 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.343 -0.545 17569 11570 1 18 . 1 1 133 133 LEU H H 287 7.904 7.904 8.522 -0.618 17569 11571 1 18 . 1 1 134 134 GLU N N 288 118.200 118.200 118.099 0.101 17569 11572 1 18 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.937 0.142 17569 11573 1 18 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.052 -1.055 17569 11574 1 18 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.265 -0.023 17569 11575 1 18 . 1 1 134 134 GLU H H 288 8.157 8.157 8.755 -0.598 17569 11576 1 18 . 1 1 135 135 GLN N N 289 117.400 117.400 119.294 -1.894 17569 11577 1 18 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.133 0.041 17569 11578 1 18 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.560 -0.572 17569 11579 1 18 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.527 -0.447 17569 11580 1 18 . 1 1 135 135 GLN H H 289 7.869 7.869 7.562 0.307 17569 11581 1 18 . 1 1 136 136 LEU N N 290 121.000 121.000 121.822 -0.822 17569 11582 1 18 . 1 1 136 136 LEU HA H 290 4.173 4.173 4.108 0.065 17569 11583 1 18 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.856 -0.718 17569 11584 1 18 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.734 0.266 17569 11585 1 18 . 1 1 136 136 LEU H H 290 7.968 7.968 7.583 0.385 17569 11586 1 18 . 1 1 137 137 LEU N N 291 118.900 118.900 116.564 2.336 17569 11587 1 18 . 1 1 137 137 LEU HA H 291 4.241 4.241 3.990 0.251 17569 11588 1 18 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.443 -1.083 17569 11589 1 18 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.309 -0.837 17569 11590 1 18 . 1 1 137 137 LEU H H 291 8.154 8.154 7.845 0.309 17569 11591 1 18 . 1 1 138 138 GLN N N 292 117.993 117.993 115.037 2.956 17569 11592 1 18 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.260 0.012 17569 11593 1 18 . 1 1 138 138 GLN CA C 292 56.632 56.632 56.710 -0.078 17569 11594 1 18 . 1 1 138 138 GLN CB C 292 28.584 28.584 30.025 -1.441 17569 11595 1 18 . 1 1 138 138 GLN H H 292 7.896 7.896 7.452 0.444 17569 11596 1 18 . 1 1 139 139 GLN N N 293 118.889 118.889 120.473 -1.584 17569 11597 1 18 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.445 -0.176 17569 11598 1 18 . 1 1 139 139 GLN CA C 293 56.454 56.454 54.955 1.499 17569 11599 1 18 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.441 -0.372 17569 11600 1 18 . 1 1 139 139 GLN H H 293 8.091 8.091 8.370 -0.279 17569 11601 1 18 . 1 1 140 140 ASN N N 294 118.604 118.604 124.409 -5.805 17569 11602 1 18 . 1 1 140 140 ASN HA H 294 4.759 4.759 5.035 -0.276 17569 11603 1 18 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.649 0.572 17569 11604 1 18 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.728 -1.995 17569 11605 1 18 . 1 1 140 140 ASN H H 294 8.273 8.273 8.564 -0.291 17569 11606 1 18 . 1 1 141 141 LYS N N 295 121.685 121.685 120.139 1.546 17569 11607 1 18 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.761 -0.401 17569 11608 1 18 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.619 0.554 17569 11609 1 18 . 1 1 141 141 LYS CB C 295 32.535 32.535 34.972 -2.437 17569 11610 1 18 . 1 1 141 141 LYS H H 295 8.089 8.089 8.375 -0.286 17569 11611 1 19 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.667 -0.280 17569 11612 1 19 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.400 0.045 17569 11613 1 19 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.826 -0.570 17569 11614 1 19 . 1 1 3 3 MET HA H 157 4.476 4.476 4.721 -0.245 17569 11615 1 19 . 1 1 3 3 MET CA C 157 55.401 55.401 55.427 -0.026 17569 11616 1 19 . 1 1 4 4 ALA N N 158 124.828 124.828 126.403 -1.575 17569 11617 1 19 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.698 -0.384 17569 11618 1 19 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.838 0.673 17569 11619 1 19 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.317 -1.315 17569 11620 1 19 . 1 1 4 4 ALA H H 158 8.382 8.382 8.412 -0.030 17569 11621 1 19 . 1 1 5 5 ASP N N 159 119.418 119.418 120.569 -1.151 17569 11622 1 19 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.868 -0.278 17569 11623 1 19 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.637 0.499 17569 11624 1 19 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.674 -1.659 17569 11625 1 19 . 1 1 5 5 ASP H H 159 8.312 8.312 8.295 0.017 17569 11626 1 19 . 1 1 6 6 LYS N N 160 121.604 121.604 119.542 2.062 17569 11627 1 19 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.508 -0.165 17569 11628 1 19 . 1 1 6 6 LYS H H 160 8.274 8.274 8.157 0.117 17569 11629 1 19 . 1 1 7 7 ARG N N 161 121.611 121.611 121.374 0.237 17569 11630 1 19 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.477 -0.150 17569 11631 1 19 . 1 1 7 7 ARG H H 161 8.430 8.430 8.682 -0.252 17569 11632 1 19 . 1 1 8 8 GLY N N 162 109.606 109.606 111.820 -2.214 17569 11633 1 19 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.741 0.306 17569 11634 1 19 . 1 1 8 8 GLY H H 162 8.473 8.473 8.753 -0.280 17569 11635 1 19 . 1 1 9 9 ASP N N 163 120.187 120.187 120.616 -0.429 17569 11636 1 19 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.789 -0.140 17569 11637 1 19 . 1 1 9 9 ASP CA C 163 54.151 54.151 52.438 1.714 17569 11638 1 19 . 1 1 9 9 ASP H H 163 8.296 8.296 8.008 0.288 17569 11639 1 19 . 1 1 10 10 GLY N N 164 108.816 108.816 109.011 -0.195 17569 11640 1 19 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.114 0.253 17569 11641 1 19 . 1 1 10 10 GLY H H 164 8.458 8.458 8.258 0.200 17569 11642 1 19 . 1 1 11 11 LEU N N 165 121.195 121.195 119.349 1.846 17569 11643 1 19 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.601 -0.285 17569 11644 1 19 . 1 1 11 11 LEU CA C 165 55.000 55.000 55.068 -0.068 17569 11645 1 19 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.691 -2.760 17569 11646 1 19 . 1 1 11 11 LEU H H 165 8.137 8.137 7.725 0.412 17569 11647 1 19 . 1 1 12 12 HIS N N 166 119.387 119.387 124.719 -5.332 17569 11648 1 19 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.813 -0.158 17569 11649 1 19 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.631 0.638 17569 11650 1 19 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.603 1.094 17569 11651 1 19 . 1 1 12 12 HIS H H 166 8.270 8.270 8.896 -0.626 17569 11652 1 19 . 1 1 13 13 GLY N N 167 109.899 109.899 111.064 -1.165 17569 11653 1 19 . 1 1 13 13 GLY CA C 167 45.105 45.105 45.292 -0.187 17569 11654 1 19 . 1 1 13 13 GLY H H 167 8.276 8.276 8.347 -0.071 17569 11655 1 19 . 1 1 14 14 ILE N N 168 119.597 119.597 122.626 -3.029 17569 11656 1 19 . 1 1 14 14 ILE HA H 168 4.323 4.323 3.886 0.437 17569 11657 1 19 . 1 1 14 14 ILE CA C 168 60.600 60.600 61.448 -0.848 17569 11658 1 19 . 1 1 14 14 ILE CB C 168 38.950 38.950 38.532 0.418 17569 11659 1 19 . 1 1 14 14 ILE H H 168 7.962 7.962 7.702 0.260 17569 11660 1 19 . 1 1 15 15 VAL N N 169 127.578 127.578 125.816 1.762 17569 11661 1 19 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.025 0.255 17569 11662 1 19 . 1 1 15 15 VAL CA C 169 61.317 61.317 63.175 -1.858 17569 11663 1 19 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.313 2.089 17569 11664 1 19 . 1 1 15 15 VAL H H 169 9.011 9.011 8.366 0.645 17569 11665 1 19 . 1 1 16 16 SER N N 170 118.596 118.596 120.003 -1.407 17569 11666 1 19 . 1 1 16 16 SER HA H 170 5.140 5.140 4.707 0.433 17569 11667 1 19 . 1 1 16 16 SER CA C 170 55.985 55.985 56.068 -0.083 17569 11668 1 19 . 1 1 16 16 SER CB C 170 65.261 65.261 65.483 -0.222 17569 11669 1 19 . 1 1 16 16 SER H H 170 8.242 8.242 8.045 0.197 17569 11670 1 19 . 1 1 17 17 CYS N N 171 123.783 123.783 122.736 1.047 17569 11671 1 19 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.157 0.024 17569 11672 1 19 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.481 -0.637 17569 11673 1 19 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.768 2.605 17569 11674 1 19 . 1 1 17 17 CYS H H 171 8.894 8.894 8.493 0.401 17569 11675 1 19 . 1 1 18 18 THR N N 172 121.703 121.703 117.687 4.016 17569 11676 1 19 . 1 1 18 18 THR HA H 172 4.386 4.386 4.077 0.309 17569 11677 1 19 . 1 1 18 18 THR CA C 172 64.667 64.667 64.048 0.619 17569 11678 1 19 . 1 1 18 18 THR CB C 172 69.498 69.498 68.529 0.968 17569 11679 1 19 . 1 1 18 18 THR H H 172 8.788 8.788 8.305 0.483 17569 11680 1 19 . 1 1 19 19 ALA N N 173 131.364 131.364 121.292 10.072 17569 11681 1 19 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.126 0.370 17569 11682 1 19 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.375 0.650 17569 11683 1 19 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.767 3.415 17569 11684 1 19 . 1 1 19 19 ALA H H 173 9.680 9.680 8.127 1.553 17569 11685 1 19 . 1 1 20 20 CYS N N 174 115.498 115.498 114.849 0.649 17569 11686 1 19 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.646 0.322 17569 11687 1 19 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.568 -1.474 17569 11688 1 19 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.523 4.721 17569 11689 1 19 . 1 1 20 20 CYS H H 174 8.470 8.470 7.987 0.483 17569 11690 1 19 . 1 1 21 21 GLY N N 175 112.464 112.464 109.177 3.287 17569 11691 1 19 . 1 1 21 21 GLY CA C 175 45.706 45.706 44.947 0.759 17569 11692 1 19 . 1 1 21 21 GLY H H 175 7.884 7.884 8.007 -0.123 17569 11693 1 19 . 1 1 22 22 GLN N N 176 121.784 121.784 118.131 3.653 17569 11694 1 19 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.516 -0.140 17569 11695 1 19 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.328 1.964 17569 11696 1 19 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.303 -2.962 17569 11697 1 19 . 1 1 22 22 GLN H H 176 8.723 8.723 7.976 0.747 17569 11698 1 19 . 1 1 23 23 GLN N N 177 122.900 122.900 122.018 0.882 17569 11699 1 19 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.429 0.101 17569 11700 1 19 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.193 0.357 17569 11701 1 19 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.049 -0.589 17569 11702 1 19 . 1 1 23 23 GLN H H 177 8.721 8.721 8.511 0.210 17569 11703 1 19 . 1 1 24 24 VAL N N 178 121.000 121.000 124.254 -3.254 17569 11704 1 19 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.984 0.540 17569 11705 1 19 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.084 -2.207 17569 11706 1 19 . 1 1 24 24 VAL H H 178 8.689 8.689 7.712 0.977 17569 11707 1 19 . 1 1 25 25 ASN N N 179 121.392 121.392 124.345 -2.953 17569 11708 1 19 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.371 0.505 17569 11709 1 19 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.857 -2.708 17569 11710 1 19 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.303 -0.326 17569 11711 1 19 . 1 1 25 25 ASN H H 179 8.635 8.635 8.086 0.549 17569 11712 1 19 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.663 -0.203 17569 11713 1 19 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.969 0.029 17569 11714 1 19 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.784 -1.391 17569 11715 1 19 . 1 1 28 28 GLN N N 182 119.300 119.300 121.612 -2.312 17569 11716 1 19 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.438 0.080 17569 11717 1 19 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.534 -2.192 17569 11718 1 19 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.069 0.281 17569 11719 1 19 . 1 1 28 28 GLN H H 182 7.494 7.494 8.301 -0.807 17569 11720 1 19 . 1 1 29 29 LYS N N 183 124.516 124.516 124.889 -0.373 17569 11721 1 19 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.546 -0.624 17569 11722 1 19 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.402 1.910 17569 11723 1 19 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.615 -0.329 17569 11724 1 19 . 1 1 29 29 LYS H H 183 8.779 8.779 8.512 0.267 17569 11725 1 19 . 1 1 30 30 ASP N N 184 116.500 116.500 119.403 -2.903 17569 11726 1 19 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.859 -0.400 17569 11727 1 19 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.682 -0.146 17569 11728 1 19 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.186 -1.215 17569 11729 1 19 . 1 1 30 30 ASP H H 184 8.556 8.556 8.087 0.469 17569 11730 1 19 . 1 1 31 31 SER N N 185 111.505 111.505 115.533 -4.028 17569 11731 1 19 . 1 1 31 31 SER HA H 185 4.695 4.695 4.693 0.002 17569 11732 1 19 . 1 1 31 31 SER CA C 185 59.747 59.747 58.155 1.592 17569 11733 1 19 . 1 1 31 31 SER CB C 185 65.198 65.198 63.429 1.769 17569 11734 1 19 . 1 1 31 31 SER H H 185 7.933 7.933 8.486 -0.553 17569 11735 1 19 . 1 1 32 32 ILE N N 186 113.394 113.394 116.739 -3.345 17569 11736 1 19 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.998 -0.112 17569 11737 1 19 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.462 -0.883 17569 11738 1 19 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.461 1.351 17569 11739 1 19 . 1 1 32 32 ILE H H 186 7.105 7.105 7.580 -0.475 17569 11740 1 19 . 1 1 33 33 TYR N N 187 119.098 119.098 120.813 -1.715 17569 11741 1 19 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.289 -0.766 17569 11742 1 19 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.592 0.668 17569 11743 1 19 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.654 1.786 17569 11744 1 19 . 1 1 33 33 TYR H H 187 8.954 8.954 7.836 1.118 17569 11745 1 19 . 1 1 34 34 ARG N N 188 118.502 118.502 122.037 -3.535 17569 11746 1 19 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.835 -0.198 17569 11747 1 19 . 1 1 34 34 ARG CA C 188 54.752 54.752 55.965 -1.213 17569 11748 1 19 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.047 1.204 17569 11749 1 19 . 1 1 34 34 ARG H H 188 8.412 8.412 8.576 -0.164 17569 11750 1 19 . 1 1 35 35 HIS N N 189 126.596 126.596 126.722 -0.126 17569 11751 1 19 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.864 -0.272 17569 11752 1 19 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.101 -0.380 17569 11753 1 19 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.006 1.466 17569 11754 1 19 . 1 1 35 35 HIS H H 189 9.813 9.813 9.141 0.672 17569 11755 1 19 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.559 -0.261 17569 11756 1 19 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.957 0.319 17569 11757 1 19 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.180 0.671 17569 11758 1 19 . 1 1 37 37 SER N N 191 110.003 110.003 113.871 -3.868 17569 11759 1 19 . 1 1 37 37 SER HA H 191 4.918 4.918 4.305 0.613 17569 11760 1 19 . 1 1 37 37 SER CA C 191 59.031 59.031 60.955 -1.924 17569 11761 1 19 . 1 1 37 37 SER CB C 191 65.104 65.104 63.314 1.790 17569 11762 1 19 . 1 1 37 37 SER H H 191 8.934 8.934 8.528 0.406 17569 11763 1 19 . 1 1 38 38 LEU N N 192 120.959 120.959 113.700 7.259 17569 11764 1 19 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.867 -0.738 17569 11765 1 19 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.291 1.855 17569 11766 1 19 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.570 1.426 17569 11767 1 19 . 1 1 38 38 LEU H H 192 8.649 8.649 7.074 1.575 17569 11768 1 19 . 1 1 39 39 GLN N N 193 108.600 108.600 119.598 -10.998 17569 11769 1 19 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.081 -0.176 17569 11770 1 19 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.611 0.203 17569 11771 1 19 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.890 -1.856 17569 11772 1 19 . 1 1 39 39 GLN H H 193 8.465 8.465 7.875 0.590 17569 11773 1 19 . 1 1 40 40 VAL N N 194 105.325 105.325 117.460 -12.135 17569 11774 1 19 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.537 0.013 17569 11775 1 19 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.531 -0.890 17569 11776 1 19 . 1 1 40 40 VAL H H 194 6.256 6.256 7.782 -1.526 17569 11777 1 19 . 1 1 41 41 LEU N N 195 123.100 123.100 121.678 1.422 17569 11778 1 19 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.806 0.010 17569 11779 1 19 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.495 3.687 17569 11780 1 19 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.137 0.433 17569 11781 1 19 . 1 1 41 41 LEU H H 195 9.154 9.154 8.517 0.637 17569 11782 1 19 . 1 1 42 42 ILE N N 196 124.396 124.396 116.836 7.560 17569 11783 1 19 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.832 1.520 17569 11784 1 19 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.334 0.896 17569 11785 1 19 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.866 1.404 17569 11786 1 19 . 1 1 42 42 ILE H H 196 9.766 9.766 7.828 1.938 17569 11787 1 19 . 1 1 43 43 CYS N N 197 121.500 121.500 114.895 6.605 17569 11788 1 19 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.190 0.072 17569 11789 1 19 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.056 0.646 17569 11790 1 19 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.322 1.978 17569 11791 1 19 . 1 1 43 43 CYS H H 197 9.882 9.882 8.290 1.592 17569 11792 1 19 . 1 1 44 44 LYS N N 198 117.995 117.995 121.777 -3.782 17569 11793 1 19 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.149 -0.160 17569 11794 1 19 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.092 -0.432 17569 11795 1 19 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.214 0.486 17569 11796 1 19 . 1 1 44 44 LYS H H 198 8.089 8.089 8.741 -0.652 17569 11797 1 19 . 1 1 45 45 ASN N N 199 119.200 119.200 117.302 1.898 17569 11798 1 19 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.610 -0.096 17569 11799 1 19 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.911 0.809 17569 11800 1 19 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.036 0.131 17569 11801 1 19 . 1 1 45 45 ASN H H 199 8.356 8.356 8.667 -0.311 17569 11802 1 19 . 1 1 46 46 CYS N N 200 126.600 126.600 119.381 7.219 17569 11803 1 19 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.975 0.206 17569 11804 1 19 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.263 2.232 17569 11805 1 19 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.142 2.040 17569 11806 1 19 . 1 1 46 46 CYS H H 200 9.189 9.189 7.813 1.376 17569 11807 1 19 . 1 1 47 47 PHE N N 201 121.962 121.962 120.337 1.625 17569 11808 1 19 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.142 -0.272 17569 11809 1 19 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.837 1.432 17569 11810 1 19 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.524 0.643 17569 11811 1 19 . 1 1 47 47 PHE H H 201 8.826 8.826 8.276 0.550 17569 11812 1 19 . 1 1 48 48 LYS N N 202 117.400 117.400 120.443 -3.043 17569 11813 1 19 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.927 -0.229 17569 11814 1 19 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.138 -1.186 17569 11815 1 19 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.293 -0.751 17569 11816 1 19 . 1 1 48 48 LYS H H 202 8.512 8.512 8.028 0.484 17569 11817 1 19 . 1 1 49 49 TYR N N 203 120.400 120.400 120.603 -0.203 17569 11818 1 19 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.171 0.243 17569 11819 1 19 . 1 1 49 49 TYR CA C 203 60.772 60.772 62.114 -1.342 17569 11820 1 19 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.568 -0.122 17569 11821 1 19 . 1 1 49 49 TYR H H 203 8.133 8.133 7.817 0.316 17569 11822 1 19 . 1 1 50 50 TYR N N 204 121.783 121.783 118.075 3.708 17569 11823 1 19 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.538 -1.043 17569 11824 1 19 . 1 1 50 50 TYR CA C 204 61.950 61.950 59.066 2.884 17569 11825 1 19 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.513 0.979 17569 11826 1 19 . 1 1 50 50 TYR H H 204 8.765 8.765 7.584 1.181 17569 11827 1 19 . 1 1 51 51 MET N N 205 110.800 110.800 116.489 -5.689 17569 11828 1 19 . 1 1 51 51 MET HA H 205 4.349 4.349 4.095 0.254 17569 11829 1 19 . 1 1 51 51 MET CA C 205 53.505 53.505 58.350 -4.845 17569 11830 1 19 . 1 1 51 51 MET CB C 205 30.384 30.384 33.033 -2.649 17569 11831 1 19 . 1 1 51 51 MET H H 205 7.771 7.771 8.532 -0.761 17569 11832 1 19 . 1 1 52 52 SER N N 206 116.800 116.800 113.034 3.766 17569 11833 1 19 . 1 1 52 52 SER HA H 206 3.919 3.919 4.440 -0.521 17569 11834 1 19 . 1 1 52 52 SER CA C 206 61.621 61.621 60.233 1.388 17569 11835 1 19 . 1 1 52 52 SER CB C 206 62.611 62.611 64.308 -1.697 17569 11836 1 19 . 1 1 52 52 SER H H 206 7.581 7.581 8.206 -0.625 17569 11837 1 19 . 1 1 53 53 ASP N N 207 117.400 117.400 121.820 -4.420 17569 11838 1 19 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.751 -0.179 17569 11839 1 19 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.443 -0.344 17569 11840 1 19 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.254 -0.066 17569 11841 1 19 . 1 1 53 53 ASP H H 207 7.085 7.085 7.945 -0.860 17569 11842 1 19 . 1 1 54 54 ASP N N 208 119.405 119.405 123.045 -3.640 17569 11843 1 19 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.925 -0.536 17569 11844 1 19 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.297 0.604 17569 11845 1 19 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.056 -1.707 17569 11846 1 19 . 1 1 54 54 ASP H H 208 8.439 8.439 8.383 0.056 17569 11847 1 19 . 1 1 55 55 ILE N N 209 124.698 124.698 121.784 2.914 17569 11848 1 19 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.445 -0.445 17569 11849 1 19 . 1 1 55 55 ILE CA C 209 62.278 62.278 59.409 2.869 17569 11850 1 19 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.206 2.085 17569 11851 1 19 . 1 1 55 55 ILE H H 209 8.128 8.128 8.472 -0.344 17569 11852 1 19 . 1 1 56 56 SER N N 210 126.703 126.703 121.087 5.616 17569 11853 1 19 . 1 1 56 56 SER HA H 210 4.365 4.365 4.366 -0.001 17569 11854 1 19 . 1 1 56 56 SER CA C 210 57.769 57.769 58.677 -0.908 17569 11855 1 19 . 1 1 56 56 SER CB C 210 64.991 64.991 64.208 0.783 17569 11856 1 19 . 1 1 56 56 SER H H 210 8.815 8.815 8.473 0.342 17569 11857 1 19 . 1 1 57 57 ARG N N 211 116.885 116.885 119.919 -3.034 17569 11858 1 19 . 1 1 57 57 ARG HA H 211 5.042 5.042 3.881 1.161 17569 11859 1 19 . 1 1 57 57 ARG CA C 211 54.400 54.400 58.425 -4.025 17569 11860 1 19 . 1 1 57 57 ARG CB C 211 34.284 34.284 29.525 4.759 17569 11861 1 19 . 1 1 57 57 ARG H H 211 8.365 8.365 8.654 -0.289 17569 11862 1 19 . 1 1 58 58 ASP N N 212 121.982 121.982 115.938 6.044 17569 11863 1 19 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.313 0.302 17569 11864 1 19 . 1 1 58 58 ASP CA C 212 52.222 52.222 56.921 -4.699 17569 11865 1 19 . 1 1 58 58 ASP CB C 212 41.502 41.502 39.707 1.795 17569 11866 1 19 . 1 1 58 58 ASP H H 212 8.706 8.706 8.504 0.202 17569 11867 1 19 . 1 1 59 59 SER N N 213 114.164 114.164 115.969 -1.805 17569 11868 1 19 . 1 1 59 59 SER HA H 213 4.212 4.212 4.173 0.039 17569 11869 1 19 . 1 1 59 59 SER CA C 213 60.840 60.840 60.786 0.054 17569 11870 1 19 . 1 1 59 59 SER CB C 213 62.714 62.714 63.072 -0.358 17569 11871 1 19 . 1 1 59 59 SER H H 213 8.687 8.687 8.119 0.568 17569 11872 1 19 . 1 1 60 60 ASP N N 214 120.899 120.899 121.285 -0.386 17569 11873 1 19 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.727 0.098 17569 11874 1 19 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.535 0.676 17569 11875 1 19 . 1 1 60 60 ASP CB C 214 41.558 41.558 39.880 1.678 17569 11876 1 19 . 1 1 60 60 ASP H H 214 8.193 8.193 7.844 0.349 17569 11877 1 19 . 1 1 61 61 GLY N N 215 108.300 108.300 108.226 0.074 17569 11878 1 19 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.934 -0.537 17569 11879 1 19 . 1 1 61 61 GLY H H 215 8.234 8.234 8.251 -0.017 17569 11880 1 19 . 1 1 62 62 MET N N 216 120.002 120.002 118.350 1.652 17569 11881 1 19 . 1 1 62 62 MET HA H 216 4.972 4.972 4.623 0.349 17569 11882 1 19 . 1 1 62 62 MET CA C 216 53.151 53.151 53.692 -0.541 17569 11883 1 19 . 1 1 62 62 MET CB C 216 32.311 32.311 33.838 -1.527 17569 11884 1 19 . 1 1 62 62 MET H H 216 8.376 8.376 7.535 0.841 17569 11885 1 19 . 1 1 63 63 ASP N N 217 127.300 127.300 120.085 7.215 17569 11886 1 19 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.454 0.512 17569 11887 1 19 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.039 0.530 17569 11888 1 19 . 1 1 63 63 ASP H H 217 9.368 9.368 8.107 1.261 17569 11889 1 19 . 1 1 64 64 GLU N N 218 114.400 114.400 124.244 -9.844 17569 11890 1 19 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.481 -0.325 17569 11891 1 19 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.750 0.100 17569 11892 1 19 . 1 1 64 64 GLU H H 218 8.583 8.583 8.706 -0.123 17569 11893 1 19 . 1 1 65 65 GLN N N 219 115.500 115.500 117.064 -1.564 17569 11894 1 19 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.549 -0.238 17569 11895 1 19 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.089 0.257 17569 11896 1 19 . 1 1 65 65 GLN H H 219 7.158 7.158 7.773 -0.615 17569 11897 1 19 . 1 1 66 66 CYS N N 220 122.600 122.600 117.679 4.921 17569 11898 1 19 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.180 -1.103 17569 11899 1 19 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.329 1.200 17569 11900 1 19 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.799 1.173 17569 11901 1 19 . 1 1 66 66 CYS H H 220 8.248 8.248 8.338 -0.090 17569 11902 1 19 . 1 1 67 67 ARG N N 221 130.363 130.363 123.852 6.511 17569 11903 1 19 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.495 -0.428 17569 11904 1 19 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.501 -2.485 17569 11905 1 19 . 1 1 67 67 ARG H H 221 9.145 9.145 8.566 0.579 17569 11906 1 19 . 1 1 68 68 TRP N N 222 124.200 124.200 120.575 3.625 17569 11907 1 19 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.710 -0.274 17569 11908 1 19 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.466 0.614 17569 11909 1 19 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.347 0.847 17569 11910 1 19 . 1 1 68 68 TRP H H 222 9.689 9.689 8.221 1.468 17569 11911 1 19 . 1 1 69 69 CYS N N 223 116.297 116.297 111.183 5.114 17569 11912 1 19 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.162 -0.071 17569 11913 1 19 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.467 2.635 17569 11914 1 19 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.041 5.296 17569 11915 1 19 . 1 1 69 69 CYS H H 223 8.822 8.822 7.778 1.044 17569 11916 1 19 . 1 1 70 70 ALA N N 224 123.112 123.112 123.327 -0.215 17569 11917 1 19 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.281 0.125 17569 11918 1 19 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.532 -0.681 17569 11919 1 19 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.676 0.044 17569 11920 1 19 . 1 1 70 70 ALA H H 224 8.787 8.787 8.147 0.640 17569 11921 1 19 . 1 1 71 71 GLU N N 225 118.300 118.300 120.350 -2.050 17569 11922 1 19 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.481 0.827 17569 11923 1 19 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.688 -2.389 17569 11924 1 19 . 1 1 71 71 GLU H H 225 8.541 8.541 8.192 0.349 17569 11925 1 19 . 1 1 72 72 GLY N N 226 111.995 111.995 109.788 2.207 17569 11926 1 19 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.576 -0.173 17569 11927 1 19 . 1 1 72 72 GLY H H 226 9.837 9.837 8.467 1.370 17569 11928 1 19 . 1 1 73 73 GLY N N 227 106.600 106.600 107.320 -0.720 17569 11929 1 19 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.044 0.927 17569 11930 1 19 . 1 1 73 73 GLY H H 227 7.772 7.772 8.389 -0.617 17569 11931 1 19 . 1 1 74 74 ASN N N 228 124.277 124.277 119.192 5.085 17569 11932 1 19 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.463 0.618 17569 11933 1 19 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.881 -0.781 17569 11934 1 19 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.365 -0.281 17569 11935 1 19 . 1 1 74 74 ASN H H 228 8.876 8.876 8.538 0.338 17569 11936 1 19 . 1 1 75 75 LEU N N 229 123.050 123.050 122.138 0.912 17569 11937 1 19 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.855 -0.255 17569 11938 1 19 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.402 0.960 17569 11939 1 19 . 1 1 75 75 LEU CB C 229 43.500 43.500 43.155 0.345 17569 11940 1 19 . 1 1 75 75 LEU H H 229 8.901 8.901 8.068 0.833 17569 11941 1 19 . 1 1 76 76 ILE N N 230 123.552 123.552 123.434 0.118 17569 11942 1 19 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.037 0.448 17569 11943 1 19 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.989 -1.289 17569 11944 1 19 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.931 -0.532 17569 11945 1 19 . 1 1 76 76 ILE H H 230 9.406 9.406 9.227 0.179 17569 11946 1 19 . 1 1 77 77 CYS N N 231 124.637 124.637 123.860 0.777 17569 11947 1 19 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.641 -0.766 17569 11948 1 19 . 1 1 77 77 CYS CA C 231 58.359 58.359 56.747 1.612 17569 11949 1 19 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.483 -0.049 17569 11950 1 19 . 1 1 77 77 CYS H H 231 8.809 8.809 8.310 0.499 17569 11951 1 19 . 1 1 78 78 CYS N N 232 125.697 125.697 122.831 2.866 17569 11952 1 19 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.791 -0.507 17569 11953 1 19 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.502 3.382 17569 11954 1 19 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.970 1.200 17569 11955 1 19 . 1 1 78 78 CYS H H 232 8.579 8.579 8.875 -0.296 17569 11956 1 19 . 1 1 79 79 ASP N N 233 123.600 123.600 126.801 -3.201 17569 11957 1 19 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.694 0.063 17569 11958 1 19 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.240 2.749 17569 11959 1 19 . 1 1 79 79 ASP CB C 233 41.629 41.629 39.924 1.705 17569 11960 1 19 . 1 1 79 79 ASP H H 233 8.577 8.577 8.053 0.524 17569 11961 1 19 . 1 1 80 80 PHE N N 234 122.100 122.100 117.139 4.961 17569 11962 1 19 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.576 -0.050 17569 11963 1 19 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.304 1.605 17569 11964 1 19 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.048 1.801 17569 11965 1 19 . 1 1 80 80 PHE H H 234 10.432 10.432 7.359 3.073 17569 11966 1 19 . 1 1 81 81 CYS N N 235 124.300 124.300 117.685 6.615 17569 11967 1 19 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.688 0.468 17569 11968 1 19 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.007 0.038 17569 11969 1 19 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.743 3.664 17569 11970 1 19 . 1 1 81 81 CYS H H 235 8.476 8.476 8.020 0.456 17569 11971 1 19 . 1 1 82 82 HIS N N 236 112.598 112.598 118.947 -6.349 17569 11972 1 19 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.159 0.824 17569 11973 1 19 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.828 -1.429 17569 11974 1 19 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.668 2.589 17569 11975 1 19 . 1 1 82 82 HIS H H 236 6.699 6.699 8.074 -1.375 17569 11976 1 19 . 1 1 83 83 ASN N N 237 123.600 123.600 118.941 4.659 17569 11977 1 19 . 1 1 83 83 ASN HA H 237 4.801 4.801 5.115 -0.314 17569 11978 1 19 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.828 2.788 17569 11979 1 19 . 1 1 83 83 ASN H H 237 9.097 9.097 7.959 1.138 17569 11980 1 19 . 1 1 84 84 ALA N N 238 122.000 122.000 124.221 -2.221 17569 11981 1 19 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.277 0.132 17569 11982 1 19 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.154 0.210 17569 11983 1 19 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.316 2.754 17569 11984 1 19 . 1 1 84 84 ALA H H 238 9.885 9.885 8.208 1.677 17569 11985 1 19 . 1 1 85 85 PHE N N 239 116.707 116.707 121.231 -4.524 17569 11986 1 19 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.143 0.885 17569 11987 1 19 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.648 -0.431 17569 11988 1 19 . 1 1 85 85 PHE CB C 239 44.664 44.664 43.047 1.617 17569 11989 1 19 . 1 1 85 85 PHE H H 239 9.450 9.450 9.140 0.310 17569 11990 1 19 . 1 1 86 86 CYS N N 240 126.682 126.682 124.608 2.074 17569 11991 1 19 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.693 0.929 17569 11992 1 19 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.878 -0.536 17569 11993 1 19 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.111 3.146 17569 11994 1 19 . 1 1 86 86 CYS H H 240 11.309 11.309 9.437 1.872 17569 11995 1 19 . 1 1 87 87 LYS N N 241 117.865 117.865 124.114 -6.249 17569 11996 1 19 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.926 -0.077 17569 11997 1 19 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.218 -0.148 17569 11998 1 19 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.474 0.324 17569 11999 1 19 . 1 1 87 87 LYS H H 241 8.230 8.230 8.840 -0.610 17569 12000 1 19 . 1 1 88 88 LYS N N 242 117.949 117.949 118.406 -0.457 17569 12001 1 19 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.107 -0.129 17569 12002 1 19 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.954 1.416 17569 12003 1 19 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.019 0.297 17569 12004 1 19 . 1 1 88 88 LYS H H 242 7.945 7.945 8.505 -0.560 17569 12005 1 19 . 1 1 89 89 CYS N N 243 125.305 125.305 117.676 7.629 17569 12006 1 19 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.261 -0.519 17569 12007 1 19 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.948 1.879 17569 12008 1 19 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.067 1.174 17569 12009 1 19 . 1 1 89 89 CYS H H 243 9.297 9.297 7.597 1.700 17569 12010 1 19 . 1 1 90 90 ILE N N 244 119.687 119.687 121.384 -1.697 17569 12011 1 19 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.903 -0.296 17569 12012 1 19 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.657 0.293 17569 12013 1 19 . 1 1 90 90 ILE H H 244 7.997 7.997 7.658 0.339 17569 12014 1 19 . 1 1 91 91 LEU N N 245 120.280 120.280 121.027 -0.747 17569 12015 1 19 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.311 -0.626 17569 12016 1 19 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.562 0.673 17569 12017 1 19 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.052 -0.094 17569 12018 1 19 . 1 1 91 91 LEU H H 245 8.810 8.810 8.779 0.031 17569 12019 1 19 . 1 1 92 92 ARG N N 246 116.901 116.901 115.204 1.697 17569 12020 1 19 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.135 -0.318 17569 12021 1 19 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.701 1.279 17569 12022 1 19 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.276 0.324 17569 12023 1 19 . 1 1 92 92 ARG H H 246 8.086 8.086 7.617 0.469 17569 12024 1 19 . 1 1 93 93 ASN N N 247 111.200 111.200 116.471 -5.271 17569 12025 1 19 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.480 0.123 17569 12026 1 19 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.662 1.146 17569 12027 1 19 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.022 3.462 17569 12028 1 19 . 1 1 93 93 ASN H H 247 7.136 7.136 8.196 -1.060 17569 12029 1 19 . 1 1 94 94 LEU N N 248 118.807 118.807 117.056 1.751 17569 12030 1 19 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.336 0.478 17569 12031 1 19 . 1 1 94 94 LEU CA C 248 55.189 55.189 54.933 0.256 17569 12032 1 19 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.725 -0.027 17569 12033 1 19 . 1 1 94 94 LEU H H 248 8.515 8.515 7.937 0.578 17569 12034 1 19 . 1 1 95 95 GLY N N 249 108.000 108.000 105.787 2.213 17569 12035 1 19 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.634 -0.006 17569 12036 1 19 . 1 1 95 95 GLY H H 249 7.955 7.955 7.662 0.293 17569 12037 1 19 . 1 1 96 96 ARG N N 250 117.797 117.797 121.896 -4.099 17569 12038 1 19 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.263 -0.420 17569 12039 1 19 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.194 0.488 17569 12040 1 19 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.285 -0.425 17569 12041 1 19 . 1 1 96 96 ARG H H 250 8.559 8.559 8.736 -0.177 17569 12042 1 19 . 1 1 97 97 LYS N N 251 120.900 120.900 119.511 1.389 17569 12043 1 19 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.019 0.137 17569 12044 1 19 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.570 -0.414 17569 12045 1 19 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.470 -0.110 17569 12046 1 19 . 1 1 97 97 LYS H H 251 8.655 8.655 8.593 0.062 17569 12047 1 19 . 1 1 98 98 GLU N N 252 122.000 122.000 119.216 2.784 17569 12048 1 19 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.052 0.299 17569 12049 1 19 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.137 -0.555 17569 12050 1 19 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.455 -1.055 17569 12051 1 19 . 1 1 98 98 GLU H H 252 7.705 7.705 8.266 -0.561 17569 12052 1 19 . 1 1 99 99 LEU N N 253 117.400 117.400 121.081 -3.681 17569 12053 1 19 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.789 0.128 17569 12054 1 19 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.117 -0.118 17569 12055 1 19 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.896 -0.414 17569 12056 1 19 . 1 1 99 99 LEU H H 253 7.285 7.285 7.748 -0.463 17569 12057 1 19 . 1 1 100 100 SER N N 254 112.100 112.100 114.752 -2.652 17569 12058 1 19 . 1 1 100 100 SER HA H 254 4.107 4.107 4.055 0.052 17569 12059 1 19 . 1 1 100 100 SER CA C 254 61.603 61.603 62.001 -0.398 17569 12060 1 19 . 1 1 100 100 SER CB C 254 62.622 62.622 63.181 -0.559 17569 12061 1 19 . 1 1 100 100 SER H H 254 8.326 8.326 8.041 0.285 17569 12062 1 19 . 1 1 101 101 THR N N 255 118.151 118.151 118.287 -0.136 17569 12063 1 19 . 1 1 101 101 THR HA H 255 4.026 4.026 4.103 -0.077 17569 12064 1 19 . 1 1 101 101 THR CA C 255 66.261 66.261 65.926 0.335 17569 12065 1 19 . 1 1 101 101 THR CB C 255 68.735 68.735 68.621 0.114 17569 12066 1 19 . 1 1 101 101 THR H H 255 7.972 7.972 7.837 0.135 17569 12067 1 19 . 1 1 102 102 ILE N N 256 120.100 120.100 122.833 -2.733 17569 12068 1 19 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.583 -0.120 17569 12069 1 19 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.699 0.075 17569 12070 1 19 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.328 0.413 17569 12071 1 19 . 1 1 102 102 ILE H H 256 7.868 7.868 8.555 -0.687 17569 12072 1 19 . 1 1 103 103 MET N N 257 114.876 114.876 116.390 -1.514 17569 12073 1 19 . 1 1 103 103 MET HA H 257 4.211 4.211 4.059 0.152 17569 12074 1 19 . 1 1 103 103 MET CA C 257 55.691 55.691 58.512 -2.821 17569 12075 1 19 . 1 1 103 103 MET CB C 257 32.000 32.000 32.732 -0.732 17569 12076 1 19 . 1 1 103 103 MET H H 257 7.606 7.606 7.348 0.258 17569 12077 1 19 . 1 1 104 104 ASP N N 258 119.976 119.976 118.173 1.803 17569 12078 1 19 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.809 -0.271 17569 12079 1 19 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.958 0.954 17569 12080 1 19 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.629 0.871 17569 12081 1 19 . 1 1 104 104 ASP H H 258 7.444 7.444 7.602 -0.158 17569 12082 1 19 . 1 1 105 105 GLU N N 259 124.388 124.388 120.426 3.962 17569 12083 1 19 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.554 -0.267 17569 12084 1 19 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.927 2.644 17569 12085 1 19 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.298 -0.756 17569 12086 1 19 . 1 1 105 105 GLU H H 259 8.559 8.559 8.145 0.414 17569 12087 1 19 . 1 1 106 106 ASN N N 260 117.201 117.201 116.608 0.593 17569 12088 1 19 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.421 0.321 17569 12089 1 19 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.227 -0.484 17569 12090 1 19 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.460 1.458 17569 12091 1 19 . 1 1 106 106 ASN H H 260 8.673 8.673 8.669 0.004 17569 12092 1 19 . 1 1 107 107 ASN N N 261 117.900 117.900 112.332 5.568 17569 12093 1 19 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.332 0.653 17569 12094 1 19 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.617 -2.315 17569 12095 1 19 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.363 3.251 17569 12096 1 19 . 1 1 107 107 ASN H H 261 7.956 7.956 8.696 -0.740 17569 12097 1 19 . 1 1 108 108 GLN N N 262 121.500 121.500 115.286 6.214 17569 12098 1 19 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.048 0.560 17569 12099 1 19 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.540 1.236 17569 12100 1 19 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.701 0.857 17569 12101 1 19 . 1 1 108 108 GLN H H 262 8.493 8.493 7.761 0.732 17569 12102 1 19 . 1 1 109 109 TRP N N 263 128.056 128.056 123.109 4.947 17569 12103 1 19 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.736 0.235 17569 12104 1 19 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.882 0.215 17569 12105 1 19 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.257 0.236 17569 12106 1 19 . 1 1 109 109 TRP H H 263 10.497 10.497 7.985 2.512 17569 12107 1 19 . 1 1 110 110 TYR N N 264 126.600 126.600 124.498 2.102 17569 12108 1 19 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.441 -0.039 17569 12109 1 19 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.414 -1.744 17569 12110 1 19 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.651 -1.643 17569 12111 1 19 . 1 1 110 110 TYR H H 264 7.545 7.545 8.128 -0.583 17569 12112 1 19 . 1 1 111 111 CYS N N 265 124.622 124.622 114.414 10.208 17569 12113 1 19 . 1 1 111 111 CYS H H 265 8.586 8.586 8.062 0.524 17569 12114 1 19 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.805 -0.613 17569 12115 1 19 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.475 1.240 17569 12116 1 19 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.570 1.350 17569 12117 1 19 . 1 1 113 113 ILE N N 267 119.504 119.504 119.493 0.011 17569 12118 1 19 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.493 -0.543 17569 12119 1 19 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.958 0.291 17569 12120 1 19 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.540 -3.007 17569 12121 1 19 . 1 1 113 113 ILE H H 267 9.160 9.160 7.470 1.690 17569 12122 1 19 . 1 1 114 114 CYS N N 268 124.100 124.100 118.363 5.737 17569 12123 1 19 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.165 -0.351 17569 12124 1 19 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.643 3.657 17569 12125 1 19 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.090 2.631 17569 12126 1 19 . 1 1 114 114 CYS H H 268 7.818 7.818 8.245 -0.427 17569 12127 1 19 . 1 1 115 115 HIS N N 269 117.127 117.127 111.235 5.892 17569 12128 1 19 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.657 0.472 17569 12129 1 19 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.045 -0.884 17569 12130 1 19 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.786 2.406 17569 12131 1 19 . 1 1 115 115 HIS H H 269 8.953 8.953 7.800 1.153 17569 12132 1 19 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.446 0.496 17569 12133 1 19 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.466 -0.158 17569 12134 1 19 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.629 1.013 17569 12135 1 19 . 1 1 117 117 GLU N N 271 123.504 123.504 122.953 0.551 17569 12136 1 19 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.361 -0.341 17569 12137 1 19 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.179 3.690 17569 12138 1 19 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.877 -1.826 17569 12139 1 19 . 1 1 117 117 GLU H H 271 8.402 8.402 8.122 0.280 17569 12140 1 19 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.564 -0.022 17569 12141 1 19 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.748 1.611 17569 12142 1 19 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.447 0.695 17569 12143 1 19 . 1 1 119 119 LEU N N 273 112.296 112.296 114.373 -2.077 17569 12144 1 19 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.903 -0.429 17569 12145 1 19 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.258 0.284 17569 12146 1 19 . 1 1 119 119 LEU H H 273 8.090 8.090 7.445 0.645 17569 12147 1 19 . 1 1 120 120 LEU N N 274 121.388 121.388 122.924 -1.536 17569 12148 1 19 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.916 0.111 17569 12149 1 19 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.367 -0.066 17569 12150 1 19 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.745 0.355 17569 12151 1 19 . 1 1 120 120 LEU H H 274 7.823 7.823 7.979 -0.156 17569 12152 1 19 . 1 1 121 121 ASP N N 275 118.600 118.600 118.938 -0.338 17569 12153 1 19 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.345 0.196 17569 12154 1 19 . 1 1 121 121 ASP CA C 275 57.703 57.703 58.392 -0.689 17569 12155 1 19 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.377 -0.934 17569 12156 1 19 . 1 1 121 121 ASP H H 275 8.694 8.694 8.488 0.206 17569 12157 1 19 . 1 1 122 122 LEU N N 276 123.192 123.192 120.372 2.820 17569 12158 1 19 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.017 0.375 17569 12159 1 19 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.475 -0.504 17569 12160 1 19 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.051 0.491 17569 12161 1 19 . 1 1 122 122 LEU H H 276 8.013 8.013 7.410 0.603 17569 12162 1 19 . 1 1 123 123 VAL N N 277 126.898 126.898 118.805 8.093 17569 12163 1 19 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.685 0.170 17569 12164 1 19 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.977 -0.314 17569 12165 1 19 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.345 0.713 17569 12166 1 19 . 1 1 123 123 VAL H H 277 8.781 8.781 7.830 0.951 17569 12167 1 19 . 1 1 124 124 THR N N 278 117.500 117.500 116.539 0.961 17569 12168 1 19 . 1 1 124 124 THR HA H 278 4.030 4.030 3.901 0.129 17569 12169 1 19 . 1 1 124 124 THR CA C 278 66.589 66.589 67.225 -0.636 17569 12170 1 19 . 1 1 124 124 THR CB C 278 68.410 68.410 68.518 -0.108 17569 12171 1 19 . 1 1 124 124 THR H H 278 8.722 8.722 8.370 0.352 17569 12172 1 19 . 1 1 125 125 ALA N N 279 124.700 124.700 124.173 0.527 17569 12173 1 19 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.137 0.124 17569 12174 1 19 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.029 0.267 17569 12175 1 19 . 1 1 125 125 ALA CB C 279 17.949 17.949 18.058 -0.109 17569 12176 1 19 . 1 1 125 125 ALA H H 279 8.239 8.239 8.395 -0.156 17569 12177 1 19 . 1 1 126 126 CYS N N 280 119.276 119.276 117.719 1.557 17569 12178 1 19 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.868 0.246 17569 12179 1 19 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.554 -1.451 17569 12180 1 19 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.876 -1.380 17569 12181 1 19 . 1 1 126 126 CYS H H 280 8.128 8.128 7.851 0.277 17569 12182 1 19 . 1 1 127 127 ASN N N 281 118.000 118.000 118.171 -0.171 17569 12183 1 19 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.588 -0.028 17569 12184 1 19 . 1 1 127 127 ASN CA C 281 56.139 56.139 57.030 -0.891 17569 12185 1 19 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.461 -1.496 17569 12186 1 19 . 1 1 127 127 ASN H H 281 8.725 8.725 7.936 0.789 17569 12187 1 19 . 1 1 128 128 SER N N 282 116.601 116.601 117.049 -0.448 17569 12188 1 19 . 1 1 128 128 SER HA H 282 4.363 4.363 4.182 0.181 17569 12189 1 19 . 1 1 128 128 SER CA C 282 61.899 61.899 61.717 0.182 17569 12190 1 19 . 1 1 128 128 SER CB C 282 62.630 62.630 63.087 -0.457 17569 12191 1 19 . 1 1 128 128 SER H H 282 8.542 8.542 7.636 0.906 17569 12192 1 19 . 1 1 129 129 VAL N N 283 123.272 123.272 121.699 1.573 17569 12193 1 19 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.606 0.071 17569 12194 1 19 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.196 0.312 17569 12195 1 19 . 1 1 129 129 VAL CB C 283 31.218 31.218 30.930 0.288 17569 12196 1 19 . 1 1 129 129 VAL H H 283 7.990 7.990 7.723 0.267 17569 12197 1 19 . 1 1 130 130 PHE N N 284 118.594 118.594 119.277 -0.683 17569 12198 1 19 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.304 -0.291 17569 12199 1 19 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.514 1.986 17569 12200 1 19 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.228 0.767 17569 12201 1 19 . 1 1 130 130 PHE H H 284 8.190 8.190 7.769 0.421 17569 12202 1 19 . 1 1 131 131 GLU N N 285 120.905 120.905 120.272 0.633 17569 12203 1 19 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.988 0.217 17569 12204 1 19 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.024 -0.810 17569 12205 1 19 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.478 0.022 17569 12206 1 19 . 1 1 131 131 GLU H H 285 8.699 8.699 8.849 -0.150 17569 12207 1 19 . 1 1 132 132 ASN N N 286 117.997 117.997 118.222 -0.225 17569 12208 1 19 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.629 -0.034 17569 12209 1 19 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.706 -1.091 17569 12210 1 19 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.668 0.184 17569 12211 1 19 . 1 1 132 132 ASN H H 286 8.082 8.082 8.105 -0.023 17569 12212 1 19 . 1 1 133 133 LEU N N 287 120.800 120.800 122.552 -1.752 17569 12213 1 19 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.294 -0.177 17569 12214 1 19 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.374 -0.576 17569 12215 1 19 . 1 1 133 133 LEU H H 287 7.904 7.904 8.625 -0.721 17569 12216 1 19 . 1 1 134 134 GLU N N 288 118.200 118.200 118.958 -0.758 17569 12217 1 19 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.950 0.129 17569 12218 1 19 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.346 -1.349 17569 12219 1 19 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.333 -0.091 17569 12220 1 19 . 1 1 134 134 GLU H H 288 8.157 8.157 8.500 -0.343 17569 12221 1 19 . 1 1 135 135 GLN N N 289 117.400 117.400 118.089 -0.689 17569 12222 1 19 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.098 0.076 17569 12223 1 19 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.359 -0.370 17569 12224 1 19 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.526 -0.446 17569 12225 1 19 . 1 1 135 135 GLN H H 289 7.869 7.869 7.701 0.168 17569 12226 1 19 . 1 1 136 136 LEU N N 290 121.000 121.000 122.079 -1.079 17569 12227 1 19 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.823 0.350 17569 12228 1 19 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.791 -0.653 17569 12229 1 19 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.683 0.317 17569 12230 1 19 . 1 1 136 136 LEU H H 290 7.968 7.968 7.642 0.326 17569 12231 1 19 . 1 1 137 137 LEU N N 291 118.900 118.900 117.611 1.289 17569 12232 1 19 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.026 0.215 17569 12233 1 19 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.163 -0.803 17569 12234 1 19 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.153 -0.681 17569 12235 1 19 . 1 1 137 137 LEU H H 291 8.154 8.154 7.475 0.679 17569 12236 1 19 . 1 1 138 138 GLN N N 292 117.993 117.993 116.033 1.960 17569 12237 1 19 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.427 -0.155 17569 12238 1 19 . 1 1 138 138 GLN CA C 292 56.632 56.632 55.807 0.825 17569 12239 1 19 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.057 -0.473 17569 12240 1 19 . 1 1 138 138 GLN H H 292 7.896 7.896 7.617 0.279 17569 12241 1 19 . 1 1 139 139 GLN N N 293 118.889 118.889 119.158 -0.269 17569 12242 1 19 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.435 -0.166 17569 12243 1 19 . 1 1 139 139 GLN CA C 293 56.454 56.454 56.127 0.327 17569 12244 1 19 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.201 -0.132 17569 12245 1 19 . 1 1 139 139 GLN H H 293 8.091 8.091 7.387 0.704 17569 12246 1 19 . 1 1 140 140 ASN N N 294 118.604 118.604 118.418 0.186 17569 12247 1 19 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.818 -0.059 17569 12248 1 19 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.762 -0.541 17569 12249 1 19 . 1 1 140 140 ASN CB C 294 38.733 38.733 38.701 0.032 17569 12250 1 19 . 1 1 140 140 ASN H H 294 8.273 8.273 8.182 0.091 17569 12251 1 19 . 1 1 141 141 LYS N N 295 121.685 121.685 122.596 -0.911 17569 12252 1 19 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.603 -0.243 17569 12253 1 19 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.894 0.279 17569 12254 1 19 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.807 -1.272 17569 12255 1 19 . 1 1 141 141 LYS H H 295 8.089 8.089 8.275 -0.186 17569 12256 1 20 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.866 -0.479 17569 12257 1 20 . 1 1 2 2 ALA CA C 156 52.445 52.445 51.581 0.864 17569 12258 1 20 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.404 -1.147 17569 12259 1 20 . 1 1 3 3 MET HA H 157 4.476 4.476 4.686 -0.210 17569 12260 1 20 . 1 1 3 3 MET CA C 157 55.401 55.401 55.802 -0.401 17569 12261 1 20 . 1 1 4 4 ALA N N 158 124.828 124.828 126.792 -1.964 17569 12262 1 20 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.562 -0.248 17569 12263 1 20 . 1 1 4 4 ALA CA C 158 52.511 52.511 52.258 0.253 17569 12264 1 20 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.967 -0.966 17569 12265 1 20 . 1 1 4 4 ALA H H 158 8.382 8.382 8.317 0.065 17569 12266 1 20 . 1 1 5 5 ASP N N 159 119.418 119.418 122.253 -2.835 17569 12267 1 20 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.784 -0.194 17569 12268 1 20 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.652 -0.516 17569 12269 1 20 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.593 -0.578 17569 12270 1 20 . 1 1 5 5 ASP H H 159 8.312 8.312 8.431 -0.119 17569 12271 1 20 . 1 1 6 6 LYS N N 160 121.604 121.604 124.143 -2.539 17569 12272 1 20 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.697 -0.354 17569 12273 1 20 . 1 1 6 6 LYS H H 160 8.274 8.274 8.575 -0.301 17569 12274 1 20 . 1 1 7 7 ARG N N 161 121.611 121.611 120.131 1.480 17569 12275 1 20 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.475 -0.148 17569 12276 1 20 . 1 1 7 7 ARG H H 161 8.430 8.430 8.583 -0.153 17569 12277 1 20 . 1 1 8 8 GLY N N 162 109.606 109.606 107.811 1.795 17569 12278 1 20 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.527 -0.480 17569 12279 1 20 . 1 1 8 8 GLY H H 162 8.473 8.473 8.155 0.318 17569 12280 1 20 . 1 1 9 9 ASP N N 163 120.187 120.187 119.329 0.858 17569 12281 1 20 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.896 -0.247 17569 12282 1 20 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.406 0.745 17569 12283 1 20 . 1 1 9 9 ASP H H 163 8.296 8.296 7.919 0.377 17569 12284 1 20 . 1 1 10 10 GLY N N 164 108.816 108.816 108.682 0.134 17569 12285 1 20 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.747 0.620 17569 12286 1 20 . 1 1 10 10 GLY H H 164 8.458 8.458 8.453 0.005 17569 12287 1 20 . 1 1 11 11 LEU N N 165 121.195 121.195 122.306 -1.111 17569 12288 1 20 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.673 -0.357 17569 12289 1 20 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.975 0.025 17569 12290 1 20 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.404 -2.472 17569 12291 1 20 . 1 1 11 11 LEU H H 165 8.137 8.137 7.930 0.207 17569 12292 1 20 . 1 1 12 12 HIS N N 166 119.387 119.387 124.299 -4.912 17569 12293 1 20 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.724 -0.069 17569 12294 1 20 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.639 0.630 17569 12295 1 20 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.967 0.730 17569 12296 1 20 . 1 1 12 12 HIS H H 166 8.270 8.270 8.732 -0.462 17569 12297 1 20 . 1 1 13 13 GLY N N 167 109.899 109.899 111.623 -1.724 17569 12298 1 20 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.336 0.769 17569 12299 1 20 . 1 1 13 13 GLY H H 167 8.276 8.276 8.349 -0.073 17569 12300 1 20 . 1 1 14 14 ILE N N 168 119.597 119.597 120.307 -0.710 17569 12301 1 20 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.244 0.079 17569 12302 1 20 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.124 0.476 17569 12303 1 20 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.486 -2.536 17569 12304 1 20 . 1 1 14 14 ILE H H 168 7.962 7.962 7.785 0.177 17569 12305 1 20 . 1 1 15 15 VAL N N 169 127.578 127.578 125.925 1.653 17569 12306 1 20 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.062 0.218 17569 12307 1 20 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.591 -1.274 17569 12308 1 20 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.226 2.176 17569 12309 1 20 . 1 1 15 15 VAL H H 169 9.011 9.011 8.467 0.544 17569 12310 1 20 . 1 1 16 16 SER N N 170 118.596 118.596 120.138 -1.542 17569 12311 1 20 . 1 1 16 16 SER HA H 170 5.140 5.140 4.676 0.464 17569 12312 1 20 . 1 1 16 16 SER CA C 170 55.985 55.985 56.579 -0.594 17569 12313 1 20 . 1 1 16 16 SER CB C 170 65.261 65.261 66.049 -0.788 17569 12314 1 20 . 1 1 16 16 SER H H 170 8.242 8.242 7.744 0.498 17569 12315 1 20 . 1 1 17 17 CYS N N 171 123.783 123.783 123.540 0.243 17569 12316 1 20 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.158 0.023 17569 12317 1 20 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.273 -0.428 17569 12318 1 20 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.614 2.759 17569 12319 1 20 . 1 1 17 17 CYS H H 171 8.894 8.894 8.477 0.417 17569 12320 1 20 . 1 1 18 18 THR N N 172 121.703 121.703 117.713 3.990 17569 12321 1 20 . 1 1 18 18 THR HA H 172 4.386 4.386 4.082 0.304 17569 12322 1 20 . 1 1 18 18 THR CA C 172 64.667 64.667 64.030 0.637 17569 12323 1 20 . 1 1 18 18 THR CB C 172 69.498 69.498 68.502 0.995 17569 12324 1 20 . 1 1 18 18 THR H H 172 8.788 8.788 8.259 0.529 17569 12325 1 20 . 1 1 19 19 ALA N N 173 131.364 131.364 121.239 10.125 17569 12326 1 20 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.101 0.395 17569 12327 1 20 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.426 0.599 17569 12328 1 20 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.726 3.456 17569 12329 1 20 . 1 1 19 19 ALA H H 173 9.680 9.680 8.088 1.592 17569 12330 1 20 . 1 1 20 20 CYS N N 174 115.498 115.498 115.469 0.029 17569 12331 1 20 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.468 0.500 17569 12332 1 20 . 1 1 20 20 CYS CA C 174 58.094 58.094 60.114 -2.020 17569 12333 1 20 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.944 4.300 17569 12334 1 20 . 1 1 20 20 CYS H H 174 8.470 8.470 7.832 0.638 17569 12335 1 20 . 1 1 21 21 GLY N N 175 112.464 112.464 109.508 2.956 17569 12336 1 20 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.065 0.641 17569 12337 1 20 . 1 1 21 21 GLY H H 175 7.884 7.884 7.926 -0.042 17569 12338 1 20 . 1 1 22 22 GLN N N 176 121.784 121.784 118.188 3.596 17569 12339 1 20 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.462 -0.086 17569 12340 1 20 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.628 1.663 17569 12341 1 20 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.728 -2.387 17569 12342 1 20 . 1 1 22 22 GLN H H 176 8.723 8.723 7.924 0.799 17569 12343 1 20 . 1 1 23 23 GLN N N 177 122.900 122.900 122.249 0.651 17569 12344 1 20 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.188 0.342 17569 12345 1 20 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.951 -0.401 17569 12346 1 20 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.249 -0.789 17569 12347 1 20 . 1 1 23 23 GLN H H 177 8.721 8.721 8.533 0.188 17569 12348 1 20 . 1 1 24 24 VAL N N 178 121.000 121.000 125.914 -4.914 17569 12349 1 20 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.115 0.409 17569 12350 1 20 . 1 1 24 24 VAL CA C 178 59.877 59.877 60.663 -0.786 17569 12351 1 20 . 1 1 24 24 VAL H H 178 8.689 8.689 7.915 0.774 17569 12352 1 20 . 1 1 25 25 ASN N N 179 121.392 121.392 123.095 -1.703 17569 12353 1 20 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.334 0.542 17569 12354 1 20 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.486 -2.337 17569 12355 1 20 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.585 -0.608 17569 12356 1 20 . 1 1 25 25 ASN H H 179 8.635 8.635 8.128 0.507 17569 12357 1 20 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.738 -0.278 17569 12358 1 20 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.890 0.108 17569 12359 1 20 . 1 1 27 27 PHE CB C 181 38.393 38.393 40.120 -1.727 17569 12360 1 20 . 1 1 28 28 GLN N N 182 119.300 119.300 121.889 -2.589 17569 12361 1 20 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.383 0.135 17569 12362 1 20 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.322 -1.980 17569 12363 1 20 . 1 1 28 28 GLN CB C 182 30.350 30.350 29.794 0.556 17569 12364 1 20 . 1 1 28 28 GLN H H 182 7.494 7.494 8.262 -0.768 17569 12365 1 20 . 1 1 29 29 LYS N N 183 124.516 124.516 125.554 -1.038 17569 12366 1 20 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.538 -0.616 17569 12367 1 20 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.501 1.811 17569 12368 1 20 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.602 -0.316 17569 12369 1 20 . 1 1 29 29 LYS H H 183 8.779 8.779 8.552 0.227 17569 12370 1 20 . 1 1 30 30 ASP N N 184 116.500 116.500 119.109 -2.609 17569 12371 1 20 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.818 -0.359 17569 12372 1 20 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.362 0.174 17569 12373 1 20 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.528 -1.557 17569 12374 1 20 . 1 1 30 30 ASP H H 184 8.556 8.556 8.045 0.511 17569 12375 1 20 . 1 1 31 31 SER N N 185 111.505 111.505 113.293 -1.788 17569 12376 1 20 . 1 1 31 31 SER HA H 185 4.695 4.695 4.710 -0.015 17569 12377 1 20 . 1 1 31 31 SER CA C 185 59.747 59.747 57.977 1.770 17569 12378 1 20 . 1 1 31 31 SER CB C 185 65.198 65.198 63.772 1.426 17569 12379 1 20 . 1 1 31 31 SER H H 185 7.933 7.933 8.334 -0.401 17569 12380 1 20 . 1 1 32 32 ILE N N 186 113.394 113.394 116.310 -2.916 17569 12381 1 20 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.992 -0.106 17569 12382 1 20 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.812 -1.233 17569 12383 1 20 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.530 1.282 17569 12384 1 20 . 1 1 32 32 ILE H H 186 7.105 7.105 7.552 -0.447 17569 12385 1 20 . 1 1 33 33 TYR N N 187 119.098 119.098 120.967 -1.869 17569 12386 1 20 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.157 -0.634 17569 12387 1 20 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.004 1.256 17569 12388 1 20 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.259 2.181 17569 12389 1 20 . 1 1 33 33 TYR H H 187 8.954 8.954 7.842 1.112 17569 12390 1 20 . 1 1 34 34 ARG N N 188 118.502 118.502 122.043 -3.541 17569 12391 1 20 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.786 -0.149 17569 12392 1 20 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.175 -1.423 17569 12393 1 20 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.201 1.050 17569 12394 1 20 . 1 1 34 34 ARG H H 188 8.412 8.412 8.598 -0.186 17569 12395 1 20 . 1 1 35 35 HIS N N 189 126.596 126.596 127.162 -0.566 17569 12396 1 20 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.916 -0.324 17569 12397 1 20 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.166 -0.445 17569 12398 1 20 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.116 1.356 17569 12399 1 20 . 1 1 35 35 HIS H H 189 9.813 9.813 9.125 0.688 17569 12400 1 20 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.638 -0.340 17569 12401 1 20 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.904 0.372 17569 12402 1 20 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.206 0.645 17569 12403 1 20 . 1 1 37 37 SER N N 191 110.003 110.003 113.701 -3.698 17569 12404 1 20 . 1 1 37 37 SER HA H 191 4.918 4.918 4.315 0.603 17569 12405 1 20 . 1 1 37 37 SER CA C 191 59.031 59.031 61.529 -2.498 17569 12406 1 20 . 1 1 37 37 SER CB C 191 65.104 65.104 63.269 1.835 17569 12407 1 20 . 1 1 37 37 SER H H 191 8.934 8.934 8.634 0.300 17569 12408 1 20 . 1 1 38 38 LEU N N 192 120.959 120.959 114.660 6.299 17569 12409 1 20 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.989 -0.860 17569 12410 1 20 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.160 1.986 17569 12411 1 20 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.326 1.670 17569 12412 1 20 . 1 1 38 38 LEU H H 192 8.649 8.649 6.997 1.652 17569 12413 1 20 . 1 1 39 39 GLN N N 193 108.600 108.600 118.688 -10.088 17569 12414 1 20 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.107 -0.202 17569 12415 1 20 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.653 0.161 17569 12416 1 20 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.619 -1.585 17569 12417 1 20 . 1 1 39 39 GLN H H 193 8.465 8.465 7.773 0.692 17569 12418 1 20 . 1 1 40 40 VAL N N 194 105.325 105.325 118.271 -12.946 17569 12419 1 20 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.455 0.095 17569 12420 1 20 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.946 -1.305 17569 12421 1 20 . 1 1 40 40 VAL H H 194 6.256 6.256 7.824 -1.568 17569 12422 1 20 . 1 1 41 41 LEU N N 195 123.100 123.100 122.330 0.770 17569 12423 1 20 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.766 0.050 17569 12424 1 20 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.696 3.486 17569 12425 1 20 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.373 0.197 17569 12426 1 20 . 1 1 41 41 LEU H H 195 9.154 9.154 8.502 0.652 17569 12427 1 20 . 1 1 42 42 ILE N N 196 124.396 124.396 117.135 7.261 17569 12428 1 20 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.815 1.537 17569 12429 1 20 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.225 1.005 17569 12430 1 20 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.862 1.408 17569 12431 1 20 . 1 1 42 42 ILE H H 196 9.766 9.766 7.827 1.939 17569 12432 1 20 . 1 1 43 43 CYS N N 197 121.500 121.500 115.052 6.448 17569 12433 1 20 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.184 0.078 17569 12434 1 20 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.260 0.443 17569 12435 1 20 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.150 2.150 17569 12436 1 20 . 1 1 43 43 CYS H H 197 9.882 9.882 8.303 1.579 17569 12437 1 20 . 1 1 44 44 LYS N N 198 117.995 117.995 122.454 -4.459 17569 12438 1 20 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.155 -0.166 17569 12439 1 20 . 1 1 44 44 LYS CA C 198 59.660 59.660 59.983 -0.323 17569 12440 1 20 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.302 0.398 17569 12441 1 20 . 1 1 44 44 LYS H H 198 8.089 8.089 8.712 -0.623 17569 12442 1 20 . 1 1 45 45 ASN N N 199 119.200 119.200 117.594 1.606 17569 12443 1 20 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.603 -0.089 17569 12444 1 20 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.109 0.611 17569 12445 1 20 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.148 0.019 17569 12446 1 20 . 1 1 45 45 ASN H H 199 8.356 8.356 8.558 -0.202 17569 12447 1 20 . 1 1 46 46 CYS N N 200 126.600 126.600 118.459 8.141 17569 12448 1 20 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.033 0.148 17569 12449 1 20 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.142 2.353 17569 12450 1 20 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.206 1.976 17569 12451 1 20 . 1 1 46 46 CYS H H 200 9.189 9.189 7.946 1.243 17569 12452 1 20 . 1 1 47 47 PHE N N 201 121.962 121.962 120.423 1.539 17569 12453 1 20 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.140 -0.270 17569 12454 1 20 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.425 1.843 17569 12455 1 20 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.542 0.625 17569 12456 1 20 . 1 1 47 47 PHE H H 201 8.826 8.826 7.841 0.985 17569 12457 1 20 . 1 1 48 48 LYS N N 202 117.400 117.400 120.227 -2.827 17569 12458 1 20 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.872 -0.174 17569 12459 1 20 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.189 -1.237 17569 12460 1 20 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.317 -0.775 17569 12461 1 20 . 1 1 48 48 LYS H H 202 8.512 8.512 7.969 0.543 17569 12462 1 20 . 1 1 49 49 TYR N N 203 120.400 120.400 120.375 0.025 17569 12463 1 20 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.233 0.181 17569 12464 1 20 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.462 -0.690 17569 12465 1 20 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.665 -0.219 17569 12466 1 20 . 1 1 49 49 TYR H H 203 8.133 8.133 7.688 0.445 17569 12467 1 20 . 1 1 50 50 TYR N N 204 121.783 121.783 118.294 3.489 17569 12468 1 20 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.668 -1.173 17569 12469 1 20 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.853 3.097 17569 12470 1 20 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.533 0.959 17569 12471 1 20 . 1 1 50 50 TYR H H 204 8.765 8.765 7.538 1.227 17569 12472 1 20 . 1 1 51 51 MET N N 205 110.800 110.800 115.546 -4.746 17569 12473 1 20 . 1 1 51 51 MET HA H 205 4.349 4.349 4.192 0.157 17569 12474 1 20 . 1 1 51 51 MET CA C 205 53.505 53.505 58.106 -4.601 17569 12475 1 20 . 1 1 51 51 MET CB C 205 30.384 30.384 33.480 -3.096 17569 12476 1 20 . 1 1 51 51 MET H H 205 7.771 7.771 8.506 -0.735 17569 12477 1 20 . 1 1 52 52 SER N N 206 116.800 116.800 112.904 3.896 17569 12478 1 20 . 1 1 52 52 SER HA H 206 3.919 3.919 4.360 -0.441 17569 12479 1 20 . 1 1 52 52 SER CA C 206 61.621 61.621 59.844 1.777 17569 12480 1 20 . 1 1 52 52 SER CB C 206 62.611 62.611 64.487 -1.875 17569 12481 1 20 . 1 1 52 52 SER H H 206 7.581 7.581 8.283 -0.702 17569 12482 1 20 . 1 1 53 53 ASP N N 207 117.400 117.400 121.526 -4.126 17569 12483 1 20 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.813 -0.241 17569 12484 1 20 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.377 -0.278 17569 12485 1 20 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.874 0.314 17569 12486 1 20 . 1 1 53 53 ASP H H 207 7.085 7.085 8.098 -1.013 17569 12487 1 20 . 1 1 54 54 ASP N N 208 119.405 119.405 123.326 -3.921 17569 12488 1 20 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.981 -0.592 17569 12489 1 20 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.525 0.375 17569 12490 1 20 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.837 -1.488 17569 12491 1 20 . 1 1 54 54 ASP H H 208 8.439 8.439 8.556 -0.117 17569 12492 1 20 . 1 1 55 55 ILE N N 209 124.698 124.698 120.816 3.882 17569 12493 1 20 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.471 -0.471 17569 12494 1 20 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.180 2.098 17569 12495 1 20 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.695 0.596 17569 12496 1 20 . 1 1 55 55 ILE H H 209 8.128 8.128 8.401 -0.273 17569 12497 1 20 . 1 1 56 56 SER N N 210 126.703 126.703 120.875 5.828 17569 12498 1 20 . 1 1 56 56 SER HA H 210 4.365 4.365 4.637 -0.272 17569 12499 1 20 . 1 1 56 56 SER CA C 210 57.769 57.769 57.415 0.354 17569 12500 1 20 . 1 1 56 56 SER CB C 210 64.991 64.991 65.464 -0.473 17569 12501 1 20 . 1 1 56 56 SER H H 210 8.815 8.815 8.397 0.418 17569 12502 1 20 . 1 1 57 57 ARG N N 211 116.885 116.885 119.727 -2.842 17569 12503 1 20 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.789 0.253 17569 12504 1 20 . 1 1 57 57 ARG CA C 211 54.400 54.400 56.231 -1.831 17569 12505 1 20 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.282 3.002 17569 12506 1 20 . 1 1 57 57 ARG H H 211 8.365 8.365 8.544 -0.179 17569 12507 1 20 . 1 1 58 58 ASP N N 212 121.982 121.982 123.382 -1.400 17569 12508 1 20 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.904 -0.289 17569 12509 1 20 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.357 -1.135 17569 12510 1 20 . 1 1 58 58 ASP CB C 212 41.502 41.502 43.923 -2.421 17569 12511 1 20 . 1 1 58 58 ASP H H 212 8.706 8.706 8.580 0.126 17569 12512 1 20 . 1 1 59 59 SER N N 213 114.164 114.164 114.134 0.030 17569 12513 1 20 . 1 1 59 59 SER HA H 213 4.212 4.212 4.063 0.149 17569 12514 1 20 . 1 1 59 59 SER CA C 213 60.840 60.840 60.870 -0.030 17569 12515 1 20 . 1 1 59 59 SER CB C 213 62.714 62.714 62.925 -0.211 17569 12516 1 20 . 1 1 59 59 SER H H 213 8.687 8.687 8.517 0.170 17569 12517 1 20 . 1 1 60 60 ASP N N 214 120.899 120.899 120.504 0.395 17569 12518 1 20 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.770 0.055 17569 12519 1 20 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.766 0.445 17569 12520 1 20 . 1 1 60 60 ASP CB C 214 41.558 41.558 41.366 0.192 17569 12521 1 20 . 1 1 60 60 ASP H H 214 8.193 8.193 8.129 0.064 17569 12522 1 20 . 1 1 61 61 GLY N N 215 108.300 108.300 108.829 -0.529 17569 12523 1 20 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.850 -0.453 17569 12524 1 20 . 1 1 61 61 GLY H H 215 8.234 8.234 8.109 0.125 17569 12525 1 20 . 1 1 62 62 MET N N 216 120.002 120.002 117.630 2.372 17569 12526 1 20 . 1 1 62 62 MET HA H 216 4.972 4.972 4.702 0.270 17569 12527 1 20 . 1 1 62 62 MET CA C 216 53.151 53.151 54.408 -1.257 17569 12528 1 20 . 1 1 62 62 MET CB C 216 32.311 32.311 36.237 -3.926 17569 12529 1 20 . 1 1 62 62 MET H H 216 8.376 8.376 7.303 1.073 17569 12530 1 20 . 1 1 63 63 ASP N N 217 127.300 127.300 122.065 5.235 17569 12531 1 20 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.768 0.198 17569 12532 1 20 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.461 0.108 17569 12533 1 20 . 1 1 63 63 ASP H H 217 9.368 9.368 8.713 0.655 17569 12534 1 20 . 1 1 64 64 GLU N N 218 114.400 114.400 125.272 -10.872 17569 12535 1 20 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.583 -0.427 17569 12536 1 20 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.446 0.404 17569 12537 1 20 . 1 1 64 64 GLU H H 218 8.583 8.583 8.390 0.193 17569 12538 1 20 . 1 1 65 65 GLN N N 219 115.500 115.500 118.128 -2.628 17569 12539 1 20 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.638 -0.327 17569 12540 1 20 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.087 0.259 17569 12541 1 20 . 1 1 65 65 GLN H H 219 7.158 7.158 8.452 -1.294 17569 12542 1 20 . 1 1 66 66 CYS N N 220 122.600 122.600 118.021 4.579 17569 12543 1 20 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.371 -1.294 17569 12544 1 20 . 1 1 66 66 CYS CA C 220 57.529 57.529 57.023 0.506 17569 12545 1 20 . 1 1 66 66 CYS CB C 220 31.972 31.972 29.232 2.740 17569 12546 1 20 . 1 1 66 66 CYS H H 220 8.248 8.248 8.731 -0.483 17569 12547 1 20 . 1 1 67 67 ARG N N 221 130.363 130.363 124.501 5.862 17569 12548 1 20 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.361 -0.294 17569 12549 1 20 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.128 -3.112 17569 12550 1 20 . 1 1 67 67 ARG H H 221 9.145 9.145 8.928 0.217 17569 12551 1 20 . 1 1 68 68 TRP N N 222 124.200 124.200 120.639 3.561 17569 12552 1 20 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.659 -0.223 17569 12553 1 20 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.215 0.865 17569 12554 1 20 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.531 0.663 17569 12555 1 20 . 1 1 68 68 TRP H H 222 9.689 9.689 8.311 1.378 17569 12556 1 20 . 1 1 69 69 CYS N N 223 116.297 116.297 110.592 5.705 17569 12557 1 20 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.028 0.063 17569 12558 1 20 . 1 1 69 69 CYS CA C 223 59.102 59.102 55.900 3.202 17569 12559 1 20 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.523 4.815 17569 12560 1 20 . 1 1 69 69 CYS H H 223 8.822 8.822 7.690 1.132 17569 12561 1 20 . 1 1 70 70 ALA N N 224 123.112 123.112 124.138 -1.026 17569 12562 1 20 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.316 0.090 17569 12563 1 20 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.087 -0.236 17569 12564 1 20 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.764 -0.044 17569 12565 1 20 . 1 1 70 70 ALA H H 224 8.787 8.787 8.214 0.573 17569 12566 1 20 . 1 1 71 71 GLU N N 225 118.300 118.300 120.869 -2.569 17569 12567 1 20 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.560 0.748 17569 12568 1 20 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.949 -2.650 17569 12569 1 20 . 1 1 71 71 GLU H H 225 8.541 8.541 7.993 0.548 17569 12570 1 20 . 1 1 72 72 GLY N N 226 111.995 111.995 111.660 0.335 17569 12571 1 20 . 1 1 72 72 GLY CA C 226 44.403 44.403 45.229 -0.826 17569 12572 1 20 . 1 1 72 72 GLY H H 226 9.837 9.837 8.530 1.307 17569 12573 1 20 . 1 1 73 73 GLY N N 227 106.600 106.600 108.322 -1.722 17569 12574 1 20 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.569 0.402 17569 12575 1 20 . 1 1 73 73 GLY H H 227 7.772 7.772 8.426 -0.654 17569 12576 1 20 . 1 1 74 74 ASN N N 228 124.277 124.277 122.572 1.705 17569 12577 1 20 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.929 0.152 17569 12578 1 20 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.189 -0.089 17569 12579 1 20 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.906 -0.821 17569 12580 1 20 . 1 1 74 74 ASN H H 228 8.876 8.876 8.485 0.391 17569 12581 1 20 . 1 1 75 75 LEU N N 229 123.050 123.050 123.517 -0.467 17569 12582 1 20 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.879 -0.279 17569 12583 1 20 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.706 0.656 17569 12584 1 20 . 1 1 75 75 LEU CB C 229 43.500 43.500 45.558 -2.058 17569 12585 1 20 . 1 1 75 75 LEU H H 229 8.901 8.901 8.450 0.451 17569 12586 1 20 . 1 1 76 76 ILE N N 230 123.552 123.552 123.049 0.503 17569 12587 1 20 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.335 0.150 17569 12588 1 20 . 1 1 76 76 ILE CA C 230 60.700 60.700 59.977 0.723 17569 12589 1 20 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.118 -0.719 17569 12590 1 20 . 1 1 76 76 ILE H H 230 9.406 9.406 8.823 0.583 17569 12591 1 20 . 1 1 77 77 CYS N N 231 124.637 124.637 125.278 -0.641 17569 12592 1 20 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.194 -0.319 17569 12593 1 20 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.266 0.093 17569 12594 1 20 . 1 1 77 77 CYS CB C 231 29.434 29.434 27.925 1.509 17569 12595 1 20 . 1 1 77 77 CYS H H 231 8.809 8.809 8.637 0.172 17569 12596 1 20 . 1 1 78 78 CYS N N 232 125.697 125.697 122.232 3.465 17569 12597 1 20 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.845 -0.561 17569 12598 1 20 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.300 3.584 17569 12599 1 20 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.995 1.175 17569 12600 1 20 . 1 1 78 78 CYS H H 232 8.579 8.579 8.578 0.002 17569 12601 1 20 . 1 1 79 79 ASP N N 233 123.600 123.600 124.467 -0.867 17569 12602 1 20 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.694 0.063 17569 12603 1 20 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.464 2.525 17569 12604 1 20 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.868 0.761 17569 12605 1 20 . 1 1 79 79 ASP H H 233 8.577 8.577 8.431 0.146 17569 12606 1 20 . 1 1 80 80 PHE N N 234 122.100 122.100 116.625 5.475 17569 12607 1 20 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.622 -0.096 17569 12608 1 20 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.450 1.459 17569 12609 1 20 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.129 1.720 17569 12610 1 20 . 1 1 80 80 PHE H H 234 10.432 10.432 7.727 2.705 17569 12611 1 20 . 1 1 81 81 CYS N N 235 124.300 124.300 117.868 6.432 17569 12612 1 20 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.666 0.490 17569 12613 1 20 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.115 -0.070 17569 12614 1 20 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.852 3.555 17569 12615 1 20 . 1 1 81 81 CYS H H 235 8.476 8.476 8.120 0.356 17569 12616 1 20 . 1 1 82 82 HIS N N 236 112.598 112.598 118.630 -6.032 17569 12617 1 20 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.136 0.847 17569 12618 1 20 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.406 -1.008 17569 12619 1 20 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.977 2.280 17569 12620 1 20 . 1 1 82 82 HIS H H 236 6.699 6.699 8.444 -1.745 17569 12621 1 20 . 1 1 83 83 ASN N N 237 123.600 123.600 118.708 4.892 17569 12622 1 20 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.809 -0.008 17569 12623 1 20 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.132 2.484 17569 12624 1 20 . 1 1 83 83 ASN H H 237 9.097 9.097 7.865 1.232 17569 12625 1 20 . 1 1 84 84 ALA N N 238 122.000 122.000 124.367 -2.367 17569 12626 1 20 . 1 1 84 84 ALA HA H 238 5.409 5.409 4.950 0.459 17569 12627 1 20 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.216 0.148 17569 12628 1 20 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.780 3.290 17569 12629 1 20 . 1 1 84 84 ALA H H 238 9.885 9.885 8.574 1.311 17569 12630 1 20 . 1 1 85 85 PHE N N 239 116.707 116.707 122.434 -5.727 17569 12631 1 20 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.132 0.896 17569 12632 1 20 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.139 0.078 17569 12633 1 20 . 1 1 85 85 PHE CB C 239 44.664 44.664 41.908 2.756 17569 12634 1 20 . 1 1 85 85 PHE H H 239 9.450 9.450 8.454 0.996 17569 12635 1 20 . 1 1 86 86 CYS N N 240 126.682 126.682 124.656 2.026 17569 12636 1 20 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.699 0.923 17569 12637 1 20 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.773 -0.431 17569 12638 1 20 . 1 1 86 86 CYS CB C 240 32.257 32.257 28.834 3.424 17569 12639 1 20 . 1 1 86 86 CYS H H 240 11.309 11.309 9.507 1.802 17569 12640 1 20 . 1 1 87 87 LYS N N 241 117.865 117.865 123.388 -5.523 17569 12641 1 20 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.910 -0.061 17569 12642 1 20 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.314 -0.244 17569 12643 1 20 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.317 0.481 17569 12644 1 20 . 1 1 87 87 LYS H H 241 8.230 8.230 8.936 -0.706 17569 12645 1 20 . 1 1 88 88 LYS N N 242 117.949 117.949 119.045 -1.096 17569 12646 1 20 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.101 -0.123 17569 12647 1 20 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.019 1.351 17569 12648 1 20 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.030 0.286 17569 12649 1 20 . 1 1 88 88 LYS H H 242 7.945 7.945 8.513 -0.568 17569 12650 1 20 . 1 1 89 89 CYS N N 243 125.305 125.305 117.182 8.123 17569 12651 1 20 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.238 -0.496 17569 12652 1 20 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.273 2.554 17569 12653 1 20 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.079 1.162 17569 12654 1 20 . 1 1 89 89 CYS H H 243 9.297 9.297 7.683 1.614 17569 12655 1 20 . 1 1 90 90 ILE N N 244 119.687 119.687 121.718 -2.031 17569 12656 1 20 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.077 -0.470 17569 12657 1 20 . 1 1 90 90 ILE CA C 244 65.950 65.950 64.045 1.905 17569 12658 1 20 . 1 1 90 90 ILE H H 244 7.997 7.997 7.698 0.299 17569 12659 1 20 . 1 1 91 91 LEU N N 245 120.280 120.280 121.375 -1.095 17569 12660 1 20 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.362 -0.677 17569 12661 1 20 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.612 0.623 17569 12662 1 20 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.909 0.049 17569 12663 1 20 . 1 1 91 91 LEU H H 245 8.810 8.810 8.834 -0.024 17569 12664 1 20 . 1 1 92 92 ARG N N 246 116.901 116.901 117.386 -0.485 17569 12665 1 20 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.080 -0.263 17569 12666 1 20 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.504 0.476 17569 12667 1 20 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.185 0.415 17569 12668 1 20 . 1 1 92 92 ARG H H 246 8.086 8.086 7.643 0.443 17569 12669 1 20 . 1 1 93 93 ASN N N 247 111.200 111.200 115.841 -4.641 17569 12670 1 20 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.485 0.118 17569 12671 1 20 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.822 0.986 17569 12672 1 20 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.999 3.485 17569 12673 1 20 . 1 1 93 93 ASN H H 247 7.136 7.136 8.131 -0.995 17569 12674 1 20 . 1 1 94 94 LEU N N 248 118.807 118.807 117.216 1.591 17569 12675 1 20 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.419 0.395 17569 12676 1 20 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.047 0.142 17569 12677 1 20 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.754 -0.056 17569 12678 1 20 . 1 1 94 94 LEU H H 248 8.515 8.515 7.992 0.523 17569 12679 1 20 . 1 1 95 95 GLY N N 249 108.000 108.000 106.123 1.877 17569 12680 1 20 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.694 -0.067 17569 12681 1 20 . 1 1 95 95 GLY H H 249 7.955 7.955 7.794 0.161 17569 12682 1 20 . 1 1 96 96 ARG N N 250 117.797 117.797 121.800 -4.003 17569 12683 1 20 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.228 -0.385 17569 12684 1 20 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.379 0.303 17569 12685 1 20 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.131 -0.271 17569 12686 1 20 . 1 1 96 96 ARG H H 250 8.559 8.559 8.671 -0.112 17569 12687 1 20 . 1 1 97 97 LYS N N 251 120.900 120.900 119.704 1.196 17569 12688 1 20 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.035 0.121 17569 12689 1 20 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.603 -0.447 17569 12690 1 20 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.794 -0.434 17569 12691 1 20 . 1 1 97 97 LYS H H 251 8.655 8.655 8.556 0.099 17569 12692 1 20 . 1 1 98 98 GLU N N 252 122.000 122.000 118.974 3.026 17569 12693 1 20 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.070 0.281 17569 12694 1 20 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.238 -0.656 17569 12695 1 20 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.494 -1.095 17569 12696 1 20 . 1 1 98 98 GLU H H 252 7.705 7.705 8.364 -0.659 17569 12697 1 20 . 1 1 99 99 LEU N N 253 117.400 117.400 120.830 -3.430 17569 12698 1 20 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.793 0.124 17569 12699 1 20 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.055 -0.057 17569 12700 1 20 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.927 -0.445 17569 12701 1 20 . 1 1 99 99 LEU H H 253 7.285 7.285 7.698 -0.413 17569 12702 1 20 . 1 1 100 100 SER N N 254 112.100 112.100 114.931 -2.831 17569 12703 1 20 . 1 1 100 100 SER HA H 254 4.107 4.107 4.085 0.022 17569 12704 1 20 . 1 1 100 100 SER CA C 254 61.603 61.603 61.939 -0.336 17569 12705 1 20 . 1 1 100 100 SER CB C 254 62.622 62.622 63.098 -0.476 17569 12706 1 20 . 1 1 100 100 SER H H 254 8.326 8.326 7.902 0.424 17569 12707 1 20 . 1 1 101 101 THR N N 255 118.151 118.151 119.218 -1.067 17569 12708 1 20 . 1 1 101 101 THR HA H 255 4.026 4.026 4.020 0.006 17569 12709 1 20 . 1 1 101 101 THR CA C 255 66.261 66.261 66.466 -0.205 17569 12710 1 20 . 1 1 101 101 THR CB C 255 68.735 68.735 68.820 -0.085 17569 12711 1 20 . 1 1 101 101 THR H H 255 7.972 7.972 7.608 0.364 17569 12712 1 20 . 1 1 102 102 ILE N N 256 120.100 120.100 122.572 -2.472 17569 12713 1 20 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.605 -0.142 17569 12714 1 20 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.806 -0.032 17569 12715 1 20 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.443 0.298 17569 12716 1 20 . 1 1 102 102 ILE H H 256 7.868 7.868 8.380 -0.512 17569 12717 1 20 . 1 1 103 103 MET N N 257 114.876 114.876 116.013 -1.137 17569 12718 1 20 . 1 1 103 103 MET HA H 257 4.211 4.211 4.061 0.150 17569 12719 1 20 . 1 1 103 103 MET CA C 257 55.691 55.691 58.312 -2.621 17569 12720 1 20 . 1 1 103 103 MET CB C 257 32.000 32.000 32.613 -0.613 17569 12721 1 20 . 1 1 103 103 MET H H 257 7.606 7.606 7.300 0.306 17569 12722 1 20 . 1 1 104 104 ASP N N 258 119.976 119.976 118.396 1.580 17569 12723 1 20 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.729 -0.191 17569 12724 1 20 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.650 1.262 17569 12725 1 20 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.808 0.692 17569 12726 1 20 . 1 1 104 104 ASP H H 258 7.444 7.444 7.604 -0.160 17569 12727 1 20 . 1 1 105 105 GLU N N 259 124.388 124.388 121.728 2.660 17569 12728 1 20 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.520 -0.233 17569 12729 1 20 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.531 3.040 17569 12730 1 20 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.411 0.131 17569 12731 1 20 . 1 1 105 105 GLU H H 259 8.559 8.559 8.232 0.327 17569 12732 1 20 . 1 1 106 106 ASN N N 260 117.201 117.201 118.006 -0.805 17569 12733 1 20 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.425 0.317 17569 12734 1 20 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.061 -0.318 17569 12735 1 20 . 1 1 106 106 ASN CB C 260 38.918 38.918 36.628 2.290 17569 12736 1 20 . 1 1 106 106 ASN H H 260 8.673 8.673 8.678 -0.005 17569 12737 1 20 . 1 1 107 107 ASN N N 261 117.900 117.900 113.388 4.512 17569 12738 1 20 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.278 0.707 17569 12739 1 20 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.669 -2.367 17569 12740 1 20 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.783 2.831 17569 12741 1 20 . 1 1 107 107 ASN H H 261 7.956 7.956 8.667 -0.711 17569 12742 1 20 . 1 1 108 108 GLN N N 262 121.500 121.500 115.135 6.365 17569 12743 1 20 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.111 0.497 17569 12744 1 20 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.650 1.126 17569 12745 1 20 . 1 1 108 108 GLN CB C 262 30.558 30.558 30.037 0.521 17569 12746 1 20 . 1 1 108 108 GLN H H 262 8.493 8.493 7.741 0.752 17569 12747 1 20 . 1 1 109 109 TRP N N 263 128.056 128.056 124.001 4.055 17569 12748 1 20 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.708 0.263 17569 12749 1 20 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.757 0.340 17569 12750 1 20 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.452 1.041 17569 12751 1 20 . 1 1 109 109 TRP H H 263 10.497 10.497 8.224 2.273 17569 12752 1 20 . 1 1 110 110 TYR N N 264 126.600 126.600 126.243 0.357 17569 12753 1 20 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.241 0.161 17569 12754 1 20 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.930 -3.259 17569 12755 1 20 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.690 -0.682 17569 12756 1 20 . 1 1 110 110 TYR H H 264 7.545 7.545 8.041 -0.496 17569 12757 1 20 . 1 1 111 111 CYS N N 265 124.622 124.622 115.294 9.328 17569 12758 1 20 . 1 1 111 111 CYS H H 265 8.586 8.586 8.626 -0.040 17569 12759 1 20 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.844 -0.652 17569 12760 1 20 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.575 1.140 17569 12761 1 20 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.679 1.241 17569 12762 1 20 . 1 1 113 113 ILE N N 267 119.504 119.504 119.870 -0.366 17569 12763 1 20 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.725 -0.775 17569 12764 1 20 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.961 0.289 17569 12765 1 20 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.585 -3.052 17569 12766 1 20 . 1 1 113 113 ILE H H 267 9.160 9.160 7.525 1.635 17569 12767 1 20 . 1 1 114 114 CYS N N 268 124.100 124.100 118.379 5.721 17569 12768 1 20 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.179 -0.365 17569 12769 1 20 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.715 3.585 17569 12770 1 20 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.095 2.626 17569 12771 1 20 . 1 1 114 114 CYS H H 268 7.818 7.818 8.253 -0.435 17569 12772 1 20 . 1 1 115 115 HIS N N 269 117.127 117.127 111.251 5.876 17569 12773 1 20 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.657 0.472 17569 12774 1 20 . 1 1 115 115 HIS CA C 269 52.161 52.161 52.977 -0.816 17569 12775 1 20 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.918 2.274 17569 12776 1 20 . 1 1 115 115 HIS H H 269 8.953 8.953 7.779 1.174 17569 12777 1 20 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.440 0.502 17569 12778 1 20 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.455 -0.147 17569 12779 1 20 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.651 0.991 17569 12780 1 20 . 1 1 117 117 GLU N N 271 123.504 123.504 123.022 0.482 17569 12781 1 20 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.443 -0.423 17569 12782 1 20 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.099 3.769 17569 12783 1 20 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.843 -1.792 17569 12784 1 20 . 1 1 117 117 GLU H H 271 8.402 8.402 8.107 0.295 17569 12785 1 20 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.553 -0.011 17569 12786 1 20 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.689 1.670 17569 12787 1 20 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.361 0.781 17569 12788 1 20 . 1 1 119 119 LEU N N 273 112.296 112.296 113.947 -1.651 17569 12789 1 20 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.930 -0.456 17569 12790 1 20 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.538 0.005 17569 12791 1 20 . 1 1 119 119 LEU H H 273 8.090 8.090 7.431 0.659 17569 12792 1 20 . 1 1 120 120 LEU N N 274 121.388 121.388 123.500 -2.112 17569 12793 1 20 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.917 0.110 17569 12794 1 20 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.826 -0.525 17569 12795 1 20 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.420 0.680 17569 12796 1 20 . 1 1 120 120 LEU H H 274 7.823 7.823 8.465 -0.642 17569 12797 1 20 . 1 1 121 121 ASP N N 275 118.600 118.600 119.204 -0.604 17569 12798 1 20 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.375 0.166 17569 12799 1 20 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.461 0.242 17569 12800 1 20 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.436 -0.993 17569 12801 1 20 . 1 1 121 121 ASP H H 275 8.694 8.694 8.536 0.158 17569 12802 1 20 . 1 1 122 122 LEU N N 276 123.192 123.192 120.715 2.477 17569 12803 1 20 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.007 0.385 17569 12804 1 20 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.991 -0.020 17569 12805 1 20 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.075 0.466 17569 12806 1 20 . 1 1 122 122 LEU H H 276 8.013 8.013 7.328 0.685 17569 12807 1 20 . 1 1 123 123 VAL N N 277 126.898 126.898 119.124 7.774 17569 12808 1 20 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.676 0.179 17569 12809 1 20 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.959 -0.296 17569 12810 1 20 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.396 0.662 17569 12811 1 20 . 1 1 123 123 VAL H H 277 8.781 8.781 8.140 0.641 17569 12812 1 20 . 1 1 124 124 THR N N 278 117.500 117.500 116.964 0.536 17569 12813 1 20 . 1 1 124 124 THR HA H 278 4.030 4.030 3.956 0.074 17569 12814 1 20 . 1 1 124 124 THR CA C 278 66.589 66.589 66.643 -0.054 17569 12815 1 20 . 1 1 124 124 THR CB C 278 68.410 68.410 68.100 0.310 17569 12816 1 20 . 1 1 124 124 THR H H 278 8.722 8.722 8.314 0.408 17569 12817 1 20 . 1 1 125 125 ALA N N 279 124.700 124.700 123.880 0.820 17569 12818 1 20 . 1 1 125 125 ALA HA H 279 4.261 4.261 3.901 0.360 17569 12819 1 20 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.372 -0.076 17569 12820 1 20 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.877 0.073 17569 12821 1 20 . 1 1 125 125 ALA H H 279 8.239 8.239 7.934 0.305 17569 12822 1 20 . 1 1 126 126 CYS N N 280 119.276 119.276 117.619 1.657 17569 12823 1 20 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.860 0.254 17569 12824 1 20 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.479 -1.376 17569 12825 1 20 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.129 -0.633 17569 12826 1 20 . 1 1 126 126 CYS H H 280 8.128 8.128 7.789 0.339 17569 12827 1 20 . 1 1 127 127 ASN N N 281 118.000 118.000 118.460 -0.460 17569 12828 1 20 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.504 0.056 17569 12829 1 20 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.917 -0.778 17569 12830 1 20 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.078 -1.113 17569 12831 1 20 . 1 1 127 127 ASN H H 281 8.725 8.725 8.012 0.713 17569 12832 1 20 . 1 1 128 128 SER N N 282 116.601 116.601 116.570 0.031 17569 12833 1 20 . 1 1 128 128 SER HA H 282 4.363 4.363 4.167 0.196 17569 12834 1 20 . 1 1 128 128 SER CA C 282 61.899 61.899 61.069 0.830 17569 12835 1 20 . 1 1 128 128 SER CB C 282 62.630 62.630 62.994 -0.364 17569 12836 1 20 . 1 1 128 128 SER H H 282 8.542 8.542 7.652 0.890 17569 12837 1 20 . 1 1 129 129 VAL N N 283 123.272 123.272 121.597 1.675 17569 12838 1 20 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.585 0.092 17569 12839 1 20 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.539 -0.031 17569 12840 1 20 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.016 0.202 17569 12841 1 20 . 1 1 129 129 VAL H H 283 7.990 7.990 7.806 0.184 17569 12842 1 20 . 1 1 130 130 PHE N N 284 118.594 118.594 119.164 -0.570 17569 12843 1 20 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.305 -0.292 17569 12844 1 20 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.055 2.445 17569 12845 1 20 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.163 0.833 17569 12846 1 20 . 1 1 130 130 PHE H H 284 8.190 8.190 7.993 0.197 17569 12847 1 20 . 1 1 131 131 GLU N N 285 120.905 120.905 120.501 0.404 17569 12848 1 20 . 1 1 131 131 GLU HA H 285 4.205 4.205 3.962 0.243 17569 12849 1 20 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.080 -0.866 17569 12850 1 20 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.489 0.011 17569 12851 1 20 . 1 1 131 131 GLU H H 285 8.699 8.699 8.892 -0.193 17569 12852 1 20 . 1 1 132 132 ASN N N 286 117.997 117.997 118.263 -0.266 17569 12853 1 20 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.670 -0.075 17569 12854 1 20 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.317 -0.702 17569 12855 1 20 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.642 0.210 17569 12856 1 20 . 1 1 132 132 ASN H H 286 8.082 8.082 7.923 0.159 17569 12857 1 20 . 1 1 133 133 LEU N N 287 120.800 120.800 122.485 -1.685 17569 12858 1 20 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.326 -0.209 17569 12859 1 20 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.592 -0.794 17569 12860 1 20 . 1 1 133 133 LEU H H 287 7.904 7.904 8.500 -0.596 17569 12861 1 20 . 1 1 134 134 GLU N N 288 118.200 118.200 118.825 -0.625 17569 12862 1 20 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.880 0.199 17569 12863 1 20 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.928 -0.931 17569 12864 1 20 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.483 -0.241 17569 12865 1 20 . 1 1 134 134 GLU H H 288 8.157 8.157 8.727 -0.570 17569 12866 1 20 . 1 1 135 135 GLN N N 289 117.400 117.400 118.645 -1.245 17569 12867 1 20 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.117 0.057 17569 12868 1 20 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.526 -0.537 17569 12869 1 20 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.471 -0.391 17569 12870 1 20 . 1 1 135 135 GLN H H 289 7.869 7.869 7.679 0.190 17569 12871 1 20 . 1 1 136 136 LEU N N 290 121.000 121.000 122.029 -1.029 17569 12872 1 20 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.835 0.338 17569 12873 1 20 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.831 -0.693 17569 12874 1 20 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.736 0.264 17569 12875 1 20 . 1 1 136 136 LEU H H 290 7.968 7.968 7.560 0.408 17569 12876 1 20 . 1 1 137 137 LEU N N 291 118.900 118.900 117.375 1.525 17569 12877 1 20 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.013 0.228 17569 12878 1 20 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.310 -0.950 17569 12879 1 20 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.117 -0.645 17569 12880 1 20 . 1 1 137 137 LEU H H 291 8.154 8.154 7.592 0.562 17569 12881 1 20 . 1 1 138 138 GLN N N 292 117.993 117.993 115.068 2.925 17569 12882 1 20 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.474 -0.202 17569 12883 1 20 . 1 1 138 138 GLN CA C 292 56.632 56.632 55.096 1.536 17569 12884 1 20 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.288 -0.704 17569 12885 1 20 . 1 1 138 138 GLN H H 292 7.896 7.896 7.470 0.426 17569 12886 1 20 . 1 1 139 139 GLN N N 293 118.889 118.889 119.710 -0.821 17569 12887 1 20 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.435 -0.166 17569 12888 1 20 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.932 0.522 17569 12889 1 20 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.663 -0.594 17569 12890 1 20 . 1 1 139 139 GLN H H 293 8.091 8.091 7.275 0.816 17569 12891 1 20 . 1 1 140 140 ASN N N 294 118.604 118.604 120.774 -2.170 17569 12892 1 20 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.827 -0.068 17569 12893 1 20 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.010 0.211 17569 12894 1 20 . 1 1 140 140 ASN CB C 294 38.733 38.733 37.355 1.378 17569 12895 1 20 . 1 1 140 140 ASN H H 294 8.273 8.273 8.393 -0.120 17569 12896 1 20 . 1 1 141 141 LYS N N 295 121.685 121.685 122.761 -1.076 17569 12897 1 20 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.500 -0.140 17569 12898 1 20 . 1 1 141 141 LYS CA C 295 56.173 56.173 57.023 -0.850 17569 12899 1 20 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.348 -0.813 17569 12900 1 20 . 1 1 141 141 LYS H H 295 8.089 8.089 8.397 -0.308 17569 12901 1 21 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.799 -0.412 17569 12902 1 21 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.077 0.368 17569 12903 1 21 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.267 -1.011 17569 12904 1 21 . 1 1 3 3 MET HA H 157 4.476 4.476 4.771 -0.295 17569 12905 1 21 . 1 1 3 3 MET CA C 157 55.401 55.401 55.250 0.151 17569 12906 1 21 . 1 1 4 4 ALA N N 158 124.828 124.828 124.757 0.071 17569 12907 1 21 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.539 -0.225 17569 12908 1 21 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.565 0.946 17569 12909 1 21 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.044 -1.043 17569 12910 1 21 . 1 1 4 4 ALA H H 158 8.382 8.382 8.239 0.143 17569 12911 1 21 . 1 1 5 5 ASP N N 159 119.418 119.418 121.728 -2.310 17569 12912 1 21 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.757 -0.167 17569 12913 1 21 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.107 0.029 17569 12914 1 21 . 1 1 5 5 ASP CB C 159 41.015 41.015 40.341 0.674 17569 12915 1 21 . 1 1 5 5 ASP H H 159 8.312 8.312 8.488 -0.176 17569 12916 1 21 . 1 1 6 6 LYS N N 160 121.604 121.604 121.165 0.439 17569 12917 1 21 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.590 -0.247 17569 12918 1 21 . 1 1 6 6 LYS H H 160 8.274 8.274 8.294 -0.020 17569 12919 1 21 . 1 1 7 7 ARG N N 161 121.611 121.611 121.897 -0.286 17569 12920 1 21 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.543 -0.216 17569 12921 1 21 . 1 1 7 7 ARG H H 161 8.430 8.430 8.699 -0.269 17569 12922 1 21 . 1 1 8 8 GLY N N 162 109.606 109.606 109.097 0.509 17569 12923 1 21 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.658 -0.611 17569 12924 1 21 . 1 1 8 8 GLY H H 162 8.473 8.473 8.001 0.472 17569 12925 1 21 . 1 1 9 9 ASP N N 163 120.187 120.187 118.896 1.291 17569 12926 1 21 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.782 -0.133 17569 12927 1 21 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.250 0.901 17569 12928 1 21 . 1 1 9 9 ASP H H 163 8.296 8.296 8.073 0.223 17569 12929 1 21 . 1 1 10 10 GLY N N 164 108.816 108.816 112.338 -3.522 17569 12930 1 21 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.080 0.288 17569 12931 1 21 . 1 1 10 10 GLY H H 164 8.458 8.458 8.469 -0.011 17569 12932 1 21 . 1 1 11 11 LEU N N 165 121.195 121.195 123.060 -1.865 17569 12933 1 21 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.606 -0.290 17569 12934 1 21 . 1 1 11 11 LEU CA C 165 55.000 55.000 55.598 -0.598 17569 12935 1 21 . 1 1 11 11 LEU CB C 165 41.932 41.932 43.032 -1.100 17569 12936 1 21 . 1 1 11 11 LEU H H 165 8.137 8.137 8.129 0.008 17569 12937 1 21 . 1 1 12 12 HIS N N 166 119.387 119.387 123.891 -4.504 17569 12938 1 21 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.668 -0.013 17569 12939 1 21 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.632 0.637 17569 12940 1 21 . 1 1 12 12 HIS CB C 166 30.697 30.697 30.265 0.432 17569 12941 1 21 . 1 1 12 12 HIS H H 166 8.270 8.270 8.208 0.062 17569 12942 1 21 . 1 1 13 13 GLY N N 167 109.899 109.899 113.435 -3.536 17569 12943 1 21 . 1 1 13 13 GLY CA C 167 45.105 45.105 45.279 -0.174 17569 12944 1 21 . 1 1 13 13 GLY H H 167 8.276 8.276 8.570 -0.294 17569 12945 1 21 . 1 1 14 14 ILE N N 168 119.597 119.597 122.211 -2.614 17569 12946 1 21 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.314 0.009 17569 12947 1 21 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.807 0.793 17569 12948 1 21 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.098 -2.148 17569 12949 1 21 . 1 1 14 14 ILE H H 168 7.962 7.962 8.089 -0.127 17569 12950 1 21 . 1 1 15 15 VAL N N 169 127.578 127.578 125.762 1.816 17569 12951 1 21 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.070 0.210 17569 12952 1 21 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.483 -1.166 17569 12953 1 21 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.510 2.892 17569 12954 1 21 . 1 1 15 15 VAL H H 169 9.011 9.011 8.406 0.605 17569 12955 1 21 . 1 1 16 16 SER N N 170 118.596 118.596 121.896 -3.300 17569 12956 1 21 . 1 1 16 16 SER HA H 170 5.140 5.140 4.749 0.391 17569 12957 1 21 . 1 1 16 16 SER CA C 170 55.985 55.985 56.422 -0.437 17569 12958 1 21 . 1 1 16 16 SER CB C 170 65.261 65.261 65.635 -0.374 17569 12959 1 21 . 1 1 16 16 SER H H 170 8.242 8.242 7.675 0.567 17569 12960 1 21 . 1 1 17 17 CYS N N 171 123.783 123.783 122.918 0.865 17569 12961 1 21 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.137 0.044 17569 12962 1 21 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.474 -0.630 17569 12963 1 21 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.804 2.569 17569 12964 1 21 . 1 1 17 17 CYS H H 171 8.894 8.894 8.508 0.386 17569 12965 1 21 . 1 1 18 18 THR N N 172 121.703 121.703 117.825 3.878 17569 12966 1 21 . 1 1 18 18 THR HA H 172 4.386 4.386 4.070 0.316 17569 12967 1 21 . 1 1 18 18 THR CA C 172 64.667 64.667 64.638 0.029 17569 12968 1 21 . 1 1 18 18 THR CB C 172 69.498 69.498 68.623 0.875 17569 12969 1 21 . 1 1 18 18 THR H H 172 8.788 8.788 8.231 0.557 17569 12970 1 21 . 1 1 19 19 ALA N N 173 131.364 131.364 122.326 9.038 17569 12971 1 21 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.148 0.348 17569 12972 1 21 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.622 0.403 17569 12973 1 21 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.866 3.316 17569 12974 1 21 . 1 1 19 19 ALA H H 173 9.680 9.680 7.782 1.898 17569 12975 1 21 . 1 1 20 20 CYS N N 174 115.498 115.498 113.945 1.553 17569 12976 1 21 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.566 0.402 17569 12977 1 21 . 1 1 20 20 CYS CA C 174 58.094 58.094 58.786 -0.692 17569 12978 1 21 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.590 4.654 17569 12979 1 21 . 1 1 20 20 CYS H H 174 8.470 8.470 7.535 0.935 17569 12980 1 21 . 1 1 21 21 GLY N N 175 112.464 112.464 108.634 3.830 17569 12981 1 21 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.015 0.691 17569 12982 1 21 . 1 1 21 21 GLY H H 175 7.884 7.884 7.969 -0.085 17569 12983 1 21 . 1 1 22 22 GLN N N 176 121.784 121.784 117.825 3.959 17569 12984 1 21 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.449 -0.073 17569 12985 1 21 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.324 1.967 17569 12986 1 21 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.853 -2.512 17569 12987 1 21 . 1 1 22 22 GLN H H 176 8.723 8.723 7.847 0.876 17569 12988 1 21 . 1 1 23 23 GLN N N 177 122.900 122.900 122.859 0.041 17569 12989 1 21 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.268 0.262 17569 12990 1 21 . 1 1 23 23 GLN CA C 177 56.550 56.550 57.080 -0.530 17569 12991 1 21 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.199 -0.739 17569 12992 1 21 . 1 1 23 23 GLN H H 177 8.721 8.721 8.575 0.146 17569 12993 1 21 . 1 1 24 24 VAL N N 178 121.000 121.000 124.490 -3.490 17569 12994 1 21 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.879 0.645 17569 12995 1 21 . 1 1 24 24 VAL CA C 178 59.877 59.877 62.657 -2.780 17569 12996 1 21 . 1 1 24 24 VAL H H 178 8.689 8.689 8.040 0.649 17569 12997 1 21 . 1 1 25 25 ASN N N 179 121.392 121.392 122.309 -0.917 17569 12998 1 21 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.264 0.612 17569 12999 1 21 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.258 -2.109 17569 13000 1 21 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.103 -0.126 17569 13001 1 21 . 1 1 25 25 ASN H H 179 8.635 8.635 8.423 0.212 17569 13002 1 21 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.649 -0.189 17569 13003 1 21 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.681 0.317 17569 13004 1 21 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.847 -1.454 17569 13005 1 21 . 1 1 28 28 GLN N N 182 119.300 119.300 122.285 -2.985 17569 13006 1 21 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.291 0.227 17569 13007 1 21 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.702 -2.360 17569 13008 1 21 . 1 1 28 28 GLN CB C 182 30.350 30.350 29.955 0.395 17569 13009 1 21 . 1 1 28 28 GLN H H 182 7.494 7.494 8.171 -0.677 17569 13010 1 21 . 1 1 29 29 LYS N N 183 124.516 124.516 126.028 -1.512 17569 13011 1 21 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.405 -0.483 17569 13012 1 21 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.182 2.130 17569 13013 1 21 . 1 1 29 29 LYS CB C 183 32.286 32.286 33.419 -1.133 17569 13014 1 21 . 1 1 29 29 LYS H H 183 8.779 8.779 8.333 0.446 17569 13015 1 21 . 1 1 30 30 ASP N N 184 116.500 116.500 120.785 -4.285 17569 13016 1 21 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.458 0.001 17569 13017 1 21 . 1 1 30 30 ASP CA C 184 54.536 54.536 55.651 -1.115 17569 13018 1 21 . 1 1 30 30 ASP CB C 184 39.971 39.971 39.709 0.262 17569 13019 1 21 . 1 1 30 30 ASP H H 184 8.556 8.556 8.831 -0.275 17569 13020 1 21 . 1 1 31 31 SER N N 185 111.505 111.505 112.666 -1.161 17569 13021 1 21 . 1 1 31 31 SER HA H 185 4.695 4.695 4.695 0.000 17569 13022 1 21 . 1 1 31 31 SER CA C 185 59.747 59.747 58.172 1.575 17569 13023 1 21 . 1 1 31 31 SER CB C 185 65.198 65.198 63.900 1.298 17569 13024 1 21 . 1 1 31 31 SER H H 185 7.933 7.933 8.561 -0.628 17569 13025 1 21 . 1 1 32 32 ILE N N 186 113.394 113.394 116.609 -3.215 17569 13026 1 21 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.907 -0.021 17569 13027 1 21 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.071 -0.492 17569 13028 1 21 . 1 1 32 32 ILE CB C 186 41.812 41.812 41.585 0.227 17569 13029 1 21 . 1 1 32 32 ILE H H 186 7.105 7.105 7.527 -0.422 17569 13030 1 21 . 1 1 33 33 TYR N N 187 119.098 119.098 120.514 -1.416 17569 13031 1 21 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.244 -0.721 17569 13032 1 21 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.298 0.962 17569 13033 1 21 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.614 1.826 17569 13034 1 21 . 1 1 33 33 TYR H H 187 8.954 8.954 7.708 1.246 17569 13035 1 21 . 1 1 34 34 ARG N N 188 118.502 118.502 122.496 -3.994 17569 13036 1 21 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.756 -0.119 17569 13037 1 21 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.225 -1.473 17569 13038 1 21 . 1 1 34 34 ARG CB C 188 31.251 31.251 29.931 1.320 17569 13039 1 21 . 1 1 34 34 ARG H H 188 8.412 8.412 8.640 -0.228 17569 13040 1 21 . 1 1 35 35 HIS N N 189 126.596 126.596 127.190 -0.594 17569 13041 1 21 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.885 -0.293 17569 13042 1 21 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.186 -0.465 17569 13043 1 21 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.112 1.360 17569 13044 1 21 . 1 1 35 35 HIS H H 189 9.813 9.813 9.114 0.699 17569 13045 1 21 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.659 -0.361 17569 13046 1 21 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.876 0.399 17569 13047 1 21 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.362 0.489 17569 13048 1 21 . 1 1 37 37 SER N N 191 110.003 110.003 113.865 -3.862 17569 13049 1 21 . 1 1 37 37 SER HA H 191 4.918 4.918 4.305 0.613 17569 13050 1 21 . 1 1 37 37 SER CA C 191 59.031 59.031 60.958 -1.927 17569 13051 1 21 . 1 1 37 37 SER CB C 191 65.104 65.104 63.301 1.803 17569 13052 1 21 . 1 1 37 37 SER H H 191 8.934 8.934 8.532 0.402 17569 13053 1 21 . 1 1 38 38 LEU N N 192 120.959 120.959 113.821 7.138 17569 13054 1 21 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.885 -0.756 17569 13055 1 21 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.313 1.833 17569 13056 1 21 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.508 1.488 17569 13057 1 21 . 1 1 38 38 LEU H H 192 8.649 8.649 7.052 1.597 17569 13058 1 21 . 1 1 39 39 GLN N N 193 108.600 108.600 119.063 -10.463 17569 13059 1 21 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.091 -0.186 17569 13060 1 21 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.633 0.181 17569 13061 1 21 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.406 -1.372 17569 13062 1 21 . 1 1 39 39 GLN H H 193 8.465 8.465 7.862 0.603 17569 13063 1 21 . 1 1 40 40 VAL N N 194 105.325 105.325 117.181 -11.856 17569 13064 1 21 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.515 0.035 17569 13065 1 21 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.509 -0.868 17569 13066 1 21 . 1 1 40 40 VAL H H 194 6.256 6.256 7.853 -1.597 17569 13067 1 21 . 1 1 41 41 LEU N N 195 123.100 123.100 122.121 0.979 17569 13068 1 21 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.763 0.053 17569 13069 1 21 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.527 3.655 17569 13070 1 21 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.814 0.756 17569 13071 1 21 . 1 1 41 41 LEU H H 195 9.154 9.154 8.521 0.633 17569 13072 1 21 . 1 1 42 42 ILE N N 196 124.396 124.396 117.182 7.214 17569 13073 1 21 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.821 1.531 17569 13074 1 21 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.238 0.992 17569 13075 1 21 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.830 1.440 17569 13076 1 21 . 1 1 42 42 ILE H H 196 9.766 9.766 7.816 1.950 17569 13077 1 21 . 1 1 43 43 CYS N N 197 121.500 121.500 115.034 6.466 17569 13078 1 21 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.035 0.227 17569 13079 1 21 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.152 0.551 17569 13080 1 21 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.405 1.895 17569 13081 1 21 . 1 1 43 43 CYS H H 197 9.882 9.882 8.251 1.631 17569 13082 1 21 . 1 1 44 44 LYS N N 198 117.995 117.995 122.047 -4.052 17569 13083 1 21 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.163 -0.174 17569 13084 1 21 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.061 -0.401 17569 13085 1 21 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.183 0.517 17569 13086 1 21 . 1 1 44 44 LYS H H 198 8.089 8.089 8.543 -0.454 17569 13087 1 21 . 1 1 45 45 ASN N N 199 119.200 119.200 117.239 1.961 17569 13088 1 21 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.619 -0.105 17569 13089 1 21 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.697 1.022 17569 13090 1 21 . 1 1 45 45 ASN CB C 199 38.167 38.167 37.949 0.218 17569 13091 1 21 . 1 1 45 45 ASN H H 199 8.356 8.356 8.618 -0.262 17569 13092 1 21 . 1 1 46 46 CYS N N 200 126.600 126.600 119.361 7.239 17569 13093 1 21 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.998 0.183 17569 13094 1 21 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.189 2.306 17569 13095 1 21 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.193 1.989 17569 13096 1 21 . 1 1 46 46 CYS H H 200 9.189 9.189 7.766 1.423 17569 13097 1 21 . 1 1 47 47 PHE N N 201 121.962 121.962 120.495 1.467 17569 13098 1 21 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.144 -0.274 17569 13099 1 21 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.200 2.069 17569 13100 1 21 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.489 0.678 17569 13101 1 21 . 1 1 47 47 PHE H H 201 8.826 8.826 8.421 0.405 17569 13102 1 21 . 1 1 48 48 LYS N N 202 117.400 117.400 120.256 -2.856 17569 13103 1 21 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.873 -0.175 17569 13104 1 21 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.223 -1.271 17569 13105 1 21 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.327 -0.785 17569 13106 1 21 . 1 1 48 48 LYS H H 202 8.512 8.512 7.912 0.600 17569 13107 1 21 . 1 1 49 49 TYR N N 203 120.400 120.400 120.387 0.013 17569 13108 1 21 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.227 0.187 17569 13109 1 21 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.633 -0.861 17569 13110 1 21 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.762 -0.316 17569 13111 1 21 . 1 1 49 49 TYR H H 203 8.133 8.133 7.758 0.375 17569 13112 1 21 . 1 1 50 50 TYR N N 204 121.783 121.783 117.977 3.806 17569 13113 1 21 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.640 -1.145 17569 13114 1 21 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.719 3.231 17569 13115 1 21 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.699 0.793 17569 13116 1 21 . 1 1 50 50 TYR H H 204 8.765 8.765 7.535 1.230 17569 13117 1 21 . 1 1 51 51 MET N N 205 110.800 110.800 115.087 -4.287 17569 13118 1 21 . 1 1 51 51 MET HA H 205 4.349 4.349 4.285 0.064 17569 13119 1 21 . 1 1 51 51 MET CA C 205 53.505 53.505 56.717 -3.212 17569 13120 1 21 . 1 1 51 51 MET CB C 205 30.384 30.384 32.458 -2.074 17569 13121 1 21 . 1 1 51 51 MET H H 205 7.771 7.771 8.528 -0.757 17569 13122 1 21 . 1 1 52 52 SER N N 206 116.800 116.800 113.812 2.988 17569 13123 1 21 . 1 1 52 52 SER HA H 206 3.919 3.919 4.392 -0.473 17569 13124 1 21 . 1 1 52 52 SER CA C 206 61.621 61.621 59.777 1.844 17569 13125 1 21 . 1 1 52 52 SER CB C 206 62.611 62.611 64.704 -2.093 17569 13126 1 21 . 1 1 52 52 SER H H 206 7.581 7.581 8.259 -0.678 17569 13127 1 21 . 1 1 53 53 ASP N N 207 117.400 117.400 121.678 -4.278 17569 13128 1 21 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.745 -0.173 17569 13129 1 21 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.729 -0.630 17569 13130 1 21 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.812 0.376 17569 13131 1 21 . 1 1 53 53 ASP H H 207 7.085 7.085 7.961 -0.876 17569 13132 1 21 . 1 1 54 54 ASP N N 208 119.405 119.405 122.715 -3.310 17569 13133 1 21 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.943 -0.554 17569 13134 1 21 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.456 0.444 17569 13135 1 21 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.534 -1.185 17569 13136 1 21 . 1 1 54 54 ASP H H 208 8.439 8.439 8.428 0.011 17569 13137 1 21 . 1 1 55 55 ILE N N 209 124.698 124.698 120.521 4.177 17569 13138 1 21 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.314 -0.314 17569 13139 1 21 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.823 1.455 17569 13140 1 21 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.166 1.125 17569 13141 1 21 . 1 1 55 55 ILE H H 209 8.128 8.128 8.429 -0.301 17569 13142 1 21 . 1 1 56 56 SER N N 210 126.703 126.703 120.628 6.075 17569 13143 1 21 . 1 1 56 56 SER HA H 210 4.365 4.365 4.769 -0.404 17569 13144 1 21 . 1 1 56 56 SER CA C 210 57.769 57.769 57.563 0.206 17569 13145 1 21 . 1 1 56 56 SER CB C 210 64.991 64.991 64.913 0.078 17569 13146 1 21 . 1 1 56 56 SER H H 210 8.815 8.815 8.437 0.378 17569 13147 1 21 . 1 1 57 57 ARG N N 211 116.885 116.885 120.126 -3.241 17569 13148 1 21 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.432 0.610 17569 13149 1 21 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.513 -1.113 17569 13150 1 21 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.646 2.638 17569 13151 1 21 . 1 1 57 57 ARG H H 211 8.365 8.365 8.478 -0.113 17569 13152 1 21 . 1 1 58 58 ASP N N 212 121.982 121.982 124.731 -2.749 17569 13153 1 21 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.502 0.113 17569 13154 1 21 . 1 1 58 58 ASP CA C 212 52.222 52.222 55.097 -2.875 17569 13155 1 21 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.288 -0.785 17569 13156 1 21 . 1 1 58 58 ASP H H 212 8.706 8.706 8.800 -0.094 17569 13157 1 21 . 1 1 59 59 SER N N 213 114.164 114.164 116.034 -1.870 17569 13158 1 21 . 1 1 59 59 SER HA H 213 4.212 4.212 4.172 0.040 17569 13159 1 21 . 1 1 59 59 SER CA C 213 60.840 60.840 60.631 0.209 17569 13160 1 21 . 1 1 59 59 SER CB C 213 62.714 62.714 63.336 -0.622 17569 13161 1 21 . 1 1 59 59 SER H H 213 8.687 8.687 8.830 -0.143 17569 13162 1 21 . 1 1 60 60 ASP N N 214 120.899 120.899 119.771 1.128 17569 13163 1 21 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.677 0.148 17569 13164 1 21 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.375 0.836 17569 13165 1 21 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.882 0.676 17569 13166 1 21 . 1 1 60 60 ASP H H 214 8.193 8.193 7.912 0.281 17569 13167 1 21 . 1 1 61 61 GLY N N 215 108.300 108.300 108.146 0.154 17569 13168 1 21 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.938 -0.541 17569 13169 1 21 . 1 1 61 61 GLY H H 215 8.234 8.234 8.076 0.158 17569 13170 1 21 . 1 1 62 62 MET N N 216 120.002 120.002 119.273 0.729 17569 13171 1 21 . 1 1 62 62 MET HA H 216 4.972 4.972 4.527 0.445 17569 13172 1 21 . 1 1 62 62 MET CA C 216 53.151 53.151 54.416 -1.265 17569 13173 1 21 . 1 1 62 62 MET CB C 216 32.311 32.311 35.011 -2.700 17569 13174 1 21 . 1 1 62 62 MET H H 216 8.376 8.376 7.268 1.108 17569 13175 1 21 . 1 1 63 63 ASP N N 217 127.300 127.300 128.548 -1.248 17569 13176 1 21 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.388 0.578 17569 13177 1 21 . 1 1 63 63 ASP CA C 217 55.569 55.569 56.076 -0.507 17569 13178 1 21 . 1 1 63 63 ASP H H 217 9.368 9.368 8.829 0.539 17569 13179 1 21 . 1 1 64 64 GLU N N 218 114.400 114.400 127.296 -12.896 17569 13180 1 21 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.557 -0.401 17569 13181 1 21 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.611 0.239 17569 13182 1 21 . 1 1 64 64 GLU H H 218 8.583 8.583 8.243 0.340 17569 13183 1 21 . 1 1 65 65 GLN N N 219 115.500 115.500 116.672 -1.172 17569 13184 1 21 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.535 -0.224 17569 13185 1 21 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.249 0.097 17569 13186 1 21 . 1 1 65 65 GLN H H 219 7.158 7.158 8.263 -1.105 17569 13187 1 21 . 1 1 66 66 CYS N N 220 122.600 122.600 117.830 4.770 17569 13188 1 21 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.211 -1.134 17569 13189 1 21 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.616 0.913 17569 13190 1 21 . 1 1 66 66 CYS CB C 220 31.972 31.972 29.792 2.180 17569 13191 1 21 . 1 1 66 66 CYS H H 220 8.248 8.248 8.512 -0.264 17569 13192 1 21 . 1 1 67 67 ARG N N 221 130.363 130.363 123.641 6.722 17569 13193 1 21 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.470 -0.403 17569 13194 1 21 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.831 -2.815 17569 13195 1 21 . 1 1 67 67 ARG H H 221 9.145 9.145 8.674 0.471 17569 13196 1 21 . 1 1 68 68 TRP N N 222 124.200 124.200 120.826 3.374 17569 13197 1 21 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.713 -0.277 17569 13198 1 21 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.357 0.723 17569 13199 1 21 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.395 0.799 17569 13200 1 21 . 1 1 68 68 TRP H H 222 9.689 9.689 8.284 1.405 17569 13201 1 21 . 1 1 69 69 CYS N N 223 116.297 116.297 111.131 5.166 17569 13202 1 21 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.182 -0.091 17569 13203 1 21 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.389 2.713 17569 13204 1 21 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.049 5.289 17569 13205 1 21 . 1 1 69 69 CYS H H 223 8.822 8.822 7.782 1.040 17569 13206 1 21 . 1 1 70 70 ALA N N 224 123.112 123.112 123.590 -0.478 17569 13207 1 21 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.264 0.142 17569 13208 1 21 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.553 -0.702 17569 13209 1 21 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.610 0.110 17569 13210 1 21 . 1 1 70 70 ALA H H 224 8.787 8.787 8.168 0.619 17569 13211 1 21 . 1 1 71 71 GLU N N 225 118.300 118.300 120.976 -2.676 17569 13212 1 21 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.516 0.792 17569 13213 1 21 . 1 1 71 71 GLU CA C 225 53.299 53.299 56.139 -2.840 17569 13214 1 21 . 1 1 71 71 GLU H H 225 8.541 8.541 8.027 0.514 17569 13215 1 21 . 1 1 72 72 GLY N N 226 111.995 111.995 111.145 0.850 17569 13216 1 21 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.894 -0.491 17569 13217 1 21 . 1 1 72 72 GLY H H 226 9.837 9.837 8.553 1.284 17569 13218 1 21 . 1 1 73 73 GLY N N 227 106.600 106.600 108.661 -2.061 17569 13219 1 21 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.757 0.214 17569 13220 1 21 . 1 1 73 73 GLY H H 227 7.772 7.772 8.347 -0.575 17569 13221 1 21 . 1 1 74 74 ASN N N 228 124.277 124.277 122.479 1.798 17569 13222 1 21 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.933 0.148 17569 13223 1 21 . 1 1 74 74 ASN CA C 228 53.100 53.100 52.738 0.362 17569 13224 1 21 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.866 -0.782 17569 13225 1 21 . 1 1 74 74 ASN H H 228 8.876 8.876 8.476 0.400 17569 13226 1 21 . 1 1 75 75 LEU N N 229 123.050 123.050 123.634 -0.584 17569 13227 1 21 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.962 -0.362 17569 13228 1 21 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.731 0.631 17569 13229 1 21 . 1 1 75 75 LEU CB C 229 43.500 43.500 45.451 -1.951 17569 13230 1 21 . 1 1 75 75 LEU H H 229 8.901 8.901 8.599 0.302 17569 13231 1 21 . 1 1 76 76 ILE N N 230 123.552 123.552 121.837 1.715 17569 13232 1 21 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.257 0.228 17569 13233 1 21 . 1 1 76 76 ILE CA C 230 60.700 60.700 60.090 0.610 17569 13234 1 21 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.174 -0.775 17569 13235 1 21 . 1 1 76 76 ILE H H 230 9.406 9.406 9.180 0.226 17569 13236 1 21 . 1 1 77 77 CYS N N 231 124.637 124.637 127.560 -2.923 17569 13237 1 21 . 1 1 77 77 CYS HA H 231 4.875 4.875 4.965 -0.090 17569 13238 1 21 . 1 1 77 77 CYS CA C 231 58.359 58.359 59.484 -1.125 17569 13239 1 21 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.833 0.601 17569 13240 1 21 . 1 1 77 77 CYS H H 231 8.809 8.809 8.687 0.122 17569 13241 1 21 . 1 1 78 78 CYS N N 232 125.697 125.697 126.000 -0.303 17569 13242 1 21 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.839 -0.555 17569 13243 1 21 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.995 3.889 17569 13244 1 21 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.686 1.484 17569 13245 1 21 . 1 1 78 78 CYS H H 232 8.579 8.579 8.760 -0.181 17569 13246 1 21 . 1 1 79 79 ASP N N 233 123.600 123.600 126.318 -2.718 17569 13247 1 21 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.674 0.083 17569 13248 1 21 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.343 2.647 17569 13249 1 21 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.068 1.561 17569 13250 1 21 . 1 1 79 79 ASP H H 233 8.577 8.577 8.126 0.451 17569 13251 1 21 . 1 1 80 80 PHE N N 234 122.100 122.100 116.977 5.123 17569 13252 1 21 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.590 -0.064 17569 13253 1 21 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.257 1.652 17569 13254 1 21 . 1 1 80 80 PHE CB C 234 41.849 41.849 39.996 1.853 17569 13255 1 21 . 1 1 80 80 PHE H H 234 10.432 10.432 7.428 3.004 17569 13256 1 21 . 1 1 81 81 CYS N N 235 124.300 124.300 117.816 6.484 17569 13257 1 21 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.735 0.421 17569 13258 1 21 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.109 -0.064 17569 13259 1 21 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.796 3.611 17569 13260 1 21 . 1 1 81 81 CYS H H 235 8.476 8.476 8.063 0.413 17569 13261 1 21 . 1 1 82 82 HIS N N 236 112.598 112.598 119.349 -6.751 17569 13262 1 21 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.132 0.851 17569 13263 1 21 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.716 -1.318 17569 13264 1 21 . 1 1 82 82 HIS CB C 236 30.257 30.257 28.093 2.164 17569 13265 1 21 . 1 1 82 82 HIS H H 236 6.699 6.699 8.178 -1.479 17569 13266 1 21 . 1 1 83 83 ASN N N 237 123.600 123.600 118.229 5.371 17569 13267 1 21 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.907 -0.106 17569 13268 1 21 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.899 2.717 17569 13269 1 21 . 1 1 83 83 ASN H H 237 9.097 9.097 7.865 1.232 17569 13270 1 21 . 1 1 84 84 ALA N N 238 122.000 122.000 124.358 -2.358 17569 13271 1 21 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.032 0.377 17569 13272 1 21 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.255 0.109 17569 13273 1 21 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.850 3.220 17569 13274 1 21 . 1 1 84 84 ALA H H 238 9.885 9.885 8.578 1.307 17569 13275 1 21 . 1 1 85 85 PHE N N 239 116.707 116.707 122.070 -5.363 17569 13276 1 21 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.136 0.892 17569 13277 1 21 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.652 -0.435 17569 13278 1 21 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.808 1.856 17569 13279 1 21 . 1 1 85 85 PHE H H 239 9.450 9.450 8.630 0.820 17569 13280 1 21 . 1 1 86 86 CYS N N 240 126.682 126.682 124.682 2.000 17569 13281 1 21 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.789 0.833 17569 13282 1 21 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.807 -0.466 17569 13283 1 21 . 1 1 86 86 CYS CB C 240 32.257 32.257 28.785 3.472 17569 13284 1 21 . 1 1 86 86 CYS H H 240 11.309 11.309 9.507 1.802 17569 13285 1 21 . 1 1 87 87 LYS N N 241 117.865 117.865 123.786 -5.921 17569 13286 1 21 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.947 -0.098 17569 13287 1 21 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.228 -0.158 17569 13288 1 21 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.316 0.482 17569 13289 1 21 . 1 1 87 87 LYS H H 241 8.230 8.230 9.010 -0.780 17569 13290 1 21 . 1 1 88 88 LYS N N 242 117.949 117.949 119.056 -1.107 17569 13291 1 21 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.120 -0.142 17569 13292 1 21 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.069 1.301 17569 13293 1 21 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.184 0.132 17569 13294 1 21 . 1 1 88 88 LYS H H 242 7.945 7.945 8.457 -0.512 17569 13295 1 21 . 1 1 89 89 CYS N N 243 125.305 125.305 117.554 7.751 17569 13296 1 21 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.277 -0.535 17569 13297 1 21 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.654 2.173 17569 13298 1 21 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.348 0.893 17569 13299 1 21 . 1 1 89 89 CYS H H 243 9.297 9.297 7.725 1.572 17569 13300 1 21 . 1 1 90 90 ILE N N 244 119.687 119.687 121.556 -1.869 17569 13301 1 21 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.936 -0.329 17569 13302 1 21 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.706 0.244 17569 13303 1 21 . 1 1 90 90 ILE H H 244 7.997 7.997 7.711 0.286 17569 13304 1 21 . 1 1 91 91 LEU N N 245 120.280 120.280 120.672 -0.392 17569 13305 1 21 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.302 -0.617 17569 13306 1 21 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.558 0.677 17569 13307 1 21 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.072 -0.114 17569 13308 1 21 . 1 1 91 91 LEU H H 245 8.810 8.810 8.823 -0.013 17569 13309 1 21 . 1 1 92 92 ARG N N 246 116.901 116.901 117.640 -0.739 17569 13310 1 21 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.085 -0.268 17569 13311 1 21 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.140 0.840 17569 13312 1 21 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.026 0.574 17569 13313 1 21 . 1 1 92 92 ARG H H 246 8.086 8.086 7.680 0.406 17569 13314 1 21 . 1 1 93 93 ASN N N 247 111.200 111.200 115.851 -4.651 17569 13315 1 21 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.513 0.090 17569 13316 1 21 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.822 0.986 17569 13317 1 21 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.961 3.523 17569 13318 1 21 . 1 1 93 93 ASN H H 247 7.136 7.136 8.163 -1.027 17569 13319 1 21 . 1 1 94 94 LEU N N 248 118.807 118.807 117.155 1.652 17569 13320 1 21 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.338 0.476 17569 13321 1 21 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.008 0.181 17569 13322 1 21 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.674 0.024 17569 13323 1 21 . 1 1 94 94 LEU H H 248 8.515 8.515 8.018 0.497 17569 13324 1 21 . 1 1 95 95 GLY N N 249 108.000 108.000 106.533 1.467 17569 13325 1 21 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.586 0.042 17569 13326 1 21 . 1 1 95 95 GLY H H 249 7.955 7.955 7.568 0.387 17569 13327 1 21 . 1 1 96 96 ARG N N 250 117.797 117.797 120.999 -3.202 17569 13328 1 21 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.303 -0.460 17569 13329 1 21 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.129 0.553 17569 13330 1 21 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.345 -0.485 17569 13331 1 21 . 1 1 96 96 ARG H H 250 8.559 8.559 8.669 -0.110 17569 13332 1 21 . 1 1 97 97 LYS N N 251 120.900 120.900 119.835 1.065 17569 13333 1 21 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.007 0.149 17569 13334 1 21 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.678 -0.522 17569 13335 1 21 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.851 -0.490 17569 13336 1 21 . 1 1 97 97 LYS H H 251 8.655 8.655 8.512 0.143 17569 13337 1 21 . 1 1 98 98 GLU N N 252 122.000 122.000 118.725 3.275 17569 13338 1 21 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.089 0.262 17569 13339 1 21 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.194 -0.612 17569 13340 1 21 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.426 -1.026 17569 13341 1 21 . 1 1 98 98 GLU H H 252 7.705 7.705 8.399 -0.694 17569 13342 1 21 . 1 1 99 99 LEU N N 253 117.400 117.400 120.554 -3.154 17569 13343 1 21 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.825 0.092 17569 13344 1 21 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.032 -0.034 17569 13345 1 21 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.865 -0.383 17569 13346 1 21 . 1 1 99 99 LEU H H 253 7.285 7.285 7.662 -0.377 17569 13347 1 21 . 1 1 100 100 SER N N 254 112.100 112.100 114.014 -1.914 17569 13348 1 21 . 1 1 100 100 SER HA H 254 4.107 4.107 4.127 -0.020 17569 13349 1 21 . 1 1 100 100 SER CA C 254 61.603 61.603 61.984 -0.381 17569 13350 1 21 . 1 1 100 100 SER CB C 254 62.622 62.622 63.134 -0.512 17569 13351 1 21 . 1 1 100 100 SER H H 254 8.326 8.326 8.097 0.229 17569 13352 1 21 . 1 1 101 101 THR N N 255 118.151 118.151 118.691 -0.540 17569 13353 1 21 . 1 1 101 101 THR HA H 255 4.026 4.026 3.999 0.027 17569 13354 1 21 . 1 1 101 101 THR CA C 255 66.261 66.261 66.623 -0.362 17569 13355 1 21 . 1 1 101 101 THR CB C 255 68.735 68.735 68.853 -0.118 17569 13356 1 21 . 1 1 101 101 THR H H 255 7.972 7.972 7.770 0.202 17569 13357 1 21 . 1 1 102 102 ILE N N 256 120.100 120.100 122.711 -2.611 17569 13358 1 21 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.584 -0.121 17569 13359 1 21 . 1 1 102 102 ILE CA C 256 64.774 64.774 65.033 -0.259 17569 13360 1 21 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.410 0.331 17569 13361 1 21 . 1 1 102 102 ILE H H 256 7.868 7.868 8.552 -0.684 17569 13362 1 21 . 1 1 103 103 MET N N 257 114.876 114.876 116.284 -1.408 17569 13363 1 21 . 1 1 103 103 MET HA H 257 4.211 4.211 4.066 0.145 17569 13364 1 21 . 1 1 103 103 MET CA C 257 55.691 55.691 58.346 -2.655 17569 13365 1 21 . 1 1 103 103 MET CB C 257 32.000 32.000 32.665 -0.665 17569 13366 1 21 . 1 1 103 103 MET H H 257 7.606 7.606 7.355 0.251 17569 13367 1 21 . 1 1 104 104 ASP N N 258 119.976 119.976 118.361 1.615 17569 13368 1 21 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.761 -0.223 17569 13369 1 21 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.549 1.363 17569 13370 1 21 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.685 0.815 17569 13371 1 21 . 1 1 104 104 ASP H H 258 7.444 7.444 7.569 -0.125 17569 13372 1 21 . 1 1 105 105 GLU N N 259 124.388 124.388 122.537 1.851 17569 13373 1 21 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.516 -0.229 17569 13374 1 21 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.017 2.554 17569 13375 1 21 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.997 -0.455 17569 13376 1 21 . 1 1 105 105 GLU H H 259 8.559 8.559 8.111 0.448 17569 13377 1 21 . 1 1 106 106 ASN N N 260 117.201 117.201 117.065 0.136 17569 13378 1 21 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.407 0.335 17569 13379 1 21 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.200 -0.457 17569 13380 1 21 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.305 1.613 17569 13381 1 21 . 1 1 106 106 ASN H H 260 8.673 8.673 8.780 -0.107 17569 13382 1 21 . 1 1 107 107 ASN N N 261 117.900 117.900 112.782 5.118 17569 13383 1 21 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.305 0.680 17569 13384 1 21 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.677 -2.375 17569 13385 1 21 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.492 3.122 17569 13386 1 21 . 1 1 107 107 ASN H H 261 7.956 7.956 8.699 -0.743 17569 13387 1 21 . 1 1 108 108 GLN N N 262 121.500 121.500 115.434 6.066 17569 13388 1 21 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.080 0.528 17569 13389 1 21 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.642 1.135 17569 13390 1 21 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.789 0.769 17569 13391 1 21 . 1 1 108 108 GLN H H 262 8.493 8.493 7.765 0.728 17569 13392 1 21 . 1 1 109 109 TRP N N 263 128.056 128.056 123.223 4.833 17569 13393 1 21 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.733 0.238 17569 13394 1 21 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.997 0.100 17569 13395 1 21 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.149 0.344 17569 13396 1 21 . 1 1 109 109 TRP H H 263 10.497 10.497 8.035 2.462 17569 13397 1 21 . 1 1 110 110 TYR N N 264 126.600 126.600 124.960 1.640 17569 13398 1 21 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.426 -0.024 17569 13399 1 21 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.505 -1.834 17569 13400 1 21 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.517 -1.508 17569 13401 1 21 . 1 1 110 110 TYR H H 264 7.545 7.545 8.156 -0.611 17569 13402 1 21 . 1 1 111 111 CYS N N 265 124.622 124.622 114.514 10.108 17569 13403 1 21 . 1 1 111 111 CYS H H 265 8.586 8.586 8.084 0.502 17569 13404 1 21 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.795 -0.603 17569 13405 1 21 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.647 1.068 17569 13406 1 21 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.599 1.321 17569 13407 1 21 . 1 1 113 113 ILE N N 267 119.504 119.504 119.639 -0.135 17569 13408 1 21 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.516 -0.566 17569 13409 1 21 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.940 0.309 17569 13410 1 21 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.553 -3.021 17569 13411 1 21 . 1 1 113 113 ILE H H 267 9.160 9.160 7.487 1.673 17569 13412 1 21 . 1 1 114 114 CYS N N 268 124.100 124.100 118.360 5.740 17569 13413 1 21 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.172 -0.358 17569 13414 1 21 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.687 3.613 17569 13415 1 21 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.101 2.620 17569 13416 1 21 . 1 1 114 114 CYS H H 268 7.818 7.818 8.257 -0.439 17569 13417 1 21 . 1 1 115 115 HIS N N 269 117.127 117.127 111.171 5.956 17569 13418 1 21 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.653 0.476 17569 13419 1 21 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.037 -0.876 17569 13420 1 21 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.804 2.388 17569 13421 1 21 . 1 1 115 115 HIS H H 269 8.953 8.953 7.794 1.159 17569 13422 1 21 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.436 0.506 17569 13423 1 21 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.465 -0.157 17569 13424 1 21 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.573 1.069 17569 13425 1 21 . 1 1 117 117 GLU N N 271 123.504 123.504 122.816 0.688 17569 13426 1 21 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.354 -0.334 17569 13427 1 21 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.110 3.759 17569 13428 1 21 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.844 -1.793 17569 13429 1 21 . 1 1 117 117 GLU H H 271 8.402 8.402 8.115 0.287 17569 13430 1 21 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.522 0.020 17569 13431 1 21 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.610 1.749 17569 13432 1 21 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.267 0.875 17569 13433 1 21 . 1 1 119 119 LEU N N 273 112.296 112.296 114.197 -1.901 17569 13434 1 21 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.903 -0.429 17569 13435 1 21 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.411 0.131 17569 13436 1 21 . 1 1 119 119 LEU H H 273 8.090 8.090 7.439 0.651 17569 13437 1 21 . 1 1 120 120 LEU N N 274 121.388 121.388 123.092 -1.704 17569 13438 1 21 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.925 0.102 17569 13439 1 21 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.346 -0.045 17569 13440 1 21 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.647 0.453 17569 13441 1 21 . 1 1 120 120 LEU H H 274 7.823 7.823 7.789 0.034 17569 13442 1 21 . 1 1 121 121 ASP N N 275 118.600 118.600 118.250 0.350 17569 13443 1 21 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.324 0.217 17569 13444 1 21 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.710 -0.007 17569 13445 1 21 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.291 -0.848 17569 13446 1 21 . 1 1 121 121 ASP H H 275 8.694 8.694 8.424 0.270 17569 13447 1 21 . 1 1 122 122 LEU N N 276 123.192 123.192 120.484 2.708 17569 13448 1 21 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.995 0.397 17569 13449 1 21 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.967 0.005 17569 13450 1 21 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.017 0.525 17569 13451 1 21 . 1 1 122 122 LEU H H 276 8.013 8.013 7.335 0.678 17569 13452 1 21 . 1 1 123 123 VAL N N 277 126.898 126.898 118.308 8.590 17569 13453 1 21 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.650 0.205 17569 13454 1 21 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.376 0.287 17569 13455 1 21 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.652 1.405 17569 13456 1 21 . 1 1 123 123 VAL H H 277 8.781 8.781 7.808 0.973 17569 13457 1 21 . 1 1 124 124 THR N N 278 117.500 117.500 116.084 1.416 17569 13458 1 21 . 1 1 124 124 THR HA H 278 4.030 4.030 3.910 0.120 17569 13459 1 21 . 1 1 124 124 THR CA C 278 66.589 66.589 67.185 -0.596 17569 13460 1 21 . 1 1 124 124 THR CB C 278 68.410 68.410 68.424 -0.014 17569 13461 1 21 . 1 1 124 124 THR H H 278 8.722 8.722 8.318 0.404 17569 13462 1 21 . 1 1 125 125 ALA N N 279 124.700 124.700 123.879 0.821 17569 13463 1 21 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.087 0.174 17569 13464 1 21 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.060 0.236 17569 13465 1 21 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.859 0.090 17569 13466 1 21 . 1 1 125 125 ALA H H 279 8.239 8.239 7.843 0.396 17569 13467 1 21 . 1 1 126 126 CYS N N 280 119.276 119.276 117.867 1.409 17569 13468 1 21 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.934 0.180 17569 13469 1 21 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.095 -0.992 17569 13470 1 21 . 1 1 126 126 CYS CB C 280 26.496 26.496 26.692 -0.196 17569 13471 1 21 . 1 1 126 126 CYS H H 280 8.128 8.128 7.771 0.357 17569 13472 1 21 . 1 1 127 127 ASN N N 281 118.000 118.000 118.657 -0.657 17569 13473 1 21 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.587 -0.027 17569 13474 1 21 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.543 -0.404 17569 13475 1 21 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.054 -1.089 17569 13476 1 21 . 1 1 127 127 ASN H H 281 8.725 8.725 7.982 0.743 17569 13477 1 21 . 1 1 128 128 SER N N 282 116.601 116.601 117.370 -0.769 17569 13478 1 21 . 1 1 128 128 SER HA H 282 4.363 4.363 4.185 0.178 17569 13479 1 21 . 1 1 128 128 SER CA C 282 61.899 61.899 61.792 0.106 17569 13480 1 21 . 1 1 128 128 SER CB C 282 62.630 62.630 63.153 -0.523 17569 13481 1 21 . 1 1 128 128 SER H H 282 8.542 8.542 7.586 0.956 17569 13482 1 21 . 1 1 129 129 VAL N N 283 123.272 123.272 122.063 1.209 17569 13483 1 21 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.500 0.177 17569 13484 1 21 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.752 -0.244 17569 13485 1 21 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.472 -0.254 17569 13486 1 21 . 1 1 129 129 VAL H H 283 7.990 7.990 7.894 0.096 17569 13487 1 21 . 1 1 130 130 PHE N N 284 118.594 118.594 118.972 -0.378 17569 13488 1 21 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.279 -0.266 17569 13489 1 21 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.235 2.265 17569 13490 1 21 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.436 0.560 17569 13491 1 21 . 1 1 130 130 PHE H H 284 8.190 8.190 7.894 0.296 17569 13492 1 21 . 1 1 131 131 GLU N N 285 120.905 120.905 120.051 0.854 17569 13493 1 21 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.062 0.143 17569 13494 1 21 . 1 1 131 131 GLU CA C 285 59.214 59.214 60.006 -0.792 17569 13495 1 21 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.422 0.077 17569 13496 1 21 . 1 1 131 131 GLU H H 285 8.699 8.699 8.512 0.187 17569 13497 1 21 . 1 1 132 132 ASN N N 286 117.997 117.997 118.319 -0.322 17569 13498 1 21 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.671 -0.076 17569 13499 1 21 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.052 -0.437 17569 13500 1 21 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.793 0.059 17569 13501 1 21 . 1 1 132 132 ASN H H 286 8.082 8.082 7.972 0.110 17569 13502 1 21 . 1 1 133 133 LEU N N 287 120.800 120.800 122.756 -1.956 17569 13503 1 21 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.335 -0.218 17569 13504 1 21 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.241 -0.443 17569 13505 1 21 . 1 1 133 133 LEU H H 287 7.904 7.904 8.600 -0.696 17569 13506 1 21 . 1 1 134 134 GLU N N 288 118.200 118.200 118.887 -0.687 17569 13507 1 21 . 1 1 134 134 GLU HA H 288 4.079 4.079 4.002 0.077 17569 13508 1 21 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.304 -1.307 17569 13509 1 21 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.095 0.147 17569 13510 1 21 . 1 1 134 134 GLU H H 288 8.157 8.157 8.395 -0.238 17569 13511 1 21 . 1 1 135 135 GLN N N 289 117.400 117.400 117.766 -0.366 17569 13512 1 21 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.116 0.058 17569 13513 1 21 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.420 -0.431 17569 13514 1 21 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.308 -0.228 17569 13515 1 21 . 1 1 135 135 GLN H H 289 7.869 7.869 7.802 0.067 17569 13516 1 21 . 1 1 136 136 LEU N N 290 121.000 121.000 122.556 -1.556 17569 13517 1 21 . 1 1 136 136 LEU HA H 290 4.173 4.173 4.009 0.164 17569 13518 1 21 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.722 -0.584 17569 13519 1 21 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.737 0.263 17569 13520 1 21 . 1 1 136 136 LEU H H 290 7.968 7.968 7.954 0.014 17569 13521 1 21 . 1 1 137 137 LEU N N 291 118.900 118.900 117.448 1.452 17569 13522 1 21 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.032 0.209 17569 13523 1 21 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.189 -0.829 17569 13524 1 21 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.189 -0.717 17569 13525 1 21 . 1 1 137 137 LEU H H 291 8.154 8.154 7.755 0.399 17569 13526 1 21 . 1 1 138 138 GLN N N 292 117.993 117.993 117.130 0.863 17569 13527 1 21 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.444 -0.172 17569 13528 1 21 . 1 1 138 138 GLN CA C 292 56.632 56.632 55.511 1.121 17569 13529 1 21 . 1 1 138 138 GLN CB C 292 28.584 28.584 28.969 -0.385 17569 13530 1 21 . 1 1 138 138 GLN H H 292 7.896 7.896 7.585 0.311 17569 13531 1 21 . 1 1 139 139 GLN N N 293 118.889 118.889 119.098 -0.209 17569 13532 1 21 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.460 -0.191 17569 13533 1 21 . 1 1 139 139 GLN CA C 293 56.454 56.454 56.017 0.437 17569 13534 1 21 . 1 1 139 139 GLN CB C 293 29.069 29.069 30.493 -1.424 17569 13535 1 21 . 1 1 139 139 GLN H H 293 8.091 8.091 7.502 0.589 17569 13536 1 21 . 1 1 140 140 ASN N N 294 118.604 118.604 123.133 -4.529 17569 13537 1 21 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.820 -0.061 17569 13538 1 21 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.179 0.042 17569 13539 1 21 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.646 -0.913 17569 13540 1 21 . 1 1 140 140 ASN H H 294 8.273 8.273 8.548 -0.275 17569 13541 1 21 . 1 1 141 141 LYS N N 295 121.685 121.685 119.759 1.926 17569 13542 1 21 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.584 -0.224 17569 13543 1 21 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.343 -0.170 17569 13544 1 21 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.413 -0.878 17569 13545 1 21 . 1 1 141 141 LYS H H 295 8.089 8.089 8.113 -0.024 17569 13546 1 22 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.664 -0.277 17569 13547 1 22 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.191 0.254 17569 13548 1 22 . 1 1 2 2 ALA CB C 156 19.256 19.256 20.424 -1.167 17569 13549 1 22 . 1 1 3 3 MET HA H 157 4.476 4.476 4.591 -0.115 17569 13550 1 22 . 1 1 3 3 MET CA C 157 55.401 55.401 55.602 -0.202 17569 13551 1 22 . 1 1 4 4 ALA N N 158 124.828 124.828 123.159 1.669 17569 13552 1 22 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.552 -0.238 17569 13553 1 22 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.911 0.600 17569 13554 1 22 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.094 -1.093 17569 13555 1 22 . 1 1 4 4 ALA H H 158 8.382 8.382 7.811 0.571 17569 13556 1 22 . 1 1 5 5 ASP N N 159 119.418 119.418 123.950 -4.532 17569 13557 1 22 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.823 -0.233 17569 13558 1 22 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.753 -0.617 17569 13559 1 22 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.328 -0.312 17569 13560 1 22 . 1 1 5 5 ASP H H 159 8.312 8.312 8.583 -0.271 17569 13561 1 22 . 1 1 6 6 LYS N N 160 121.604 121.604 120.024 1.580 17569 13562 1 22 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.729 -0.386 17569 13563 1 22 . 1 1 6 6 LYS H H 160 8.274 8.274 8.271 0.003 17569 13564 1 22 . 1 1 7 7 ARG N N 161 121.611 121.611 120.805 0.806 17569 13565 1 22 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.534 -0.206 17569 13566 1 22 . 1 1 7 7 ARG H H 161 8.430 8.430 8.913 -0.483 17569 13567 1 22 . 1 1 8 8 GLY N N 162 109.606 109.606 109.777 -0.171 17569 13568 1 22 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.202 -0.155 17569 13569 1 22 . 1 1 8 8 GLY H H 162 8.473 8.473 8.009 0.464 17569 13570 1 22 . 1 1 9 9 ASP N N 163 120.187 120.187 120.021 0.166 17569 13571 1 22 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.737 -0.088 17569 13572 1 22 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.068 1.083 17569 13573 1 22 . 1 1 9 9 ASP H H 163 8.296 8.296 7.978 0.318 17569 13574 1 22 . 1 1 10 10 GLY N N 164 108.816 108.816 108.512 0.304 17569 13575 1 22 . 1 1 10 10 GLY CA C 164 45.367 45.367 46.069 -0.702 17569 13576 1 22 . 1 1 10 10 GLY H H 164 8.458 8.458 8.493 -0.035 17569 13577 1 22 . 1 1 11 11 LEU N N 165 121.195 121.195 117.017 4.178 17569 13578 1 22 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.606 -0.290 17569 13579 1 22 . 1 1 11 11 LEU CA C 165 55.000 55.000 53.797 1.203 17569 13580 1 22 . 1 1 11 11 LEU CB C 165 41.932 41.932 43.692 -1.760 17569 13581 1 22 . 1 1 11 11 LEU H H 165 8.137 8.137 7.479 0.658 17569 13582 1 22 . 1 1 12 12 HIS N N 166 119.387 119.387 119.274 0.113 17569 13583 1 22 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.860 -0.205 17569 13584 1 22 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.692 0.577 17569 13585 1 22 . 1 1 12 12 HIS CB C 166 30.697 30.697 31.054 -0.357 17569 13586 1 22 . 1 1 12 12 HIS H H 166 8.270 8.270 8.572 -0.302 17569 13587 1 22 . 1 1 13 13 GLY N N 167 109.899 109.899 111.738 -1.839 17569 13588 1 22 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.287 0.818 17569 13589 1 22 . 1 1 13 13 GLY H H 167 8.276 8.276 8.616 -0.340 17569 13590 1 22 . 1 1 14 14 ILE N N 168 119.597 119.597 119.731 -0.134 17569 13591 1 22 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.239 0.084 17569 13592 1 22 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.578 0.022 17569 13593 1 22 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.183 -2.233 17569 13594 1 22 . 1 1 14 14 ILE H H 168 7.962 7.962 8.079 -0.117 17569 13595 1 22 . 1 1 15 15 VAL N N 169 127.578 127.578 125.242 2.336 17569 13596 1 22 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.022 0.258 17569 13597 1 22 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.554 -1.237 17569 13598 1 22 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.134 3.268 17569 13599 1 22 . 1 1 15 15 VAL H H 169 9.011 9.011 8.547 0.464 17569 13600 1 22 . 1 1 16 16 SER N N 170 118.596 118.596 119.449 -0.853 17569 13601 1 22 . 1 1 16 16 SER HA H 170 5.140 5.140 4.750 0.390 17569 13602 1 22 . 1 1 16 16 SER CA C 170 55.985 55.985 55.989 -0.004 17569 13603 1 22 . 1 1 16 16 SER CB C 170 65.261 65.261 65.774 -0.513 17569 13604 1 22 . 1 1 16 16 SER H H 170 8.242 8.242 7.663 0.579 17569 13605 1 22 . 1 1 17 17 CYS N N 171 123.783 123.783 122.793 0.990 17569 13606 1 22 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.139 0.042 17569 13607 1 22 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.824 -0.980 17569 13608 1 22 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.710 2.663 17569 13609 1 22 . 1 1 17 17 CYS H H 171 8.894 8.894 8.477 0.417 17569 13610 1 22 . 1 1 18 18 THR N N 172 121.703 121.703 117.791 3.912 17569 13611 1 22 . 1 1 18 18 THR HA H 172 4.386 4.386 4.101 0.285 17569 13612 1 22 . 1 1 18 18 THR CA C 172 64.667 64.667 64.200 0.467 17569 13613 1 22 . 1 1 18 18 THR CB C 172 69.498 69.498 68.842 0.656 17569 13614 1 22 . 1 1 18 18 THR H H 172 8.788 8.788 8.163 0.625 17569 13615 1 22 . 1 1 19 19 ALA N N 173 131.364 131.364 121.452 9.912 17569 13616 1 22 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.048 0.448 17569 13617 1 22 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.559 0.466 17569 13618 1 22 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.590 3.592 17569 13619 1 22 . 1 1 19 19 ALA H H 173 9.680 9.680 8.038 1.642 17569 13620 1 22 . 1 1 20 20 CYS N N 174 115.498 115.498 114.900 0.598 17569 13621 1 22 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.424 0.544 17569 13622 1 22 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.924 -1.830 17569 13623 1 22 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.070 4.174 17569 13624 1 22 . 1 1 20 20 CYS H H 174 8.470 8.470 7.714 0.756 17569 13625 1 22 . 1 1 21 21 GLY N N 175 112.464 112.464 109.238 3.226 17569 13626 1 22 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.102 0.604 17569 13627 1 22 . 1 1 21 21 GLY H H 175 7.884 7.884 7.943 -0.059 17569 13628 1 22 . 1 1 22 22 GLN N N 176 121.784 121.784 117.795 3.989 17569 13629 1 22 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.428 -0.052 17569 13630 1 22 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.442 1.849 17569 13631 1 22 . 1 1 22 22 GLN CB C 176 29.341 29.341 32.197 -2.856 17569 13632 1 22 . 1 1 22 22 GLN H H 176 8.723 8.723 7.904 0.819 17569 13633 1 22 . 1 1 23 23 GLN N N 177 122.900 122.900 122.726 0.174 17569 13634 1 22 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.213 0.317 17569 13635 1 22 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.782 -0.232 17569 13636 1 22 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.177 -0.717 17569 13637 1 22 . 1 1 23 23 GLN H H 177 8.721 8.721 8.459 0.262 17569 13638 1 22 . 1 1 24 24 VAL N N 178 121.000 121.000 123.522 -2.522 17569 13639 1 22 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.980 0.544 17569 13640 1 22 . 1 1 24 24 VAL CA C 178 59.877 59.877 60.789 -0.912 17569 13641 1 22 . 1 1 24 24 VAL H H 178 8.689 8.689 7.815 0.874 17569 13642 1 22 . 1 1 25 25 ASN N N 179 121.392 121.392 125.014 -3.622 17569 13643 1 22 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.282 0.594 17569 13644 1 22 . 1 1 25 25 ASN CA C 179 52.149 52.149 53.838 -1.689 17569 13645 1 22 . 1 1 25 25 ASN CB C 179 37.977 37.977 37.964 0.013 17569 13646 1 22 . 1 1 25 25 ASN H H 179 8.635 8.635 8.411 0.224 17569 13647 1 22 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.670 -0.210 17569 13648 1 22 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.877 0.121 17569 13649 1 22 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.827 -1.434 17569 13650 1 22 . 1 1 28 28 GLN N N 182 119.300 119.300 121.362 -2.062 17569 13651 1 22 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.471 0.047 17569 13652 1 22 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.613 -2.271 17569 13653 1 22 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.203 0.147 17569 13654 1 22 . 1 1 28 28 GLN H H 182 7.494 7.494 7.804 -0.310 17569 13655 1 22 . 1 1 29 29 LYS N N 183 124.516 124.516 126.556 -2.040 17569 13656 1 22 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.574 -0.652 17569 13657 1 22 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.493 1.819 17569 13658 1 22 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.162 0.124 17569 13659 1 22 . 1 1 29 29 LYS H H 183 8.779 8.779 8.760 0.019 17569 13660 1 22 . 1 1 30 30 ASP N N 184 116.500 116.500 118.651 -2.151 17569 13661 1 22 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.888 -0.429 17569 13662 1 22 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.680 -0.144 17569 13663 1 22 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.193 -1.222 17569 13664 1 22 . 1 1 30 30 ASP H H 184 8.556 8.556 8.234 0.322 17569 13665 1 22 . 1 1 31 31 SER N N 185 111.505 111.505 114.693 -3.188 17569 13666 1 22 . 1 1 31 31 SER HA H 185 4.695 4.695 4.728 -0.033 17569 13667 1 22 . 1 1 31 31 SER CA C 185 59.747 59.747 58.403 1.344 17569 13668 1 22 . 1 1 31 31 SER CB C 185 65.198 65.198 63.984 1.214 17569 13669 1 22 . 1 1 31 31 SER H H 185 7.933 7.933 8.521 -0.588 17569 13670 1 22 . 1 1 32 32 ILE N N 186 113.394 113.394 116.728 -3.334 17569 13671 1 22 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.025 -0.139 17569 13672 1 22 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.228 -0.649 17569 13673 1 22 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.807 1.005 17569 13674 1 22 . 1 1 32 32 ILE H H 186 7.105 7.105 7.560 -0.455 17569 13675 1 22 . 1 1 33 33 TYR N N 187 119.098 119.098 120.716 -1.618 17569 13676 1 22 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.080 -0.557 17569 13677 1 22 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.908 1.351 17569 13678 1 22 . 1 1 33 33 TYR CB C 187 43.440 43.440 40.831 2.609 17569 13679 1 22 . 1 1 33 33 TYR H H 187 8.954 8.954 7.780 1.174 17569 13680 1 22 . 1 1 34 34 ARG N N 188 118.502 118.502 123.832 -5.330 17569 13681 1 22 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.718 -0.081 17569 13682 1 22 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.490 -1.738 17569 13683 1 22 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.207 1.044 17569 13684 1 22 . 1 1 34 34 ARG H H 188 8.412 8.412 8.554 -0.142 17569 13685 1 22 . 1 1 35 35 HIS N N 189 126.596 126.596 128.883 -2.287 17569 13686 1 22 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.933 -0.341 17569 13687 1 22 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.164 -0.443 17569 13688 1 22 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.223 1.249 17569 13689 1 22 . 1 1 35 35 HIS H H 189 9.813 9.813 9.146 0.667 17569 13690 1 22 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.564 -0.266 17569 13691 1 22 . 1 1 36 36 PRO CA C 190 65.276 65.276 65.068 0.208 17569 13692 1 22 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.182 0.669 17569 13693 1 22 . 1 1 37 37 SER N N 191 110.003 110.003 114.082 -4.079 17569 13694 1 22 . 1 1 37 37 SER HA H 191 4.918 4.918 4.300 0.618 17569 13695 1 22 . 1 1 37 37 SER CA C 191 59.031 59.031 60.982 -1.951 17569 13696 1 22 . 1 1 37 37 SER CB C 191 65.104 65.104 63.271 1.833 17569 13697 1 22 . 1 1 37 37 SER H H 191 8.934 8.934 8.547 0.387 17569 13698 1 22 . 1 1 38 38 LEU N N 192 120.959 120.959 114.402 6.557 17569 13699 1 22 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.963 -0.834 17569 13700 1 22 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.158 1.988 17569 13701 1 22 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.505 1.492 17569 13702 1 22 . 1 1 38 38 LEU H H 192 8.649 8.649 7.016 1.633 17569 13703 1 22 . 1 1 39 39 GLN N N 193 108.600 108.600 119.523 -10.923 17569 13704 1 22 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.114 -0.209 17569 13705 1 22 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.729 0.085 17569 13706 1 22 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.337 -2.303 17569 13707 1 22 . 1 1 39 39 GLN H H 193 8.465 8.465 7.830 0.635 17569 13708 1 22 . 1 1 40 40 VAL N N 194 105.325 105.325 118.493 -13.168 17569 13709 1 22 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.514 0.036 17569 13710 1 22 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.415 -0.774 17569 13711 1 22 . 1 1 40 40 VAL H H 194 6.256 6.256 7.882 -1.626 17569 13712 1 22 . 1 1 41 41 LEU N N 195 123.100 123.100 122.326 0.774 17569 13713 1 22 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.757 0.059 17569 13714 1 22 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.479 3.703 17569 13715 1 22 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.296 0.274 17569 13716 1 22 . 1 1 41 41 LEU H H 195 9.154 9.154 8.538 0.616 17569 13717 1 22 . 1 1 42 42 ILE N N 196 124.396 124.396 117.200 7.196 17569 13718 1 22 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.857 1.495 17569 13719 1 22 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.207 1.023 17569 13720 1 22 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.931 1.339 17569 13721 1 22 . 1 1 42 42 ILE H H 196 9.766 9.766 7.823 1.943 17569 13722 1 22 . 1 1 43 43 CYS N N 197 121.500 121.500 114.728 6.772 17569 13723 1 22 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.289 -0.027 17569 13724 1 22 . 1 1 43 43 CYS CA C 197 56.703 56.703 55.954 0.749 17569 13725 1 22 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.486 1.814 17569 13726 1 22 . 1 1 43 43 CYS H H 197 9.882 9.882 8.261 1.621 17569 13727 1 22 . 1 1 44 44 LYS N N 198 117.995 117.995 122.035 -4.040 17569 13728 1 22 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.140 -0.151 17569 13729 1 22 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.179 -0.519 17569 13730 1 22 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.349 0.351 17569 13731 1 22 . 1 1 44 44 LYS H H 198 8.089 8.089 8.449 -0.360 17569 13732 1 22 . 1 1 45 45 ASN N N 199 119.200 119.200 117.597 1.603 17569 13733 1 22 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.601 -0.087 17569 13734 1 22 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.288 0.432 17569 13735 1 22 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.264 -0.097 17569 13736 1 22 . 1 1 45 45 ASN H H 199 8.356 8.356 8.626 -0.270 17569 13737 1 22 . 1 1 46 46 CYS N N 200 126.600 126.600 118.292 8.308 17569 13738 1 22 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.027 0.154 17569 13739 1 22 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.106 2.389 17569 13740 1 22 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.158 2.024 17569 13741 1 22 . 1 1 46 46 CYS H H 200 9.189 9.189 7.876 1.313 17569 13742 1 22 . 1 1 47 47 PHE N N 201 121.962 121.962 120.409 1.553 17569 13743 1 22 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.138 -0.268 17569 13744 1 22 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.398 1.871 17569 13745 1 22 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.613 0.554 17569 13746 1 22 . 1 1 47 47 PHE H H 201 8.826 8.826 7.874 0.952 17569 13747 1 22 . 1 1 48 48 LYS N N 202 117.400 117.400 120.830 -3.430 17569 13748 1 22 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.901 -0.203 17569 13749 1 22 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.972 -1.020 17569 13750 1 22 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.312 -0.770 17569 13751 1 22 . 1 1 48 48 LYS H H 202 8.512 8.512 8.141 0.371 17569 13752 1 22 . 1 1 49 49 TYR N N 203 120.400 120.400 119.742 0.658 17569 13753 1 22 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.205 0.209 17569 13754 1 22 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.837 -1.065 17569 13755 1 22 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.693 -0.247 17569 13756 1 22 . 1 1 49 49 TYR H H 203 8.133 8.133 7.714 0.419 17569 13757 1 22 . 1 1 50 50 TYR N N 204 121.783 121.783 117.807 3.976 17569 13758 1 22 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.689 -1.194 17569 13759 1 22 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.665 3.285 17569 13760 1 22 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.751 0.741 17569 13761 1 22 . 1 1 50 50 TYR H H 204 8.765 8.765 7.409 1.356 17569 13762 1 22 . 1 1 51 51 MET N N 205 110.800 110.800 115.793 -4.993 17569 13763 1 22 . 1 1 51 51 MET HA H 205 4.349 4.349 4.215 0.134 17569 13764 1 22 . 1 1 51 51 MET CA C 205 53.505 53.505 57.197 -3.692 17569 13765 1 22 . 1 1 51 51 MET CB C 205 30.384 30.384 32.526 -2.142 17569 13766 1 22 . 1 1 51 51 MET H H 205 7.771 7.771 8.543 -0.772 17569 13767 1 22 . 1 1 52 52 SER N N 206 116.800 116.800 112.587 4.213 17569 13768 1 22 . 1 1 52 52 SER HA H 206 3.919 3.919 4.375 -0.456 17569 13769 1 22 . 1 1 52 52 SER CA C 206 61.621 61.621 59.993 1.628 17569 13770 1 22 . 1 1 52 52 SER CB C 206 62.611 62.611 64.273 -1.662 17569 13771 1 22 . 1 1 52 52 SER H H 206 7.581 7.581 8.339 -0.758 17569 13772 1 22 . 1 1 53 53 ASP N N 207 117.400 117.400 121.359 -3.959 17569 13773 1 22 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.745 -0.172 17569 13774 1 22 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.572 -0.473 17569 13775 1 22 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.976 0.212 17569 13776 1 22 . 1 1 53 53 ASP H H 207 7.085 7.085 7.962 -0.877 17569 13777 1 22 . 1 1 54 54 ASP N N 208 119.405 119.405 123.265 -3.860 17569 13778 1 22 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.998 -0.609 17569 13779 1 22 . 1 1 54 54 ASP CA C 208 53.900 53.900 52.914 0.986 17569 13780 1 22 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.558 -2.209 17569 13781 1 22 . 1 1 54 54 ASP H H 208 8.439 8.439 8.496 -0.057 17569 13782 1 22 . 1 1 55 55 ILE N N 209 124.698 124.698 122.307 2.391 17569 13783 1 22 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.120 -0.120 17569 13784 1 22 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.285 1.994 17569 13785 1 22 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.565 1.726 17569 13786 1 22 . 1 1 55 55 ILE H H 209 8.128 8.128 8.563 -0.435 17569 13787 1 22 . 1 1 56 56 SER N N 210 126.703 126.703 122.191 4.512 17569 13788 1 22 . 1 1 56 56 SER HA H 210 4.365 4.365 4.178 0.187 17569 13789 1 22 . 1 1 56 56 SER CA C 210 57.769 57.769 60.377 -2.607 17569 13790 1 22 . 1 1 56 56 SER CB C 210 64.991 64.991 63.483 1.508 17569 13791 1 22 . 1 1 56 56 SER H H 210 8.815 8.815 8.813 0.002 17569 13792 1 22 . 1 1 57 57 ARG N N 211 116.885 116.885 116.659 0.226 17569 13793 1 22 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.475 0.567 17569 13794 1 22 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.427 -1.027 17569 13795 1 22 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.420 2.864 17569 13796 1 22 . 1 1 57 57 ARG H H 211 8.365 8.365 7.422 0.943 17569 13797 1 22 . 1 1 58 58 ASP N N 212 121.982 121.982 117.911 4.071 17569 13798 1 22 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.372 0.243 17569 13799 1 22 . 1 1 58 58 ASP CA C 212 52.222 52.222 56.831 -4.609 17569 13800 1 22 . 1 1 58 58 ASP CB C 212 41.502 41.502 39.564 1.938 17569 13801 1 22 . 1 1 58 58 ASP H H 212 8.706 8.706 8.309 0.397 17569 13802 1 22 . 1 1 59 59 SER N N 213 114.164 114.164 116.787 -2.623 17569 13803 1 22 . 1 1 59 59 SER HA H 213 4.212 4.212 4.200 0.012 17569 13804 1 22 . 1 1 59 59 SER CA C 213 60.840 60.840 60.825 0.015 17569 13805 1 22 . 1 1 59 59 SER CB C 213 62.714 62.714 63.143 -0.429 17569 13806 1 22 . 1 1 59 59 SER H H 213 8.687 8.687 7.929 0.758 17569 13807 1 22 . 1 1 60 60 ASP N N 214 120.899 120.899 119.735 1.164 17569 13808 1 22 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.692 0.133 17569 13809 1 22 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.839 0.372 17569 13810 1 22 . 1 1 60 60 ASP CB C 214 41.558 41.558 39.743 1.815 17569 13811 1 22 . 1 1 60 60 ASP H H 214 8.193 8.193 7.650 0.543 17569 13812 1 22 . 1 1 61 61 GLY N N 215 108.300 108.300 108.588 -0.288 17569 13813 1 22 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.852 -0.455 17569 13814 1 22 . 1 1 61 61 GLY H H 215 8.234 8.234 8.098 0.136 17569 13815 1 22 . 1 1 62 62 MET N N 216 120.002 120.002 119.004 0.998 17569 13816 1 22 . 1 1 62 62 MET HA H 216 4.972 4.972 4.517 0.455 17569 13817 1 22 . 1 1 62 62 MET CA C 216 53.151 53.151 54.003 -0.852 17569 13818 1 22 . 1 1 62 62 MET CB C 216 32.311 32.311 33.837 -1.526 17569 13819 1 22 . 1 1 62 62 MET H H 216 8.376 8.376 7.433 0.943 17569 13820 1 22 . 1 1 63 63 ASP N N 217 127.300 127.300 123.247 4.053 17569 13821 1 22 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.568 0.398 17569 13822 1 22 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.585 -0.016 17569 13823 1 22 . 1 1 63 63 ASP H H 217 9.368 9.368 8.557 0.811 17569 13824 1 22 . 1 1 64 64 GLU N N 218 114.400 114.400 125.069 -10.669 17569 13825 1 22 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.411 -0.255 17569 13826 1 22 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.411 0.439 17569 13827 1 22 . 1 1 64 64 GLU H H 218 8.583 8.583 8.538 0.045 17569 13828 1 22 . 1 1 65 65 GLN N N 219 115.500 115.500 117.022 -1.522 17569 13829 1 22 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.631 -0.320 17569 13830 1 22 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.409 -0.063 17569 13831 1 22 . 1 1 65 65 GLN H H 219 7.158 7.158 7.801 -0.643 17569 13832 1 22 . 1 1 66 66 CYS N N 220 122.600 122.600 117.881 4.719 17569 13833 1 22 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.400 -1.323 17569 13834 1 22 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.754 0.775 17569 13835 1 22 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.358 1.614 17569 13836 1 22 . 1 1 66 66 CYS H H 220 8.248 8.248 8.351 -0.103 17569 13837 1 22 . 1 1 67 67 ARG N N 221 130.363 130.363 124.525 5.838 17569 13838 1 22 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.540 -0.473 17569 13839 1 22 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.836 -2.820 17569 13840 1 22 . 1 1 67 67 ARG H H 221 9.145 9.145 8.844 0.301 17569 13841 1 22 . 1 1 68 68 TRP N N 222 124.200 124.200 120.803 3.397 17569 13842 1 22 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.720 -0.284 17569 13843 1 22 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.443 0.637 17569 13844 1 22 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.319 0.875 17569 13845 1 22 . 1 1 68 68 TRP H H 222 9.689 9.689 8.274 1.415 17569 13846 1 22 . 1 1 69 69 CYS N N 223 116.297 116.297 111.468 4.829 17569 13847 1 22 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.161 -0.070 17569 13848 1 22 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.429 2.673 17569 13849 1 22 . 1 1 69 69 CYS CB C 223 32.338 32.338 26.672 5.665 17569 13850 1 22 . 1 1 69 69 CYS H H 223 8.822 8.822 7.846 0.976 17569 13851 1 22 . 1 1 70 70 ALA N N 224 123.112 123.112 123.764 -0.652 17569 13852 1 22 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.277 0.129 17569 13853 1 22 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.504 -0.653 17569 13854 1 22 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.707 0.013 17569 13855 1 22 . 1 1 70 70 ALA H H 224 8.787 8.787 8.167 0.620 17569 13856 1 22 . 1 1 71 71 GLU N N 225 118.300 118.300 121.396 -3.096 17569 13857 1 22 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.529 0.779 17569 13858 1 22 . 1 1 71 71 GLU CA C 225 53.299 53.299 56.068 -2.768 17569 13859 1 22 . 1 1 71 71 GLU H H 225 8.541 8.541 8.025 0.516 17569 13860 1 22 . 1 1 72 72 GLY N N 226 111.995 111.995 110.113 1.882 17569 13861 1 22 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.630 -0.227 17569 13862 1 22 . 1 1 72 72 GLY H H 226 9.837 9.837 8.679 1.158 17569 13863 1 22 . 1 1 73 73 GLY N N 227 106.600 106.600 108.104 -1.504 17569 13864 1 22 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.517 0.454 17569 13865 1 22 . 1 1 73 73 GLY H H 227 7.772 7.772 8.271 -0.499 17569 13866 1 22 . 1 1 74 74 ASN N N 228 124.277 124.277 122.313 1.964 17569 13867 1 22 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.797 0.284 17569 13868 1 22 . 1 1 74 74 ASN CA C 228 53.100 53.100 52.851 0.249 17569 13869 1 22 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.465 -0.381 17569 13870 1 22 . 1 1 74 74 ASN H H 228 8.876 8.876 8.438 0.438 17569 13871 1 22 . 1 1 75 75 LEU N N 229 123.050 123.050 125.495 -2.445 17569 13872 1 22 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.908 -0.308 17569 13873 1 22 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.587 0.775 17569 13874 1 22 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.071 -0.571 17569 13875 1 22 . 1 1 75 75 LEU H H 229 8.901 8.901 8.075 0.826 17569 13876 1 22 . 1 1 76 76 ILE N N 230 123.552 123.552 124.326 -0.774 17569 13877 1 22 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.080 0.405 17569 13878 1 22 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.401 -0.701 17569 13879 1 22 . 1 1 76 76 ILE CB C 230 37.399 37.399 37.329 0.070 17569 13880 1 22 . 1 1 76 76 ILE H H 230 9.406 9.406 9.045 0.361 17569 13881 1 22 . 1 1 77 77 CYS N N 231 124.637 124.637 126.756 -2.119 17569 13882 1 22 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.294 -0.419 17569 13883 1 22 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.035 0.324 17569 13884 1 22 . 1 1 77 77 CYS CB C 231 29.434 29.434 27.947 1.487 17569 13885 1 22 . 1 1 77 77 CYS H H 231 8.809 8.809 8.569 0.240 17569 13886 1 22 . 1 1 78 78 CYS N N 232 125.697 125.697 121.915 3.782 17569 13887 1 22 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.805 -0.521 17569 13888 1 22 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.592 4.292 17569 13889 1 22 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.502 1.669 17569 13890 1 22 . 1 1 78 78 CYS H H 232 8.579 8.579 8.764 -0.185 17569 13891 1 22 . 1 1 79 79 ASP N N 233 123.600 123.600 124.964 -1.364 17569 13892 1 22 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.548 0.209 17569 13893 1 22 . 1 1 79 79 ASP CA C 233 56.989 56.989 53.974 3.015 17569 13894 1 22 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.711 0.918 17569 13895 1 22 . 1 1 79 79 ASP H H 233 8.577 8.577 8.543 0.034 17569 13896 1 22 . 1 1 80 80 PHE N N 234 122.100 122.100 116.383 5.717 17569 13897 1 22 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.559 -0.033 17569 13898 1 22 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.153 1.756 17569 13899 1 22 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.500 1.349 17569 13900 1 22 . 1 1 80 80 PHE H H 234 10.432 10.432 7.224 3.208 17569 13901 1 22 . 1 1 81 81 CYS N N 235 124.300 124.300 117.607 6.693 17569 13902 1 22 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.669 0.487 17569 13903 1 22 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.801 0.244 17569 13904 1 22 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.153 4.254 17569 13905 1 22 . 1 1 81 81 CYS H H 235 8.476 8.476 7.897 0.579 17569 13906 1 22 . 1 1 82 82 HIS N N 236 112.598 112.598 119.378 -6.780 17569 13907 1 22 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.151 0.832 17569 13908 1 22 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.078 -1.681 17569 13909 1 22 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.912 2.345 17569 13910 1 22 . 1 1 82 82 HIS H H 236 6.699 6.699 8.105 -1.406 17569 13911 1 22 . 1 1 83 83 ASN N N 237 123.600 123.600 117.992 5.608 17569 13912 1 22 . 1 1 83 83 ASN HA H 237 4.801 4.801 5.217 -0.416 17569 13913 1 22 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.442 3.174 17569 13914 1 22 . 1 1 83 83 ASN H H 237 9.097 9.097 7.796 1.301 17569 13915 1 22 . 1 1 84 84 ALA N N 238 122.000 122.000 123.466 -1.466 17569 13916 1 22 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.159 0.250 17569 13917 1 22 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.350 0.014 17569 13918 1 22 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.356 2.714 17569 13919 1 22 . 1 1 84 84 ALA H H 238 9.885 9.885 8.509 1.376 17569 13920 1 22 . 1 1 85 85 PHE N N 239 116.707 116.707 121.492 -4.785 17569 13921 1 22 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.177 0.851 17569 13922 1 22 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.170 0.047 17569 13923 1 22 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.402 2.262 17569 13924 1 22 . 1 1 85 85 PHE H H 239 9.450 9.450 8.921 0.529 17569 13925 1 22 . 1 1 86 86 CYS N N 240 126.682 126.682 124.214 2.468 17569 13926 1 22 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.762 0.860 17569 13927 1 22 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.620 -0.278 17569 13928 1 22 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.262 2.994 17569 13929 1 22 . 1 1 86 86 CYS H H 240 11.309 11.309 9.504 1.805 17569 13930 1 22 . 1 1 87 87 LYS N N 241 117.865 117.865 123.542 -5.677 17569 13931 1 22 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.902 -0.053 17569 13932 1 22 . 1 1 87 87 LYS CA C 241 60.070 60.070 59.829 0.241 17569 13933 1 22 . 1 1 87 87 LYS CB C 241 32.798 32.798 31.948 0.850 17569 13934 1 22 . 1 1 87 87 LYS H H 241 8.230 8.230 8.939 -0.709 17569 13935 1 22 . 1 1 88 88 LYS N N 242 117.949 117.949 119.690 -1.741 17569 13936 1 22 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.113 -0.135 17569 13937 1 22 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.887 1.483 17569 13938 1 22 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.995 0.321 17569 13939 1 22 . 1 1 88 88 LYS H H 242 7.945 7.945 8.432 -0.487 17569 13940 1 22 . 1 1 89 89 CYS N N 243 125.305 125.305 117.551 7.754 17569 13941 1 22 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.243 -0.501 17569 13942 1 22 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.201 2.626 17569 13943 1 22 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.361 0.880 17569 13944 1 22 . 1 1 89 89 CYS H H 243 9.297 9.297 7.776 1.521 17569 13945 1 22 . 1 1 90 90 ILE N N 244 119.687 119.687 121.656 -1.969 17569 13946 1 22 . 1 1 90 90 ILE HA H 244 3.607 3.607 4.077 -0.470 17569 13947 1 22 . 1 1 90 90 ILE CA C 244 65.950 65.950 63.915 2.035 17569 13948 1 22 . 1 1 90 90 ILE H H 244 7.997 7.997 7.670 0.327 17569 13949 1 22 . 1 1 91 91 LEU N N 245 120.280 120.280 121.445 -1.165 17569 13950 1 22 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.404 -0.719 17569 13951 1 22 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.712 0.523 17569 13952 1 22 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.774 0.184 17569 13953 1 22 . 1 1 91 91 LEU H H 245 8.810 8.810 8.859 -0.049 17569 13954 1 22 . 1 1 92 92 ARG N N 246 116.901 116.901 117.598 -0.697 17569 13955 1 22 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.116 -0.299 17569 13956 1 22 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.006 0.974 17569 13957 1 22 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.073 0.527 17569 13958 1 22 . 1 1 92 92 ARG H H 246 8.086 8.086 7.669 0.417 17569 13959 1 22 . 1 1 93 93 ASN N N 247 111.200 111.200 115.510 -4.310 17569 13960 1 22 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.485 0.118 17569 13961 1 22 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.736 1.072 17569 13962 1 22 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.991 3.493 17569 13963 1 22 . 1 1 93 93 ASN H H 247 7.136 7.136 8.139 -1.003 17569 13964 1 22 . 1 1 94 94 LEU N N 248 118.807 118.807 117.305 1.502 17569 13965 1 22 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.558 0.256 17569 13966 1 22 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.056 0.133 17569 13967 1 22 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.702 -0.004 17569 13968 1 22 . 1 1 94 94 LEU H H 248 8.515 8.515 7.948 0.567 17569 13969 1 22 . 1 1 95 95 GLY N N 249 108.000 108.000 106.168 1.832 17569 13970 1 22 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.684 -0.056 17569 13971 1 22 . 1 1 95 95 GLY H H 249 7.955 7.955 7.826 0.129 17569 13972 1 22 . 1 1 96 96 ARG N N 250 117.797 117.797 121.885 -4.088 17569 13973 1 22 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.230 -0.387 17569 13974 1 22 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.233 0.449 17569 13975 1 22 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.227 -0.367 17569 13976 1 22 . 1 1 96 96 ARG H H 250 8.559 8.559 8.565 -0.006 17569 13977 1 22 . 1 1 97 97 LYS N N 251 120.900 120.900 119.840 1.060 17569 13978 1 22 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.016 0.140 17569 13979 1 22 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.381 -0.225 17569 13980 1 22 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.689 -0.328 17569 13981 1 22 . 1 1 97 97 LYS H H 251 8.655 8.655 8.588 0.067 17569 13982 1 22 . 1 1 98 98 GLU N N 252 122.000 122.000 119.031 2.969 17569 13983 1 22 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.087 0.264 17569 13984 1 22 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.198 -0.616 17569 13985 1 22 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.401 -1.001 17569 13986 1 22 . 1 1 98 98 GLU H H 252 7.705 7.705 8.340 -0.635 17569 13987 1 22 . 1 1 99 99 LEU N N 253 117.400 117.400 120.833 -3.433 17569 13988 1 22 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.791 0.126 17569 13989 1 22 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.040 -0.042 17569 13990 1 22 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.814 -0.332 17569 13991 1 22 . 1 1 99 99 LEU H H 253 7.285 7.285 7.673 -0.388 17569 13992 1 22 . 1 1 100 100 SER N N 254 112.100 112.100 113.911 -1.811 17569 13993 1 22 . 1 1 100 100 SER HA H 254 4.107 4.107 4.095 0.012 17569 13994 1 22 . 1 1 100 100 SER CA C 254 61.603 61.603 61.646 -0.043 17569 13995 1 22 . 1 1 100 100 SER CB C 254 62.622 62.622 63.099 -0.477 17569 13996 1 22 . 1 1 100 100 SER H H 254 8.326 8.326 8.040 0.286 17569 13997 1 22 . 1 1 101 101 THR N N 255 118.151 118.151 118.363 -0.212 17569 13998 1 22 . 1 1 101 101 THR HA H 255 4.026 4.026 4.101 -0.075 17569 13999 1 22 . 1 1 101 101 THR CA C 255 66.261 66.261 66.540 -0.279 17569 14000 1 22 . 1 1 101 101 THR CB C 255 68.735 68.735 68.705 0.030 17569 14001 1 22 . 1 1 101 101 THR H H 255 7.972 7.972 7.808 0.164 17569 14002 1 22 . 1 1 102 102 ILE N N 256 120.100 120.100 123.458 -3.358 17569 14003 1 22 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.905 -0.442 17569 14004 1 22 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.616 0.158 17569 14005 1 22 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.481 0.260 17569 14006 1 22 . 1 1 102 102 ILE H H 256 7.868 7.868 8.633 -0.765 17569 14007 1 22 . 1 1 103 103 MET N N 257 114.876 114.876 116.705 -1.829 17569 14008 1 22 . 1 1 103 103 MET HA H 257 4.211 4.211 4.100 0.111 17569 14009 1 22 . 1 1 103 103 MET CA C 257 55.691 55.691 57.564 -1.873 17569 14010 1 22 . 1 1 103 103 MET CB C 257 32.000 32.000 32.199 -0.199 17569 14011 1 22 . 1 1 103 103 MET H H 257 7.606 7.606 7.309 0.297 17569 14012 1 22 . 1 1 104 104 ASP N N 258 119.976 119.976 119.190 0.786 17569 14013 1 22 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.813 -0.275 17569 14014 1 22 . 1 1 104 104 ASP CA C 258 54.912 54.912 54.101 0.811 17569 14015 1 22 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.326 1.174 17569 14016 1 22 . 1 1 104 104 ASP H H 258 7.444 7.444 7.607 -0.163 17569 14017 1 22 . 1 1 105 105 GLU N N 259 124.388 124.388 120.483 3.905 17569 14018 1 22 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.471 -0.184 17569 14019 1 22 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.443 2.128 17569 14020 1 22 . 1 1 105 105 GLU CB C 259 29.542 29.542 30.124 -0.582 17569 14021 1 22 . 1 1 105 105 GLU H H 259 8.559 8.559 8.177 0.382 17569 14022 1 22 . 1 1 106 106 ASN N N 260 117.201 117.201 119.281 -2.080 17569 14023 1 22 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.408 0.334 17569 14024 1 22 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.831 -0.088 17569 14025 1 22 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.363 1.555 17569 14026 1 22 . 1 1 106 106 ASN H H 260 8.673 8.673 8.479 0.194 17569 14027 1 22 . 1 1 107 107 ASN N N 261 117.900 117.900 112.760 5.140 17569 14028 1 22 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.329 0.656 17569 14029 1 22 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.711 -2.409 17569 14030 1 22 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.360 3.254 17569 14031 1 22 . 1 1 107 107 ASN H H 261 7.956 7.956 8.741 -0.785 17569 14032 1 22 . 1 1 108 108 GLN N N 262 121.500 121.500 115.327 6.173 17569 14033 1 22 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.040 0.568 17569 14034 1 22 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.837 0.938 17569 14035 1 22 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.832 0.726 17569 14036 1 22 . 1 1 108 108 GLN H H 262 8.493 8.493 7.522 0.971 17569 14037 1 22 . 1 1 109 109 TRP N N 263 128.056 128.056 123.405 4.651 17569 14038 1 22 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.960 0.011 17569 14039 1 22 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.023 1.073 17569 14040 1 22 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.520 0.973 17569 14041 1 22 . 1 1 109 109 TRP H H 263 10.497 10.497 8.050 2.447 17569 14042 1 22 . 1 1 110 110 TYR N N 264 126.600 126.600 126.170 0.430 17569 14043 1 22 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.214 0.188 17569 14044 1 22 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.787 -3.116 17569 14045 1 22 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.694 -0.686 17569 14046 1 22 . 1 1 110 110 TYR H H 264 7.545 7.545 8.084 -0.539 17569 14047 1 22 . 1 1 111 111 CYS N N 265 124.622 124.622 114.358 10.264 17569 14048 1 22 . 1 1 111 111 CYS H H 265 8.586 8.586 8.370 0.216 17569 14049 1 22 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.857 -0.665 17569 14050 1 22 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.798 0.917 17569 14051 1 22 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.742 1.178 17569 14052 1 22 . 1 1 113 113 ILE N N 267 119.504 119.504 119.768 -0.264 17569 14053 1 22 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.552 -0.602 17569 14054 1 22 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.911 0.338 17569 14055 1 22 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.559 -3.026 17569 14056 1 22 . 1 1 113 113 ILE H H 267 9.160 9.160 7.509 1.651 17569 14057 1 22 . 1 1 114 114 CYS N N 268 124.100 124.100 118.372 5.728 17569 14058 1 22 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.180 -0.366 17569 14059 1 22 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.709 3.591 17569 14060 1 22 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.082 2.639 17569 14061 1 22 . 1 1 114 114 CYS H H 268 7.818 7.818 8.248 -0.430 17569 14062 1 22 . 1 1 115 115 HIS N N 269 117.127 117.127 111.304 5.823 17569 14063 1 22 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.665 0.464 17569 14064 1 22 . 1 1 115 115 HIS CA C 269 52.161 52.161 52.968 -0.807 17569 14065 1 22 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.929 2.263 17569 14066 1 22 . 1 1 115 115 HIS H H 269 8.953 8.953 7.793 1.160 17569 14067 1 22 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.441 0.501 17569 14068 1 22 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.443 -0.135 17569 14069 1 22 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.675 0.966 17569 14070 1 22 . 1 1 117 117 GLU N N 271 123.504 123.504 123.031 0.473 17569 14071 1 22 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.457 -0.437 17569 14072 1 22 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.068 3.801 17569 14073 1 22 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.689 -1.638 17569 14074 1 22 . 1 1 117 117 GLU H H 271 8.402 8.402 8.124 0.278 17569 14075 1 22 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.564 -0.022 17569 14076 1 22 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.708 1.651 17569 14077 1 22 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.410 0.732 17569 14078 1 22 . 1 1 119 119 LEU N N 273 112.296 112.296 113.924 -1.628 17569 14079 1 22 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.926 -0.452 17569 14080 1 22 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.573 -0.031 17569 14081 1 22 . 1 1 119 119 LEU H H 273 8.090 8.090 7.440 0.650 17569 14082 1 22 . 1 1 120 120 LEU N N 274 121.388 121.388 123.772 -2.384 17569 14083 1 22 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.918 0.109 17569 14084 1 22 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.518 -0.217 17569 14085 1 22 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.452 0.648 17569 14086 1 22 . 1 1 120 120 LEU H H 274 7.823 7.823 8.324 -0.501 17569 14087 1 22 . 1 1 121 121 ASP N N 275 118.600 118.600 118.751 -0.151 17569 14088 1 22 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.369 0.172 17569 14089 1 22 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.296 0.407 17569 14090 1 22 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.373 -0.930 17569 14091 1 22 . 1 1 121 121 ASP H H 275 8.694 8.694 8.502 0.192 17569 14092 1 22 . 1 1 122 122 LEU N N 276 123.192 123.192 120.731 2.461 17569 14093 1 22 . 1 1 122 122 LEU HA H 276 4.392 4.392 4.074 0.318 17569 14094 1 22 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.830 0.142 17569 14095 1 22 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.063 0.478 17569 14096 1 22 . 1 1 122 122 LEU H H 276 8.013 8.013 7.270 0.743 17569 14097 1 22 . 1 1 123 123 VAL N N 277 126.898 126.898 118.701 8.197 17569 14098 1 22 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.720 0.135 17569 14099 1 22 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.344 0.319 17569 14100 1 22 . 1 1 123 123 VAL CB C 277 32.058 32.058 30.751 1.307 17569 14101 1 22 . 1 1 123 123 VAL H H 277 8.781 8.781 7.929 0.852 17569 14102 1 22 . 1 1 124 124 THR N N 278 117.500 117.500 116.560 0.940 17569 14103 1 22 . 1 1 124 124 THR HA H 278 4.030 4.030 3.950 0.080 17569 14104 1 22 . 1 1 124 124 THR CA C 278 66.589 66.589 67.078 -0.489 17569 14105 1 22 . 1 1 124 124 THR CB C 278 68.410 68.410 68.348 0.062 17569 14106 1 22 . 1 1 124 124 THR H H 278 8.722 8.722 8.311 0.411 17569 14107 1 22 . 1 1 125 125 ALA N N 279 124.700 124.700 124.364 0.336 17569 14108 1 22 . 1 1 125 125 ALA HA H 279 4.261 4.261 3.968 0.293 17569 14109 1 22 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.257 0.039 17569 14110 1 22 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.962 -0.013 17569 14111 1 22 . 1 1 125 125 ALA H H 279 8.239 8.239 8.290 -0.051 17569 14112 1 22 . 1 1 126 126 CYS N N 280 119.276 119.276 117.380 1.896 17569 14113 1 22 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.849 0.265 17569 14114 1 22 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.838 -1.735 17569 14115 1 22 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.823 -1.327 17569 14116 1 22 . 1 1 126 126 CYS H H 280 8.128 8.128 7.755 0.373 17569 14117 1 22 . 1 1 127 127 ASN N N 281 118.000 118.000 118.103 -0.103 17569 14118 1 22 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.565 -0.005 17569 14119 1 22 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.575 -0.436 17569 14120 1 22 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.905 -0.940 17569 14121 1 22 . 1 1 127 127 ASN H H 281 8.725 8.725 7.941 0.784 17569 14122 1 22 . 1 1 128 128 SER N N 282 116.601 116.601 116.323 0.278 17569 14123 1 22 . 1 1 128 128 SER HA H 282 4.363 4.363 4.229 0.134 17569 14124 1 22 . 1 1 128 128 SER CA C 282 61.899 61.899 61.459 0.440 17569 14125 1 22 . 1 1 128 128 SER CB C 282 62.630 62.630 62.919 -0.289 17569 14126 1 22 . 1 1 128 128 SER H H 282 8.542 8.542 7.837 0.705 17569 14127 1 22 . 1 1 129 129 VAL N N 283 123.272 123.272 121.926 1.346 17569 14128 1 22 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.548 0.129 17569 14129 1 22 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.857 -0.349 17569 14130 1 22 . 1 1 129 129 VAL CB C 283 31.218 31.218 30.937 0.281 17569 14131 1 22 . 1 1 129 129 VAL H H 283 7.990 7.990 8.031 -0.041 17569 14132 1 22 . 1 1 130 130 PHE N N 284 118.594 118.594 118.949 -0.355 17569 14133 1 22 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.237 -0.224 17569 14134 1 22 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.417 2.083 17569 14135 1 22 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.032 0.964 17569 14136 1 22 . 1 1 130 130 PHE H H 284 8.190 8.190 7.912 0.278 17569 14137 1 22 . 1 1 131 131 GLU N N 285 120.905 120.905 119.911 0.994 17569 14138 1 22 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.030 0.175 17569 14139 1 22 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.761 -0.547 17569 14140 1 22 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.388 0.112 17569 14141 1 22 . 1 1 131 131 GLU H H 285 8.699 8.699 8.695 0.004 17569 14142 1 22 . 1 1 132 132 ASN N N 286 117.997 117.997 118.267 -0.270 17569 14143 1 22 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.629 -0.034 17569 14144 1 22 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.039 -0.424 17569 14145 1 22 . 1 1 132 132 ASN CB C 286 38.852 38.852 39.121 -0.269 17569 14146 1 22 . 1 1 132 132 ASN H H 286 8.082 8.082 8.183 -0.101 17569 14147 1 22 . 1 1 133 133 LEU N N 287 120.800 120.800 121.682 -0.882 17569 14148 1 22 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.372 -0.255 17569 14149 1 22 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.224 -0.426 17569 14150 1 22 . 1 1 133 133 LEU H H 287 7.904 7.904 8.605 -0.701 17569 14151 1 22 . 1 1 134 134 GLU N N 288 118.200 118.200 118.739 -0.539 17569 14152 1 22 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.934 0.145 17569 14153 1 22 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.838 -0.841 17569 14154 1 22 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.337 -0.095 17569 14155 1 22 . 1 1 134 134 GLU H H 288 8.157 8.157 8.329 -0.172 17569 14156 1 22 . 1 1 135 135 GLN N N 289 117.400 117.400 119.021 -1.621 17569 14157 1 22 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.076 0.098 17569 14158 1 22 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.636 -0.648 17569 14159 1 22 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.493 -0.413 17569 14160 1 22 . 1 1 135 135 GLN H H 289 7.869 7.869 7.609 0.260 17569 14161 1 22 . 1 1 136 136 LEU N N 290 121.000 121.000 121.695 -0.695 17569 14162 1 22 . 1 1 136 136 LEU HA H 290 4.173 4.173 4.070 0.103 17569 14163 1 22 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.841 -0.703 17569 14164 1 22 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.695 0.305 17569 14165 1 22 . 1 1 136 136 LEU H H 290 7.968 7.968 7.634 0.334 17569 14166 1 22 . 1 1 137 137 LEU N N 291 118.900 118.900 119.222 -0.322 17569 14167 1 22 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.054 0.187 17569 14168 1 22 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.421 -1.061 17569 14169 1 22 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.289 -0.817 17569 14170 1 22 . 1 1 137 137 LEU H H 291 8.154 8.154 7.682 0.472 17569 14171 1 22 . 1 1 138 138 GLN N N 292 117.993 117.993 115.715 2.278 17569 14172 1 22 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.273 -0.001 17569 14173 1 22 . 1 1 138 138 GLN CA C 292 56.632 56.632 56.846 -0.214 17569 14174 1 22 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.977 -1.393 17569 14175 1 22 . 1 1 138 138 GLN H H 292 7.896 7.896 7.613 0.283 17569 14176 1 22 . 1 1 139 139 GLN N N 293 118.889 118.889 119.796 -0.907 17569 14177 1 22 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.424 -0.155 17569 14178 1 22 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.045 1.409 17569 14179 1 22 . 1 1 139 139 GLN CB C 293 29.069 29.069 30.194 -1.125 17569 14180 1 22 . 1 1 139 139 GLN H H 293 8.091 8.091 8.338 -0.247 17569 14181 1 22 . 1 1 140 140 ASN N N 294 118.604 118.604 122.998 -4.394 17569 14182 1 22 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.993 -0.234 17569 14183 1 22 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.935 0.286 17569 14184 1 22 . 1 1 140 140 ASN CB C 294 38.733 38.733 41.464 -2.731 17569 14185 1 22 . 1 1 140 140 ASN H H 294 8.273 8.273 8.665 -0.392 17569 14186 1 22 . 1 1 141 141 LYS N N 295 121.685 121.685 121.251 0.434 17569 14187 1 22 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.793 -0.433 17569 14188 1 22 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.557 0.616 17569 14189 1 22 . 1 1 141 141 LYS CB C 295 32.535 32.535 34.384 -1.849 17569 14190 1 22 . 1 1 141 141 LYS H H 295 8.089 8.089 8.597 -0.508 17569 14191 1 23 . 1 1 2 2 ALA HA H 156 4.387 4.387 5.084 -0.697 17569 14192 1 23 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.018 0.427 17569 14193 1 23 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.087 0.169 17569 14194 1 23 . 1 1 3 3 MET HA H 157 4.476 4.476 4.770 -0.294 17569 14195 1 23 . 1 1 3 3 MET CA C 157 55.401 55.401 54.861 0.540 17569 14196 1 23 . 1 1 4 4 ALA N N 158 124.828 124.828 123.010 1.818 17569 14197 1 23 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.592 -0.278 17569 14198 1 23 . 1 1 4 4 ALA CA C 158 52.511 52.511 52.161 0.350 17569 14199 1 23 . 1 1 4 4 ALA CB C 158 19.001 19.001 19.840 -0.840 17569 14200 1 23 . 1 1 4 4 ALA H H 158 8.382 8.382 8.377 0.005 17569 14201 1 23 . 1 1 5 5 ASP N N 159 119.418 119.418 118.632 0.786 17569 14202 1 23 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.842 -0.252 17569 14203 1 23 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.695 0.441 17569 14204 1 23 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.940 -0.925 17569 14205 1 23 . 1 1 5 5 ASP H H 159 8.312 8.312 8.052 0.260 17569 14206 1 23 . 1 1 6 6 LYS N N 160 121.604 121.604 120.611 0.993 17569 14207 1 23 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.611 -0.268 17569 14208 1 23 . 1 1 6 6 LYS H H 160 8.274 8.274 8.330 -0.056 17569 14209 1 23 . 1 1 7 7 ARG N N 161 121.611 121.611 122.468 -0.857 17569 14210 1 23 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.413 -0.086 17569 14211 1 23 . 1 1 7 7 ARG H H 161 8.430 8.430 8.686 -0.256 17569 14212 1 23 . 1 1 8 8 GLY N N 162 109.606 109.606 112.762 -3.156 17569 14213 1 23 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.865 0.182 17569 14214 1 23 . 1 1 8 8 GLY H H 162 8.473 8.473 8.619 -0.146 17569 14215 1 23 . 1 1 9 9 ASP N N 163 120.187 120.187 121.380 -1.193 17569 14216 1 23 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.814 -0.165 17569 14217 1 23 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.468 0.683 17569 14218 1 23 . 1 1 9 9 ASP H H 163 8.296 8.296 8.093 0.203 17569 14219 1 23 . 1 1 10 10 GLY N N 164 108.816 108.816 110.625 -1.809 17569 14220 1 23 . 1 1 10 10 GLY CA C 164 45.367 45.367 44.895 0.472 17569 14221 1 23 . 1 1 10 10 GLY H H 164 8.458 8.458 8.410 0.048 17569 14222 1 23 . 1 1 11 11 LEU N N 165 121.195 121.195 120.157 1.038 17569 14223 1 23 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.543 -0.227 17569 14224 1 23 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.162 0.838 17569 14225 1 23 . 1 1 11 11 LEU CB C 165 41.932 41.932 44.274 -2.342 17569 14226 1 23 . 1 1 11 11 LEU H H 165 8.137 8.137 7.757 0.380 17569 14227 1 23 . 1 1 12 12 HIS N N 166 119.387 119.387 120.623 -1.236 17569 14228 1 23 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.329 0.326 17569 14229 1 23 . 1 1 12 12 HIS CA C 166 56.269 56.269 56.378 -0.109 17569 14230 1 23 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.686 1.012 17569 14231 1 23 . 1 1 12 12 HIS H H 166 8.270 8.270 8.605 -0.335 17569 14232 1 23 . 1 1 13 13 GLY N N 167 109.899 109.899 112.777 -2.878 17569 14233 1 23 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.556 0.549 17569 14234 1 23 . 1 1 13 13 GLY H H 167 8.276 8.276 8.118 0.158 17569 14235 1 23 . 1 1 14 14 ILE N N 168 119.597 119.597 124.336 -4.739 17569 14236 1 23 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.223 0.100 17569 14237 1 23 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.993 0.607 17569 14238 1 23 . 1 1 14 14 ILE CB C 168 38.950 38.950 40.507 -1.556 17569 14239 1 23 . 1 1 14 14 ILE H H 168 7.962 7.962 7.966 -0.004 17569 14240 1 23 . 1 1 15 15 VAL N N 169 127.578 127.578 129.226 -1.648 17569 14241 1 23 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.014 0.266 17569 14242 1 23 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.121 -0.804 17569 14243 1 23 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.251 2.151 17569 14244 1 23 . 1 1 15 15 VAL H H 169 9.011 9.011 8.510 0.501 17569 14245 1 23 . 1 1 16 16 SER N N 170 118.596 118.596 120.690 -2.094 17569 14246 1 23 . 1 1 16 16 SER HA H 170 5.140 5.140 4.874 0.266 17569 14247 1 23 . 1 1 16 16 SER CA C 170 55.985 55.985 56.072 -0.087 17569 14248 1 23 . 1 1 16 16 SER CB C 170 65.261 65.261 65.371 -0.110 17569 14249 1 23 . 1 1 16 16 SER H H 170 8.242 8.242 7.783 0.459 17569 14250 1 23 . 1 1 17 17 CYS N N 171 123.783 123.783 123.729 0.054 17569 14251 1 23 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.117 0.064 17569 14252 1 23 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.547 -0.703 17569 14253 1 23 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.954 2.419 17569 14254 1 23 . 1 1 17 17 CYS H H 171 8.894 8.894 8.484 0.410 17569 14255 1 23 . 1 1 18 18 THR N N 172 121.703 121.703 117.858 3.845 17569 14256 1 23 . 1 1 18 18 THR HA H 172 4.386 4.386 4.091 0.295 17569 14257 1 23 . 1 1 18 18 THR CA C 172 64.667 64.667 64.543 0.123 17569 14258 1 23 . 1 1 18 18 THR CB C 172 69.498 69.498 68.671 0.827 17569 14259 1 23 . 1 1 18 18 THR H H 172 8.788 8.788 8.233 0.555 17569 14260 1 23 . 1 1 19 19 ALA N N 173 131.364 131.364 122.061 9.303 17569 14261 1 23 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.089 0.407 17569 14262 1 23 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.577 0.448 17569 14263 1 23 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.720 3.462 17569 14264 1 23 . 1 1 19 19 ALA H H 173 9.680 9.680 8.142 1.538 17569 14265 1 23 . 1 1 20 20 CYS N N 174 115.498 115.498 114.877 0.621 17569 14266 1 23 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.636 0.333 17569 14267 1 23 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.630 -1.536 17569 14268 1 23 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.369 4.875 17569 14269 1 23 . 1 1 20 20 CYS H H 174 8.470 8.470 7.997 0.473 17569 14270 1 23 . 1 1 21 21 GLY N N 175 112.464 112.464 109.144 3.320 17569 14271 1 23 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.000 0.706 17569 14272 1 23 . 1 1 21 21 GLY H H 175 7.884 7.884 7.986 -0.102 17569 14273 1 23 . 1 1 22 22 GLN N N 176 121.784 121.784 118.022 3.762 17569 14274 1 23 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.459 -0.083 17569 14275 1 23 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.564 1.727 17569 14276 1 23 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.762 -2.421 17569 14277 1 23 . 1 1 22 22 GLN H H 176 8.723 8.723 7.832 0.891 17569 14278 1 23 . 1 1 23 23 GLN N N 177 122.900 122.900 122.573 0.327 17569 14279 1 23 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.155 0.375 17569 14280 1 23 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.896 -0.346 17569 14281 1 23 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.237 -0.777 17569 14282 1 23 . 1 1 23 23 GLN H H 177 8.721 8.721 8.535 0.186 17569 14283 1 23 . 1 1 24 24 VAL N N 178 121.000 121.000 124.466 -3.466 17569 14284 1 23 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.053 0.471 17569 14285 1 23 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.088 -1.211 17569 14286 1 23 . 1 1 24 24 VAL H H 178 8.689 8.689 8.367 0.322 17569 14287 1 23 . 1 1 25 25 ASN N N 179 121.392 121.392 124.199 -2.807 17569 14288 1 23 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.485 0.391 17569 14289 1 23 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.754 -2.605 17569 14290 1 23 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.626 -0.649 17569 14291 1 23 . 1 1 25 25 ASN H H 179 8.635 8.635 8.169 0.466 17569 14292 1 23 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.145 0.315 17569 14293 1 23 . 1 1 27 27 PHE CA C 181 56.998 56.998 58.883 -1.885 17569 14294 1 23 . 1 1 27 27 PHE CB C 181 38.393 38.393 37.473 0.920 17569 14295 1 23 . 1 1 28 28 GLN N N 182 119.300 119.300 119.201 0.099 17569 14296 1 23 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.352 0.166 17569 14297 1 23 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.458 -2.116 17569 14298 1 23 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.242 0.108 17569 14299 1 23 . 1 1 28 28 GLN H H 182 7.494 7.494 7.677 -0.183 17569 14300 1 23 . 1 1 29 29 LYS N N 183 124.516 124.516 125.965 -1.449 17569 14301 1 23 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.517 -0.595 17569 14302 1 23 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.617 1.695 17569 14303 1 23 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.164 0.122 17569 14304 1 23 . 1 1 29 29 LYS H H 183 8.779 8.779 8.629 0.150 17569 14305 1 23 . 1 1 30 30 ASP N N 184 116.500 116.500 118.622 -2.122 17569 14306 1 23 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.803 -0.344 17569 14307 1 23 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.863 -0.327 17569 14308 1 23 . 1 1 30 30 ASP CB C 184 39.971 39.971 41.391 -1.420 17569 14309 1 23 . 1 1 30 30 ASP H H 184 8.556 8.556 8.192 0.364 17569 14310 1 23 . 1 1 31 31 SER N N 185 111.505 111.505 114.476 -2.971 17569 14311 1 23 . 1 1 31 31 SER HA H 185 4.695 4.695 4.762 -0.067 17569 14312 1 23 . 1 1 31 31 SER CA C 185 59.747 59.747 58.033 1.714 17569 14313 1 23 . 1 1 31 31 SER CB C 185 65.198 65.198 63.388 1.810 17569 14314 1 23 . 1 1 31 31 SER H H 185 7.933 7.933 8.406 -0.473 17569 14315 1 23 . 1 1 32 32 ILE N N 186 113.394 113.394 116.394 -3.000 17569 14316 1 23 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.047 -0.161 17569 14317 1 23 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.350 -0.771 17569 14318 1 23 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.498 1.313 17569 14319 1 23 . 1 1 32 32 ILE H H 186 7.105 7.105 7.540 -0.435 17569 14320 1 23 . 1 1 33 33 TYR N N 187 119.098 119.098 120.715 -1.617 17569 14321 1 23 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.163 -0.640 17569 14322 1 23 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.998 1.262 17569 14323 1 23 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.169 2.271 17569 14324 1 23 . 1 1 33 33 TYR H H 187 8.954 8.954 7.809 1.145 17569 14325 1 23 . 1 1 34 34 ARG N N 188 118.502 118.502 122.615 -4.113 17569 14326 1 23 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.773 -0.136 17569 14327 1 23 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.431 -1.679 17569 14328 1 23 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.744 0.507 17569 14329 1 23 . 1 1 34 34 ARG H H 188 8.412 8.412 8.847 -0.435 17569 14330 1 23 . 1 1 35 35 HIS N N 189 126.596 126.596 126.728 -0.132 17569 14331 1 23 . 1 1 35 35 HIS HA H 189 4.592 4.592 5.059 -0.467 17569 14332 1 23 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.283 0.438 17569 14333 1 23 . 1 1 35 35 HIS CB C 189 32.472 32.472 30.635 1.837 17569 14334 1 23 . 1 1 35 35 HIS H H 189 9.813 9.813 9.113 0.700 17569 14335 1 23 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.559 -0.261 17569 14336 1 23 . 1 1 36 36 PRO CA C 190 65.276 65.276 65.504 -0.228 17569 14337 1 23 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.275 0.576 17569 14338 1 23 . 1 1 37 37 SER N N 191 110.003 110.003 115.424 -5.421 17569 14339 1 23 . 1 1 37 37 SER HA H 191 4.918 4.918 4.298 0.620 17569 14340 1 23 . 1 1 37 37 SER CA C 191 59.031 59.031 61.762 -2.731 17569 14341 1 23 . 1 1 37 37 SER CB C 191 65.104 65.104 63.220 1.884 17569 14342 1 23 . 1 1 37 37 SER H H 191 8.934 8.934 8.736 0.198 17569 14343 1 23 . 1 1 38 38 LEU N N 192 120.959 120.959 114.172 6.787 17569 14344 1 23 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.845 -0.716 17569 14345 1 23 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.086 2.060 17569 14346 1 23 . 1 1 38 38 LEU CB C 192 43.996 43.996 41.319 2.677 17569 14347 1 23 . 1 1 38 38 LEU H H 192 8.649 8.649 7.065 1.584 17569 14348 1 23 . 1 1 39 39 GLN N N 193 108.600 108.600 116.539 -7.939 17569 14349 1 23 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.030 -0.125 17569 14350 1 23 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.802 0.012 17569 14351 1 23 . 1 1 39 39 GLN CB C 193 25.034 25.034 25.790 -0.756 17569 14352 1 23 . 1 1 39 39 GLN H H 193 8.465 8.465 7.665 0.800 17569 14353 1 23 . 1 1 40 40 VAL N N 194 105.325 105.325 117.468 -12.143 17569 14354 1 23 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.547 0.003 17569 14355 1 23 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.207 -0.566 17569 14356 1 23 . 1 1 40 40 VAL H H 194 6.256 6.256 7.613 -1.357 17569 14357 1 23 . 1 1 41 41 LEU N N 195 123.100 123.100 121.559 1.541 17569 14358 1 23 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.804 0.012 17569 14359 1 23 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.445 3.737 17569 14360 1 23 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.175 0.395 17569 14361 1 23 . 1 1 41 41 LEU H H 195 9.154 9.154 8.521 0.633 17569 14362 1 23 . 1 1 42 42 ILE N N 196 124.396 124.396 116.730 7.666 17569 14363 1 23 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.833 1.519 17569 14364 1 23 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.363 0.867 17569 14365 1 23 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.864 1.407 17569 14366 1 23 . 1 1 42 42 ILE H H 196 9.766 9.766 7.799 1.967 17569 14367 1 23 . 1 1 43 43 CYS N N 197 121.500 121.500 114.813 6.687 17569 14368 1 23 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.258 0.004 17569 14369 1 23 . 1 1 43 43 CYS CA C 197 56.703 56.703 55.898 0.805 17569 14370 1 23 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.058 2.243 17569 14371 1 23 . 1 1 43 43 CYS H H 197 9.882 9.882 8.316 1.566 17569 14372 1 23 . 1 1 44 44 LYS N N 198 117.995 117.995 122.483 -4.488 17569 14373 1 23 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.193 -0.204 17569 14374 1 23 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.262 -0.602 17569 14375 1 23 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.455 0.245 17569 14376 1 23 . 1 1 44 44 LYS H H 198 8.089 8.089 8.769 -0.680 17569 14377 1 23 . 1 1 45 45 ASN N N 199 119.200 119.200 117.274 1.926 17569 14378 1 23 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.542 -0.028 17569 14379 1 23 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.179 0.541 17569 14380 1 23 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.483 -0.316 17569 14381 1 23 . 1 1 45 45 ASN H H 199 8.356 8.356 8.576 -0.220 17569 14382 1 23 . 1 1 46 46 CYS N N 200 126.600 126.600 118.091 8.509 17569 14383 1 23 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.023 0.158 17569 14384 1 23 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.271 2.224 17569 14385 1 23 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.153 2.029 17569 14386 1 23 . 1 1 46 46 CYS H H 200 9.189 9.189 7.845 1.344 17569 14387 1 23 . 1 1 47 47 PHE N N 201 121.962 121.962 120.455 1.507 17569 14388 1 23 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.150 -0.280 17569 14389 1 23 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.804 1.464 17569 14390 1 23 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.583 0.584 17569 14391 1 23 . 1 1 47 47 PHE H H 201 8.826 8.826 7.805 1.021 17569 14392 1 23 . 1 1 48 48 LYS N N 202 117.400 117.400 120.381 -2.981 17569 14393 1 23 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.945 -0.247 17569 14394 1 23 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.572 -0.620 17569 14395 1 23 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.089 -0.547 17569 14396 1 23 . 1 1 48 48 LYS H H 202 8.512 8.512 8.173 0.339 17569 14397 1 23 . 1 1 49 49 TYR N N 203 120.400 120.400 120.284 0.116 17569 14398 1 23 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.204 0.210 17569 14399 1 23 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.582 -0.810 17569 14400 1 23 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.551 -0.105 17569 14401 1 23 . 1 1 49 49 TYR H H 203 8.133 8.133 7.759 0.374 17569 14402 1 23 . 1 1 50 50 TYR N N 204 121.783 121.783 118.440 3.343 17569 14403 1 23 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.549 -1.054 17569 14404 1 23 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.788 3.162 17569 14405 1 23 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.588 0.904 17569 14406 1 23 . 1 1 50 50 TYR H H 204 8.765 8.765 7.630 1.135 17569 14407 1 23 . 1 1 51 51 MET N N 205 110.800 110.800 116.062 -5.262 17569 14408 1 23 . 1 1 51 51 MET HA H 205 4.349 4.349 4.251 0.098 17569 14409 1 23 . 1 1 51 51 MET CA C 205 53.505 53.505 56.991 -3.486 17569 14410 1 23 . 1 1 51 51 MET CB C 205 30.384 30.384 32.376 -1.992 17569 14411 1 23 . 1 1 51 51 MET H H 205 7.771 7.771 8.566 -0.795 17569 14412 1 23 . 1 1 52 52 SER N N 206 116.800 116.800 113.987 2.813 17569 14413 1 23 . 1 1 52 52 SER HA H 206 3.919 3.919 4.369 -0.450 17569 14414 1 23 . 1 1 52 52 SER CA C 206 61.621 61.621 60.100 1.521 17569 14415 1 23 . 1 1 52 52 SER CB C 206 62.611 62.611 64.347 -1.736 17569 14416 1 23 . 1 1 52 52 SER H H 206 7.581 7.581 8.261 -0.680 17569 14417 1 23 . 1 1 53 53 ASP N N 207 117.400 117.400 121.036 -3.636 17569 14418 1 23 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.745 -0.173 17569 14419 1 23 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.376 -0.277 17569 14420 1 23 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.214 -0.026 17569 14421 1 23 . 1 1 53 53 ASP H H 207 7.085 7.085 8.002 -0.917 17569 14422 1 23 . 1 1 54 54 ASP N N 208 119.405 119.405 122.842 -3.437 17569 14423 1 23 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.884 -0.495 17569 14424 1 23 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.400 0.500 17569 14425 1 23 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.840 -1.491 17569 14426 1 23 . 1 1 54 54 ASP H H 208 8.439 8.439 8.290 0.149 17569 14427 1 23 . 1 1 55 55 ILE N N 209 124.698 124.698 120.850 3.848 17569 14428 1 23 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.229 -0.229 17569 14429 1 23 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.255 2.023 17569 14430 1 23 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.186 1.105 17569 14431 1 23 . 1 1 55 55 ILE H H 209 8.128 8.128 8.429 -0.301 17569 14432 1 23 . 1 1 56 56 SER N N 210 126.703 126.703 119.573 7.130 17569 14433 1 23 . 1 1 56 56 SER HA H 210 4.365 4.365 4.778 -0.413 17569 14434 1 23 . 1 1 56 56 SER CA C 210 57.769 57.769 57.535 0.235 17569 14435 1 23 . 1 1 56 56 SER CB C 210 64.991 64.991 64.538 0.453 17569 14436 1 23 . 1 1 56 56 SER H H 210 8.815 8.815 8.581 0.234 17569 14437 1 23 . 1 1 57 57 ARG N N 211 116.885 116.885 120.174 -3.289 17569 14438 1 23 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.536 0.506 17569 14439 1 23 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.321 -0.921 17569 14440 1 23 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.494 2.790 17569 14441 1 23 . 1 1 57 57 ARG H H 211 8.365 8.365 8.459 -0.094 17569 14442 1 23 . 1 1 58 58 ASP N N 212 121.982 121.982 121.253 0.729 17569 14443 1 23 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.583 0.032 17569 14444 1 23 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.782 -1.560 17569 14445 1 23 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.826 -1.324 17569 14446 1 23 . 1 1 58 58 ASP H H 212 8.706 8.706 8.682 0.024 17569 14447 1 23 . 1 1 59 59 SER N N 213 114.164 114.164 115.709 -1.545 17569 14448 1 23 . 1 1 59 59 SER HA H 213 4.212 4.212 4.257 -0.045 17569 14449 1 23 . 1 1 59 59 SER CA C 213 60.840 60.840 60.697 0.143 17569 14450 1 23 . 1 1 59 59 SER CB C 213 62.714 62.714 63.323 -0.609 17569 14451 1 23 . 1 1 59 59 SER H H 213 8.687 8.687 8.738 -0.051 17569 14452 1 23 . 1 1 60 60 ASP N N 214 120.899 120.899 119.520 1.379 17569 14453 1 23 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.770 0.055 17569 14454 1 23 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.552 0.659 17569 14455 1 23 . 1 1 60 60 ASP CB C 214 41.558 41.558 39.845 1.713 17569 14456 1 23 . 1 1 60 60 ASP H H 214 8.193 8.193 7.855 0.338 17569 14457 1 23 . 1 1 61 61 GLY N N 215 108.300 108.300 108.078 0.222 17569 14458 1 23 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.872 -0.475 17569 14459 1 23 . 1 1 61 61 GLY H H 215 8.234 8.234 7.713 0.521 17569 14460 1 23 . 1 1 62 62 MET N N 216 120.002 120.002 118.750 1.252 17569 14461 1 23 . 1 1 62 62 MET HA H 216 4.972 4.972 4.728 0.244 17569 14462 1 23 . 1 1 62 62 MET CA C 216 53.151 53.151 54.862 -1.711 17569 14463 1 23 . 1 1 62 62 MET CB C 216 32.311 32.311 32.860 -0.549 17569 14464 1 23 . 1 1 62 62 MET H H 216 8.376 8.376 7.727 0.649 17569 14465 1 23 . 1 1 63 63 ASP N N 217 127.300 127.300 119.217 8.083 17569 14466 1 23 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.311 0.655 17569 14467 1 23 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.800 -0.231 17569 14468 1 23 . 1 1 63 63 ASP H H 217 9.368 9.368 7.914 1.454 17569 14469 1 23 . 1 1 64 64 GLU N N 218 114.400 114.400 125.482 -11.082 17569 14470 1 23 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.603 -0.447 17569 14471 1 23 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.621 0.229 17569 14472 1 23 . 1 1 64 64 GLU H H 218 8.583 8.583 8.280 0.303 17569 14473 1 23 . 1 1 65 65 GLN N N 219 115.500 115.500 116.641 -1.141 17569 14474 1 23 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.492 -0.181 17569 14475 1 23 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.584 -0.238 17569 14476 1 23 . 1 1 65 65 GLN H H 219 7.158 7.158 7.878 -0.720 17569 14477 1 23 . 1 1 66 66 CYS N N 220 122.600 122.600 117.581 5.019 17569 14478 1 23 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.175 -1.098 17569 14479 1 23 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.868 0.661 17569 14480 1 23 . 1 1 66 66 CYS CB C 220 31.972 31.972 29.914 2.058 17569 14481 1 23 . 1 1 66 66 CYS H H 220 8.248 8.248 8.503 -0.255 17569 14482 1 23 . 1 1 67 67 ARG N N 221 130.363 130.363 124.077 6.286 17569 14483 1 23 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.409 -0.342 17569 14484 1 23 . 1 1 67 67 ARG CA C 221 55.016 55.016 58.313 -3.297 17569 14485 1 23 . 1 1 67 67 ARG H H 221 9.145 9.145 8.552 0.593 17569 14486 1 23 . 1 1 68 68 TRP N N 222 124.200 124.200 120.663 3.537 17569 14487 1 23 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.734 -0.297 17569 14488 1 23 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.252 0.828 17569 14489 1 23 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.699 0.495 17569 14490 1 23 . 1 1 68 68 TRP H H 222 9.689 9.689 8.221 1.468 17569 14491 1 23 . 1 1 69 69 CYS N N 223 116.297 116.297 111.617 4.680 17569 14492 1 23 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.228 -0.137 17569 14493 1 23 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.595 2.507 17569 14494 1 23 . 1 1 69 69 CYS CB C 223 32.338 32.338 26.894 5.444 17569 14495 1 23 . 1 1 69 69 CYS H H 223 8.822 8.822 7.882 0.940 17569 14496 1 23 . 1 1 70 70 ALA N N 224 123.112 123.112 123.626 -0.514 17569 14497 1 23 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.256 0.150 17569 14498 1 23 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.551 -0.700 17569 14499 1 23 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.602 0.118 17569 14500 1 23 . 1 1 70 70 ALA H H 224 8.787 8.787 8.195 0.592 17569 14501 1 23 . 1 1 71 71 GLU N N 225 118.300 118.300 120.720 -2.420 17569 14502 1 23 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.504 0.804 17569 14503 1 23 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.665 -2.366 17569 14504 1 23 . 1 1 71 71 GLU H H 225 8.541 8.541 8.229 0.312 17569 14505 1 23 . 1 1 72 72 GLY N N 226 111.995 111.995 109.387 2.608 17569 14506 1 23 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.306 0.097 17569 14507 1 23 . 1 1 72 72 GLY H H 226 9.837 9.837 8.231 1.606 17569 14508 1 23 . 1 1 73 73 GLY N N 227 106.600 106.600 107.698 -1.098 17569 14509 1 23 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.359 0.612 17569 14510 1 23 . 1 1 73 73 GLY H H 227 7.772 7.772 8.203 -0.431 17569 14511 1 23 . 1 1 74 74 ASN N N 228 124.277 124.277 119.236 5.041 17569 14512 1 23 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.469 0.612 17569 14513 1 23 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.880 -0.780 17569 14514 1 23 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.493 -0.409 17569 14515 1 23 . 1 1 74 74 ASN H H 228 8.876 8.876 8.514 0.362 17569 14516 1 23 . 1 1 75 75 LEU N N 229 123.050 123.050 122.382 0.668 17569 14517 1 23 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.927 -0.327 17569 14518 1 23 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.444 0.918 17569 14519 1 23 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.380 -0.880 17569 14520 1 23 . 1 1 75 75 LEU H H 229 8.901 8.901 8.038 0.863 17569 14521 1 23 . 1 1 76 76 ILE N N 230 123.552 123.552 122.454 1.098 17569 14522 1 23 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.040 0.445 17569 14523 1 23 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.466 -0.766 17569 14524 1 23 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.446 -1.047 17569 14525 1 23 . 1 1 76 76 ILE H H 230 9.406 9.406 9.203 0.203 17569 14526 1 23 . 1 1 77 77 CYS N N 231 124.637 124.637 126.830 -2.193 17569 14527 1 23 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.422 -0.547 17569 14528 1 23 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.953 0.406 17569 14529 1 23 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.777 0.657 17569 14530 1 23 . 1 1 77 77 CYS H H 231 8.809 8.809 8.423 0.386 17569 14531 1 23 . 1 1 78 78 CYS N N 232 125.697 125.697 125.667 0.030 17569 14532 1 23 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.820 -0.536 17569 14533 1 23 . 1 1 78 78 CYS CA C 232 61.884 61.884 57.669 4.215 17569 14534 1 23 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.692 1.478 17569 14535 1 23 . 1 1 78 78 CYS H H 232 8.579 8.579 8.802 -0.223 17569 14536 1 23 . 1 1 79 79 ASP N N 233 123.600 123.600 125.625 -2.025 17569 14537 1 23 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.590 0.167 17569 14538 1 23 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.360 2.629 17569 14539 1 23 . 1 1 79 79 ASP CB C 233 41.629 41.629 39.685 1.944 17569 14540 1 23 . 1 1 79 79 ASP H H 233 8.577 8.577 8.135 0.442 17569 14541 1 23 . 1 1 80 80 PHE N N 234 122.100 122.100 116.794 5.306 17569 14542 1 23 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.665 -0.139 17569 14543 1 23 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.490 1.419 17569 14544 1 23 . 1 1 80 80 PHE CB C 234 41.849 41.849 39.694 2.155 17569 14545 1 23 . 1 1 80 80 PHE H H 234 10.432 10.432 7.314 3.118 17569 14546 1 23 . 1 1 81 81 CYS N N 235 124.300 124.300 117.468 6.832 17569 14547 1 23 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.797 0.359 17569 14548 1 23 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.060 -0.016 17569 14549 1 23 . 1 1 81 81 CYS CB C 235 31.407 31.407 26.619 4.788 17569 14550 1 23 . 1 1 81 81 CYS H H 235 8.476 8.476 7.991 0.485 17569 14551 1 23 . 1 1 82 82 HIS N N 236 112.598 112.598 118.585 -5.987 17569 14552 1 23 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.180 0.803 17569 14553 1 23 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.374 -1.976 17569 14554 1 23 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.516 2.741 17569 14555 1 23 . 1 1 82 82 HIS H H 236 6.699 6.699 8.102 -1.403 17569 14556 1 23 . 1 1 83 83 ASN N N 237 123.600 123.600 118.219 5.381 17569 14557 1 23 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.862 -0.062 17569 14558 1 23 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.622 2.994 17569 14559 1 23 . 1 1 83 83 ASN H H 237 9.097 9.097 7.832 1.265 17569 14560 1 23 . 1 1 84 84 ALA N N 238 122.000 122.000 124.175 -2.175 17569 14561 1 23 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.309 0.100 17569 14562 1 23 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.206 0.158 17569 14563 1 23 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.079 2.991 17569 14564 1 23 . 1 1 84 84 ALA H H 238 9.885 9.885 8.686 1.199 17569 14565 1 23 . 1 1 85 85 PHE N N 239 116.707 116.707 121.807 -5.100 17569 14566 1 23 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.152 0.876 17569 14567 1 23 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.690 -0.473 17569 14568 1 23 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.986 1.677 17569 14569 1 23 . 1 1 85 85 PHE H H 239 9.450 9.450 9.300 0.150 17569 14570 1 23 . 1 1 86 86 CYS N N 240 126.682 126.682 124.638 2.044 17569 14571 1 23 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.656 0.966 17569 14572 1 23 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.994 -0.652 17569 14573 1 23 . 1 1 86 86 CYS CB C 240 32.257 32.257 28.934 3.323 17569 14574 1 23 . 1 1 86 86 CYS H H 240 11.309 11.309 9.502 1.807 17569 14575 1 23 . 1 1 87 87 LYS N N 241 117.865 117.865 123.668 -5.803 17569 14576 1 23 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.935 -0.086 17569 14577 1 23 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.163 -0.093 17569 14578 1 23 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.525 0.273 17569 14579 1 23 . 1 1 87 87 LYS H H 241 8.230 8.230 8.663 -0.433 17569 14580 1 23 . 1 1 88 88 LYS N N 242 117.949 117.949 118.368 -0.419 17569 14581 1 23 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.154 -0.176 17569 14582 1 23 . 1 1 88 88 LYS CA C 242 60.370 60.370 58.860 1.510 17569 14583 1 23 . 1 1 88 88 LYS CB C 242 32.316 32.316 31.992 0.324 17569 14584 1 23 . 1 1 88 88 LYS H H 242 7.945 7.945 8.498 -0.553 17569 14585 1 23 . 1 1 89 89 CYS N N 243 125.305 125.305 117.793 7.512 17569 14586 1 23 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.292 -0.550 17569 14587 1 23 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.974 1.853 17569 14588 1 23 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.081 1.161 17569 14589 1 23 . 1 1 89 89 CYS H H 243 9.297 9.297 7.584 1.713 17569 14590 1 23 . 1 1 90 90 ILE N N 244 119.687 119.687 121.506 -1.819 17569 14591 1 23 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.919 -0.312 17569 14592 1 23 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.630 0.320 17569 14593 1 23 . 1 1 90 90 ILE H H 244 7.997 7.997 7.622 0.375 17569 14594 1 23 . 1 1 91 91 LEU N N 245 120.280 120.280 120.722 -0.442 17569 14595 1 23 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.298 -0.613 17569 14596 1 23 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.615 0.620 17569 14597 1 23 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.039 -0.081 17569 14598 1 23 . 1 1 91 91 LEU H H 245 8.810 8.810 8.701 0.109 17569 14599 1 23 . 1 1 92 92 ARG N N 246 116.901 116.901 117.417 -0.516 17569 14600 1 23 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.118 -0.301 17569 14601 1 23 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.028 0.952 17569 14602 1 23 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.145 0.455 17569 14603 1 23 . 1 1 92 92 ARG H H 246 8.086 8.086 7.696 0.390 17569 14604 1 23 . 1 1 93 93 ASN N N 247 111.200 111.200 115.893 -4.693 17569 14605 1 23 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.511 0.092 17569 14606 1 23 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.796 1.012 17569 14607 1 23 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.954 3.530 17569 14608 1 23 . 1 1 93 93 ASN H H 247 7.136 7.136 8.283 -1.147 17569 14609 1 23 . 1 1 94 94 LEU N N 248 118.807 118.807 117.521 1.286 17569 14610 1 23 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.402 0.412 17569 14611 1 23 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.226 -0.037 17569 14612 1 23 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.590 0.108 17569 14613 1 23 . 1 1 94 94 LEU H H 248 8.515 8.515 7.916 0.599 17569 14614 1 23 . 1 1 95 95 GLY N N 249 108.000 108.000 106.465 1.535 17569 14615 1 23 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.564 0.064 17569 14616 1 23 . 1 1 95 95 GLY H H 249 7.955 7.955 7.587 0.368 17569 14617 1 23 . 1 1 96 96 ARG N N 250 117.797 117.797 120.829 -3.032 17569 14618 1 23 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.316 -0.473 17569 14619 1 23 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.097 0.585 17569 14620 1 23 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.331 -0.471 17569 14621 1 23 . 1 1 96 96 ARG H H 250 8.559 8.559 8.640 -0.081 17569 14622 1 23 . 1 1 97 97 LYS N N 251 120.900 120.900 119.626 1.274 17569 14623 1 23 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.013 0.143 17569 14624 1 23 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.550 -0.394 17569 14625 1 23 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.570 -0.210 17569 14626 1 23 . 1 1 97 97 LYS H H 251 8.655 8.655 8.531 0.124 17569 14627 1 23 . 1 1 98 98 GLU N N 252 122.000 122.000 118.819 3.181 17569 14628 1 23 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.103 0.248 17569 14629 1 23 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.345 -0.763 17569 14630 1 23 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.228 -0.828 17569 14631 1 23 . 1 1 98 98 GLU H H 252 7.705 7.705 8.313 -0.608 17569 14632 1 23 . 1 1 99 99 LEU N N 253 117.400 117.400 121.170 -3.770 17569 14633 1 23 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.781 0.136 17569 14634 1 23 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.059 -0.061 17569 14635 1 23 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.852 -0.370 17569 14636 1 23 . 1 1 99 99 LEU H H 253 7.285 7.285 7.637 -0.352 17569 14637 1 23 . 1 1 100 100 SER N N 254 112.100 112.100 115.325 -3.225 17569 14638 1 23 . 1 1 100 100 SER HA H 254 4.107 4.107 4.092 0.015 17569 14639 1 23 . 1 1 100 100 SER CA C 254 61.603 61.603 61.770 -0.167 17569 14640 1 23 . 1 1 100 100 SER CB C 254 62.622 62.622 63.169 -0.547 17569 14641 1 23 . 1 1 100 100 SER H H 254 8.326 8.326 8.228 0.098 17569 14642 1 23 . 1 1 101 101 THR N N 255 118.151 118.151 118.992 -0.841 17569 14643 1 23 . 1 1 101 101 THR HA H 255 4.026 4.026 4.055 -0.029 17569 14644 1 23 . 1 1 101 101 THR CA C 255 66.261 66.261 66.883 -0.622 17569 14645 1 23 . 1 1 101 101 THR CB C 255 68.735 68.735 68.790 -0.055 17569 14646 1 23 . 1 1 101 101 THR H H 255 7.972 7.972 7.951 0.021 17569 14647 1 23 . 1 1 102 102 ILE N N 256 120.100 120.100 122.476 -2.376 17569 14648 1 23 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.572 -0.109 17569 14649 1 23 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.757 0.017 17569 14650 1 23 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.505 0.236 17569 14651 1 23 . 1 1 102 102 ILE H H 256 7.868 7.868 8.568 -0.700 17569 14652 1 23 . 1 1 103 103 MET N N 257 114.876 114.876 116.895 -2.019 17569 14653 1 23 . 1 1 103 103 MET HA H 257 4.211 4.211 4.060 0.151 17569 14654 1 23 . 1 1 103 103 MET CA C 257 55.691 55.691 58.315 -2.624 17569 14655 1 23 . 1 1 103 103 MET CB C 257 32.000 32.000 32.968 -0.968 17569 14656 1 23 . 1 1 103 103 MET H H 257 7.606 7.606 7.302 0.304 17569 14657 1 23 . 1 1 104 104 ASP N N 258 119.976 119.976 118.495 1.481 17569 14658 1 23 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.788 -0.250 17569 14659 1 23 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.742 1.170 17569 14660 1 23 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.530 0.970 17569 14661 1 23 . 1 1 104 104 ASP H H 258 7.444 7.444 7.579 -0.135 17569 14662 1 23 . 1 1 105 105 GLU N N 259 124.388 124.388 121.806 2.582 17569 14663 1 23 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.538 -0.251 17569 14664 1 23 . 1 1 105 105 GLU CA C 259 57.571 57.571 54.609 2.962 17569 14665 1 23 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.670 -0.128 17569 14666 1 23 . 1 1 105 105 GLU H H 259 8.559 8.559 8.298 0.261 17569 14667 1 23 . 1 1 106 106 ASN N N 260 117.201 117.201 119.184 -1.983 17569 14668 1 23 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.433 0.309 17569 14669 1 23 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.271 -0.528 17569 14670 1 23 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.519 1.399 17569 14671 1 23 . 1 1 106 106 ASN H H 260 8.673 8.673 8.285 0.388 17569 14672 1 23 . 1 1 107 107 ASN N N 261 117.900 117.900 112.612 5.288 17569 14673 1 23 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.291 0.694 17569 14674 1 23 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.562 -2.260 17569 14675 1 23 . 1 1 107 107 ASN CB C 261 40.614 40.614 36.840 3.774 17569 14676 1 23 . 1 1 107 107 ASN H H 261 7.956 7.956 8.743 -0.787 17569 14677 1 23 . 1 1 108 108 GLN N N 262 121.500 121.500 115.613 5.887 17569 14678 1 23 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.015 0.593 17569 14679 1 23 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.805 0.971 17569 14680 1 23 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.712 0.846 17569 14681 1 23 . 1 1 108 108 GLN H H 262 8.493 8.493 7.685 0.808 17569 14682 1 23 . 1 1 109 109 TRP N N 263 128.056 128.056 122.933 5.123 17569 14683 1 23 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.659 0.312 17569 14684 1 23 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.972 0.125 17569 14685 1 23 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.184 0.309 17569 14686 1 23 . 1 1 109 109 TRP H H 263 10.497 10.497 7.974 2.523 17569 14687 1 23 . 1 1 110 110 TYR N N 264 126.600 126.600 124.881 1.719 17569 14688 1 23 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.420 -0.018 17569 14689 1 23 . 1 1 110 110 TYR CA C 264 56.671 56.671 58.510 -1.839 17569 14690 1 23 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.543 -1.535 17569 14691 1 23 . 1 1 110 110 TYR H H 264 7.545 7.545 8.147 -0.602 17569 14692 1 23 . 1 1 111 111 CYS N N 265 124.622 124.622 114.521 10.101 17569 14693 1 23 . 1 1 111 111 CYS H H 265 8.586 8.586 8.080 0.506 17569 14694 1 23 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.806 -0.614 17569 14695 1 23 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.632 1.083 17569 14696 1 23 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.615 1.305 17569 14697 1 23 . 1 1 113 113 ILE N N 267 119.504 119.504 119.442 0.062 17569 14698 1 23 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.501 -0.551 17569 14699 1 23 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.951 0.298 17569 14700 1 23 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.579 -3.046 17569 14701 1 23 . 1 1 113 113 ILE H H 267 9.160 9.160 7.481 1.679 17569 14702 1 23 . 1 1 114 114 CYS N N 268 124.100 124.100 118.397 5.703 17569 14703 1 23 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.188 -0.374 17569 14704 1 23 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.670 3.630 17569 14705 1 23 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.138 2.583 17569 14706 1 23 . 1 1 114 114 CYS H H 268 7.818 7.818 8.263 -0.445 17569 14707 1 23 . 1 1 115 115 HIS N N 269 117.127 117.127 111.369 5.758 17569 14708 1 23 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.664 0.465 17569 14709 1 23 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.027 -0.866 17569 14710 1 23 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.838 2.354 17569 14711 1 23 . 1 1 115 115 HIS H H 269 8.953 8.953 7.805 1.148 17569 14712 1 23 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.456 0.486 17569 14713 1 23 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.417 -0.109 17569 14714 1 23 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.762 0.880 17569 14715 1 23 . 1 1 117 117 GLU N N 271 123.504 123.504 123.398 0.106 17569 14716 1 23 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.390 -0.370 17569 14717 1 23 . 1 1 117 117 GLU CA C 271 61.869 61.869 57.816 4.053 17569 14718 1 23 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.951 -1.900 17569 14719 1 23 . 1 1 117 117 GLU H H 271 8.402 8.402 8.171 0.231 17569 14720 1 23 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.586 -0.044 17569 14721 1 23 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.640 1.719 17569 14722 1 23 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.406 0.736 17569 14723 1 23 . 1 1 119 119 LEU N N 273 112.296 112.296 114.513 -2.217 17569 14724 1 23 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.891 -0.417 17569 14725 1 23 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.470 0.072 17569 14726 1 23 . 1 1 119 119 LEU H H 273 8.090 8.090 7.435 0.655 17569 14727 1 23 . 1 1 120 120 LEU N N 274 121.388 121.388 122.841 -1.453 17569 14728 1 23 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.905 0.122 17569 14729 1 23 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.411 -0.110 17569 14730 1 23 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.806 0.294 17569 14731 1 23 . 1 1 120 120 LEU H H 274 7.823 7.823 8.052 -0.229 17569 14732 1 23 . 1 1 121 121 ASP N N 275 118.600 118.600 118.559 0.041 17569 14733 1 23 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.316 0.225 17569 14734 1 23 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.411 0.292 17569 14735 1 23 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.623 -1.180 17569 14736 1 23 . 1 1 121 121 ASP H H 275 8.694 8.694 8.428 0.266 17569 14737 1 23 . 1 1 122 122 LEU N N 276 123.192 123.192 119.903 3.289 17569 14738 1 23 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.967 0.425 17569 14739 1 23 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.327 -0.356 17569 14740 1 23 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.054 0.488 17569 14741 1 23 . 1 1 122 122 LEU H H 276 8.013 8.013 7.357 0.656 17569 14742 1 23 . 1 1 123 123 VAL N N 277 126.898 126.898 118.797 8.101 17569 14743 1 23 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.674 0.181 17569 14744 1 23 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.995 -0.332 17569 14745 1 23 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.419 0.639 17569 14746 1 23 . 1 1 123 123 VAL H H 277 8.781 8.781 7.814 0.967 17569 14747 1 23 . 1 1 124 124 THR N N 278 117.500 117.500 116.628 0.872 17569 14748 1 23 . 1 1 124 124 THR HA H 278 4.030 4.030 3.886 0.144 17569 14749 1 23 . 1 1 124 124 THR CA C 278 66.589 66.589 67.291 -0.702 17569 14750 1 23 . 1 1 124 124 THR CB C 278 68.410 68.410 68.484 -0.073 17569 14751 1 23 . 1 1 124 124 THR H H 278 8.722 8.722 8.387 0.335 17569 14752 1 23 . 1 1 125 125 ALA N N 279 124.700 124.700 123.979 0.721 17569 14753 1 23 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.083 0.178 17569 14754 1 23 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.081 0.215 17569 14755 1 23 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.947 0.002 17569 14756 1 23 . 1 1 125 125 ALA H H 279 8.239 8.239 8.338 -0.099 17569 14757 1 23 . 1 1 126 126 CYS N N 280 119.276 119.276 117.722 1.554 17569 14758 1 23 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.873 0.241 17569 14759 1 23 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.807 -1.704 17569 14760 1 23 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.925 -1.429 17569 14761 1 23 . 1 1 126 126 CYS H H 280 8.128 8.128 7.748 0.380 17569 14762 1 23 . 1 1 127 127 ASN N N 281 118.000 118.000 118.162 -0.162 17569 14763 1 23 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.598 -0.038 17569 14764 1 23 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.789 -0.650 17569 14765 1 23 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.050 -1.085 17569 14766 1 23 . 1 1 127 127 ASN H H 281 8.725 8.725 7.989 0.736 17569 14767 1 23 . 1 1 128 128 SER N N 282 116.601 116.601 116.723 -0.122 17569 14768 1 23 . 1 1 128 128 SER HA H 282 4.363 4.363 4.246 0.117 17569 14769 1 23 . 1 1 128 128 SER CA C 282 61.899 61.899 61.452 0.447 17569 14770 1 23 . 1 1 128 128 SER CB C 282 62.630 62.630 63.016 -0.386 17569 14771 1 23 . 1 1 128 128 SER H H 282 8.542 8.542 7.966 0.576 17569 14772 1 23 . 1 1 129 129 VAL N N 283 123.272 123.272 121.964 1.308 17569 14773 1 23 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.460 0.217 17569 14774 1 23 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.631 -0.123 17569 14775 1 23 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.428 -0.210 17569 14776 1 23 . 1 1 129 129 VAL H H 283 7.990 7.990 8.152 -0.162 17569 14777 1 23 . 1 1 130 130 PHE N N 284 118.594 118.594 118.773 -0.179 17569 14778 1 23 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.242 -0.229 17569 14779 1 23 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.242 2.258 17569 14780 1 23 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.361 0.635 17569 14781 1 23 . 1 1 130 130 PHE H H 284 8.190 8.190 8.017 0.173 17569 14782 1 23 . 1 1 131 131 GLU N N 285 120.905 120.905 120.641 0.264 17569 14783 1 23 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.449 -0.244 17569 14784 1 23 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.029 0.185 17569 14785 1 23 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.565 -0.065 17569 14786 1 23 . 1 1 131 131 GLU H H 285 8.699 8.699 8.883 -0.184 17569 14787 1 23 . 1 1 132 132 ASN N N 286 117.997 117.997 118.006 -0.009 17569 14788 1 23 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.697 -0.102 17569 14789 1 23 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.871 -0.256 17569 14790 1 23 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.650 0.202 17569 14791 1 23 . 1 1 132 132 ASN H H 286 8.082 8.082 8.419 -0.337 17569 14792 1 23 . 1 1 133 133 LEU N N 287 120.800 120.800 121.902 -1.102 17569 14793 1 23 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.371 -0.254 17569 14794 1 23 . 1 1 133 133 LEU CA C 287 57.798 57.798 57.962 -0.164 17569 14795 1 23 . 1 1 133 133 LEU H H 287 7.904 7.904 8.088 -0.184 17569 14796 1 23 . 1 1 134 134 GLU N N 288 118.200 118.200 118.921 -0.721 17569 14797 1 23 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.889 0.190 17569 14798 1 23 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.776 -0.779 17569 14799 1 23 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.212 0.030 17569 14800 1 23 . 1 1 134 134 GLU H H 288 8.157 8.157 8.066 0.091 17569 14801 1 23 . 1 1 135 135 GLN N N 289 117.400 117.400 118.803 -1.403 17569 14802 1 23 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.075 0.099 17569 14803 1 23 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.757 -0.768 17569 14804 1 23 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.765 -0.684 17569 14805 1 23 . 1 1 135 135 GLN H H 289 7.869 7.869 7.726 0.143 17569 14806 1 23 . 1 1 136 136 LEU N N 290 121.000 121.000 118.719 2.281 17569 14807 1 23 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.831 0.342 17569 14808 1 23 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.486 -0.348 17569 14809 1 23 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.452 0.548 17569 14810 1 23 . 1 1 136 136 LEU H H 290 7.968 7.968 7.339 0.629 17569 14811 1 23 . 1 1 137 137 LEU N N 291 118.900 118.900 118.044 0.856 17569 14812 1 23 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.031 0.210 17569 14813 1 23 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.308 -0.948 17569 14814 1 23 . 1 1 137 137 LEU CB C 291 41.472 41.472 41.810 -0.339 17569 14815 1 23 . 1 1 137 137 LEU H H 291 8.154 8.154 7.283 0.871 17569 14816 1 23 . 1 1 138 138 GLN N N 292 117.993 117.993 116.170 1.823 17569 14817 1 23 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.101 0.171 17569 14818 1 23 . 1 1 138 138 GLN CA C 292 56.632 56.632 57.880 -1.248 17569 14819 1 23 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.002 -0.418 17569 14820 1 23 . 1 1 138 138 GLN H H 292 7.896 7.896 7.813 0.083 17569 14821 1 23 . 1 1 139 139 GLN N N 293 118.889 118.889 118.626 0.263 17569 14822 1 23 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.465 -0.196 17569 14823 1 23 . 1 1 139 139 GLN CA C 293 56.454 56.454 54.978 1.476 17569 14824 1 23 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.854 -0.785 17569 14825 1 23 . 1 1 139 139 GLN H H 293 8.091 8.091 7.646 0.445 17569 14826 1 23 . 1 1 140 140 ASN N N 294 118.604 118.604 122.104 -3.500 17569 14827 1 23 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.898 -0.139 17569 14828 1 23 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.209 1.012 17569 14829 1 23 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.749 -2.016 17569 14830 1 23 . 1 1 140 140 ASN H H 294 8.273 8.273 8.562 -0.289 17569 14831 1 23 . 1 1 141 141 LYS N N 295 121.685 121.685 121.140 0.545 17569 14832 1 23 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.561 -0.201 17569 14833 1 23 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.952 0.221 17569 14834 1 23 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.489 -0.954 17569 14835 1 23 . 1 1 141 141 LYS H H 295 8.089 8.089 8.507 -0.418 17569 14836 1 24 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.683 -0.296 17569 14837 1 24 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.549 -0.104 17569 14838 1 24 . 1 1 2 2 ALA CB C 156 19.256 19.256 18.859 0.397 17569 14839 1 24 . 1 1 3 3 MET HA H 157 4.476 4.476 4.810 -0.334 17569 14840 1 24 . 1 1 3 3 MET CA C 157 55.401 55.401 56.202 -0.801 17569 14841 1 24 . 1 1 4 4 ALA N N 158 124.828 124.828 123.063 1.765 17569 14842 1 24 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.641 -0.327 17569 14843 1 24 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.736 0.775 17569 14844 1 24 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.064 -1.063 17569 14845 1 24 . 1 1 4 4 ALA H H 158 8.382 8.382 7.806 0.576 17569 14846 1 24 . 1 1 5 5 ASP N N 159 119.418 119.418 119.475 -0.057 17569 14847 1 24 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.946 -0.356 17569 14848 1 24 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.626 0.510 17569 14849 1 24 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.812 -1.797 17569 14850 1 24 . 1 1 5 5 ASP H H 159 8.312 8.312 8.418 -0.106 17569 14851 1 24 . 1 1 6 6 LYS N N 160 121.604 121.604 119.812 1.792 17569 14852 1 24 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.728 -0.385 17569 14853 1 24 . 1 1 6 6 LYS H H 160 8.274 8.274 8.361 -0.087 17569 14854 1 24 . 1 1 7 7 ARG N N 161 121.611 121.611 120.040 1.571 17569 14855 1 24 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.558 -0.231 17569 14856 1 24 . 1 1 7 7 ARG H H 161 8.430 8.430 8.868 -0.438 17569 14857 1 24 . 1 1 8 8 GLY N N 162 109.606 109.606 109.434 0.172 17569 14858 1 24 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.326 -0.279 17569 14859 1 24 . 1 1 8 8 GLY H H 162 8.473 8.473 8.725 -0.252 17569 14860 1 24 . 1 1 9 9 ASP N N 163 120.187 120.187 119.631 0.556 17569 14861 1 24 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.980 -0.331 17569 14862 1 24 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.845 0.306 17569 14863 1 24 . 1 1 9 9 ASP H H 163 8.296 8.296 7.849 0.447 17569 14864 1 24 . 1 1 10 10 GLY N N 164 108.816 108.816 109.718 -0.902 17569 14865 1 24 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.732 -0.365 17569 14866 1 24 . 1 1 10 10 GLY H H 164 8.458 8.458 8.589 -0.131 17569 14867 1 24 . 1 1 11 11 LEU N N 165 121.195 121.195 121.613 -0.418 17569 14868 1 24 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.672 -0.356 17569 14869 1 24 . 1 1 11 11 LEU CA C 165 55.000 55.000 55.592 -0.592 17569 14870 1 24 . 1 1 11 11 LEU CB C 165 41.932 41.932 42.885 -0.953 17569 14871 1 24 . 1 1 11 11 LEU H H 165 8.137 8.137 7.860 0.277 17569 14872 1 24 . 1 1 12 12 HIS N N 166 119.387 119.387 124.847 -5.460 17569 14873 1 24 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.721 -0.066 17569 14874 1 24 . 1 1 12 12 HIS CA C 166 56.269 56.269 56.272 -0.003 17569 14875 1 24 . 1 1 12 12 HIS CB C 166 30.697 30.697 30.351 0.346 17569 14876 1 24 . 1 1 12 12 HIS H H 166 8.270 8.270 8.331 -0.061 17569 14877 1 24 . 1 1 13 13 GLY N N 167 109.899 109.899 111.848 -1.949 17569 14878 1 24 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.786 0.319 17569 14879 1 24 . 1 1 13 13 GLY H H 167 8.276 8.276 8.253 0.023 17569 14880 1 24 . 1 1 14 14 ILE N N 168 119.597 119.597 123.630 -4.033 17569 14881 1 24 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.373 -0.050 17569 14882 1 24 . 1 1 14 14 ILE CA C 168 60.600 60.600 59.636 0.964 17569 14883 1 24 . 1 1 14 14 ILE CB C 168 38.950 38.950 39.356 -0.406 17569 14884 1 24 . 1 1 14 14 ILE H H 168 7.962 7.962 8.164 -0.202 17569 14885 1 24 . 1 1 15 15 VAL N N 169 127.578 127.578 129.449 -1.871 17569 14886 1 24 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.058 0.222 17569 14887 1 24 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.310 -0.993 17569 14888 1 24 . 1 1 15 15 VAL CB C 169 33.402 33.402 31.549 1.853 17569 14889 1 24 . 1 1 15 15 VAL H H 169 9.011 9.011 8.423 0.588 17569 14890 1 24 . 1 1 16 16 SER N N 170 118.596 118.596 120.700 -2.104 17569 14891 1 24 . 1 1 16 16 SER HA H 170 5.140 5.140 4.783 0.357 17569 14892 1 24 . 1 1 16 16 SER CA C 170 55.985 55.985 56.423 -0.438 17569 14893 1 24 . 1 1 16 16 SER CB C 170 65.261 65.261 65.601 -0.340 17569 14894 1 24 . 1 1 16 16 SER H H 170 8.242 8.242 7.769 0.473 17569 14895 1 24 . 1 1 17 17 CYS N N 171 123.783 123.783 123.075 0.708 17569 14896 1 24 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.171 0.010 17569 14897 1 24 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.917 -1.073 17569 14898 1 24 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.575 2.798 17569 14899 1 24 . 1 1 17 17 CYS H H 171 8.894 8.894 8.470 0.424 17569 14900 1 24 . 1 1 18 18 THR N N 172 121.703 121.703 117.450 4.253 17569 14901 1 24 . 1 1 18 18 THR HA H 172 4.386 4.386 4.091 0.295 17569 14902 1 24 . 1 1 18 18 THR CA C 172 64.667 64.667 64.582 0.086 17569 14903 1 24 . 1 1 18 18 THR CB C 172 69.498 69.498 68.853 0.645 17569 14904 1 24 . 1 1 18 18 THR H H 172 8.788 8.788 8.333 0.455 17569 14905 1 24 . 1 1 19 19 ALA N N 173 131.364 131.364 121.427 9.937 17569 14906 1 24 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.201 0.295 17569 14907 1 24 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.710 0.315 17569 14908 1 24 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.655 3.526 17569 14909 1 24 . 1 1 19 19 ALA H H 173 9.680 9.680 7.917 1.763 17569 14910 1 24 . 1 1 20 20 CYS N N 174 115.498 115.498 113.254 2.244 17569 14911 1 24 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.532 0.436 17569 14912 1 24 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.390 -1.296 17569 14913 1 24 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.646 4.598 17569 14914 1 24 . 1 1 20 20 CYS H H 174 8.470 8.470 7.575 0.895 17569 14915 1 24 . 1 1 21 21 GLY N N 175 112.464 112.464 108.501 3.963 17569 14916 1 24 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.151 0.555 17569 14917 1 24 . 1 1 21 21 GLY H H 175 7.884 7.884 7.863 0.021 17569 14918 1 24 . 1 1 22 22 GLN N N 176 121.784 121.784 117.862 3.922 17569 14919 1 24 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.422 -0.046 17569 14920 1 24 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.408 1.883 17569 14921 1 24 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.760 -2.419 17569 14922 1 24 . 1 1 22 22 GLN H H 176 8.723 8.723 7.859 0.864 17569 14923 1 24 . 1 1 23 23 GLN N N 177 122.900 122.900 124.165 -1.265 17569 14924 1 24 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.129 0.401 17569 14925 1 24 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.688 -0.138 17569 14926 1 24 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.223 -0.763 17569 14927 1 24 . 1 1 23 23 GLN H H 177 8.721 8.721 8.569 0.152 17569 14928 1 24 . 1 1 24 24 VAL N N 178 121.000 121.000 125.856 -4.856 17569 14929 1 24 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.987 0.537 17569 14930 1 24 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.785 -1.908 17569 14931 1 24 . 1 1 24 24 VAL H H 178 8.689 8.689 7.921 0.768 17569 14932 1 24 . 1 1 25 25 ASN N N 179 121.392 121.392 123.228 -1.836 17569 14933 1 24 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.299 0.577 17569 14934 1 24 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.383 -2.235 17569 14935 1 24 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.971 -0.994 17569 14936 1 24 . 1 1 25 25 ASN H H 179 8.635 8.635 7.977 0.658 17569 14937 1 24 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.607 -0.147 17569 14938 1 24 . 1 1 27 27 PHE CA C 181 56.998 56.998 57.000 -0.002 17569 14939 1 24 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.410 -1.017 17569 14940 1 24 . 1 1 28 28 GLN N N 182 119.300 119.300 122.283 -2.983 17569 14941 1 24 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.225 0.293 17569 14942 1 24 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.368 -2.026 17569 14943 1 24 . 1 1 28 28 GLN CB C 182 30.350 30.350 29.565 0.785 17569 14944 1 24 . 1 1 28 28 GLN H H 182 7.494 7.494 8.000 -0.506 17569 14945 1 24 . 1 1 29 29 LYS N N 183 124.516 124.516 126.853 -2.337 17569 14946 1 24 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.342 -0.420 17569 14947 1 24 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.689 1.623 17569 14948 1 24 . 1 1 29 29 LYS CB C 183 32.286 32.286 33.393 -1.107 17569 14949 1 24 . 1 1 29 29 LYS H H 183 8.779 8.779 8.339 0.440 17569 14950 1 24 . 1 1 30 30 ASP N N 184 116.500 116.500 119.058 -2.558 17569 14951 1 24 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.481 -0.022 17569 14952 1 24 . 1 1 30 30 ASP CA C 184 54.536 54.536 55.489 -0.952 17569 14953 1 24 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.249 -0.278 17569 14954 1 24 . 1 1 30 30 ASP H H 184 8.556 8.556 8.723 -0.167 17569 14955 1 24 . 1 1 31 31 SER N N 185 111.505 111.505 110.487 1.018 17569 14956 1 24 . 1 1 31 31 SER HA H 185 4.695 4.695 4.710 -0.015 17569 14957 1 24 . 1 1 31 31 SER CA C 185 59.747 59.747 57.718 2.029 17569 14958 1 24 . 1 1 31 31 SER CB C 185 65.198 65.198 63.967 1.231 17569 14959 1 24 . 1 1 31 31 SER H H 185 7.933 7.933 8.155 -0.222 17569 14960 1 24 . 1 1 32 32 ILE N N 186 113.394 113.394 116.522 -3.128 17569 14961 1 24 . 1 1 32 32 ILE HA H 186 4.886 4.886 5.055 -0.169 17569 14962 1 24 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.284 -0.705 17569 14963 1 24 . 1 1 32 32 ILE CB C 186 41.812 41.812 41.712 0.099 17569 14964 1 24 . 1 1 32 32 ILE H H 186 7.105 7.105 7.401 -0.296 17569 14965 1 24 . 1 1 33 33 TYR N N 187 119.098 119.098 120.817 -1.719 17569 14966 1 24 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.258 -0.735 17569 14967 1 24 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.125 1.135 17569 14968 1 24 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.292 2.148 17569 14969 1 24 . 1 1 33 33 TYR H H 187 8.954 8.954 7.698 1.256 17569 14970 1 24 . 1 1 34 34 ARG N N 188 118.502 118.502 123.506 -5.004 17569 14971 1 24 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.766 -0.129 17569 14972 1 24 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.252 -1.500 17569 14973 1 24 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.437 0.814 17569 14974 1 24 . 1 1 34 34 ARG H H 188 8.412 8.412 8.670 -0.258 17569 14975 1 24 . 1 1 35 35 HIS N N 189 126.596 126.596 128.617 -2.021 17569 14976 1 24 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.896 -0.304 17569 14977 1 24 . 1 1 35 35 HIS CA C 189 55.721 55.721 55.930 -0.209 17569 14978 1 24 . 1 1 35 35 HIS CB C 189 32.472 32.472 30.927 1.544 17569 14979 1 24 . 1 1 35 35 HIS H H 189 9.813 9.813 9.179 0.634 17569 14980 1 24 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.640 -0.342 17569 14981 1 24 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.868 0.408 17569 14982 1 24 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.307 0.544 17569 14983 1 24 . 1 1 37 37 SER N N 191 110.003 110.003 113.861 -3.858 17569 14984 1 24 . 1 1 37 37 SER HA H 191 4.918 4.918 4.299 0.619 17569 14985 1 24 . 1 1 37 37 SER CA C 191 59.031 59.031 60.978 -1.947 17569 14986 1 24 . 1 1 37 37 SER CB C 191 65.104 65.104 63.272 1.832 17569 14987 1 24 . 1 1 37 37 SER H H 191 8.934 8.934 8.533 0.401 17569 14988 1 24 . 1 1 38 38 LEU N N 192 120.959 120.959 114.387 6.572 17569 14989 1 24 . 1 1 38 38 LEU HA H 192 4.129 4.129 5.005 -0.876 17569 14990 1 24 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.181 1.965 17569 14991 1 24 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.464 1.532 17569 14992 1 24 . 1 1 38 38 LEU H H 192 8.649 8.649 7.023 1.626 17569 14993 1 24 . 1 1 39 39 GLN N N 193 108.600 108.600 118.308 -9.708 17569 14994 1 24 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.119 -0.214 17569 14995 1 24 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.727 0.087 17569 14996 1 24 . 1 1 39 39 GLN CB C 193 25.034 25.034 27.054 -2.020 17569 14997 1 24 . 1 1 39 39 GLN H H 193 8.465 8.465 7.664 0.801 17569 14998 1 24 . 1 1 40 40 VAL N N 194 105.325 105.325 119.372 -14.047 17569 14999 1 24 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.416 0.134 17569 15000 1 24 . 1 1 40 40 VAL CA C 194 58.641 58.641 60.144 -1.503 17569 15001 1 24 . 1 1 40 40 VAL H H 194 6.256 6.256 7.887 -1.631 17569 15002 1 24 . 1 1 41 41 LEU N N 195 123.100 123.100 121.961 1.139 17569 15003 1 24 . 1 1 41 41 LEU HA H 195 4.816 4.816 5.146 -0.330 17569 15004 1 24 . 1 1 41 41 LEU CA C 195 58.182 58.182 53.788 4.394 17569 15005 1 24 . 1 1 41 41 LEU CB C 195 43.570 43.570 44.160 -0.590 17569 15006 1 24 . 1 1 41 41 LEU H H 195 9.154 9.154 8.465 0.689 17569 15007 1 24 . 1 1 42 42 ILE N N 196 124.396 124.396 116.691 7.705 17569 15008 1 24 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.792 1.560 17569 15009 1 24 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.411 0.819 17569 15010 1 24 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.798 1.472 17569 15011 1 24 . 1 1 42 42 ILE H H 196 9.766 9.766 7.795 1.971 17569 15012 1 24 . 1 1 43 43 CYS N N 197 121.500 121.500 115.114 6.386 17569 15013 1 24 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.037 0.225 17569 15014 1 24 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.209 0.494 17569 15015 1 24 . 1 1 43 43 CYS CB C 197 33.300 33.300 30.879 2.421 17569 15016 1 24 . 1 1 43 43 CYS H H 197 9.882 9.882 8.344 1.538 17569 15017 1 24 . 1 1 44 44 LYS N N 198 117.995 117.995 122.203 -4.208 17569 15018 1 24 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.199 -0.210 17569 15019 1 24 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.325 -0.665 17569 15020 1 24 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.447 0.253 17569 15021 1 24 . 1 1 44 44 LYS H H 198 8.089 8.089 8.845 -0.756 17569 15022 1 24 . 1 1 45 45 ASN N N 199 119.200 119.200 117.171 2.029 17569 15023 1 24 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.591 -0.077 17569 15024 1 24 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.904 0.816 17569 15025 1 24 . 1 1 45 45 ASN CB C 199 38.167 38.167 37.956 0.211 17569 15026 1 24 . 1 1 45 45 ASN H H 199 8.356 8.356 8.518 -0.162 17569 15027 1 24 . 1 1 46 46 CYS N N 200 126.600 126.600 119.449 7.151 17569 15028 1 24 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.008 0.173 17569 15029 1 24 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.144 2.351 17569 15030 1 24 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.133 2.049 17569 15031 1 24 . 1 1 46 46 CYS H H 200 9.189 9.189 7.563 1.626 17569 15032 1 24 . 1 1 47 47 PHE N N 201 121.962 121.962 120.423 1.539 17569 15033 1 24 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.089 -0.219 17569 15034 1 24 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.722 1.547 17569 15035 1 24 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.514 0.652 17569 15036 1 24 . 1 1 47 47 PHE H H 201 8.826 8.826 8.322 0.504 17569 15037 1 24 . 1 1 48 48 LYS N N 202 117.400 117.400 120.450 -3.050 17569 15038 1 24 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.888 -0.190 17569 15039 1 24 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.026 -1.074 17569 15040 1 24 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.341 -0.799 17569 15041 1 24 . 1 1 48 48 LYS H H 202 8.512 8.512 7.978 0.534 17569 15042 1 24 . 1 1 49 49 TYR N N 203 120.400 120.400 120.711 -0.311 17569 15043 1 24 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.225 0.189 17569 15044 1 24 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.474 -0.702 17569 15045 1 24 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.704 -0.258 17569 15046 1 24 . 1 1 49 49 TYR H H 203 8.133 8.133 7.656 0.477 17569 15047 1 24 . 1 1 50 50 TYR N N 204 121.783 121.783 118.119 3.664 17569 15048 1 24 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.666 -1.171 17569 15049 1 24 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.992 2.958 17569 15050 1 24 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.545 0.947 17569 15051 1 24 . 1 1 50 50 TYR H H 204 8.765 8.765 7.715 1.050 17569 15052 1 24 . 1 1 51 51 MET N N 205 110.800 110.800 115.812 -5.012 17569 15053 1 24 . 1 1 51 51 MET HA H 205 4.349 4.349 4.127 0.222 17569 15054 1 24 . 1 1 51 51 MET CA C 205 53.505 53.505 58.175 -4.670 17569 15055 1 24 . 1 1 51 51 MET CB C 205 30.384 30.384 33.188 -2.804 17569 15056 1 24 . 1 1 51 51 MET H H 205 7.771 7.771 8.427 -0.656 17569 15057 1 24 . 1 1 52 52 SER N N 206 116.800 116.800 113.044 3.756 17569 15058 1 24 . 1 1 52 52 SER HA H 206 3.919 3.919 4.385 -0.466 17569 15059 1 24 . 1 1 52 52 SER CA C 206 61.621 61.621 60.195 1.426 17569 15060 1 24 . 1 1 52 52 SER CB C 206 62.611 62.611 64.298 -1.687 17569 15061 1 24 . 1 1 52 52 SER H H 206 7.581 7.581 8.194 -0.613 17569 15062 1 24 . 1 1 53 53 ASP N N 207 117.400 117.400 121.641 -4.241 17569 15063 1 24 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.741 -0.169 17569 15064 1 24 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.812 -0.713 17569 15065 1 24 . 1 1 53 53 ASP CB C 207 43.188 43.188 42.648 0.541 17569 15066 1 24 . 1 1 53 53 ASP H H 207 7.085 7.085 8.202 -1.117 17569 15067 1 24 . 1 1 54 54 ASP N N 208 119.405 119.405 122.503 -3.098 17569 15068 1 24 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.963 -0.574 17569 15069 1 24 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.465 0.435 17569 15070 1 24 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.043 -1.694 17569 15071 1 24 . 1 1 54 54 ASP H H 208 8.439 8.439 8.486 -0.047 17569 15072 1 24 . 1 1 55 55 ILE N N 209 124.698 124.698 120.596 4.102 17569 15073 1 24 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.509 -0.509 17569 15074 1 24 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.111 2.167 17569 15075 1 24 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.239 1.052 17569 15076 1 24 . 1 1 55 55 ILE H H 209 8.128 8.128 8.465 -0.337 17569 15077 1 24 . 1 1 56 56 SER N N 210 126.703 126.703 120.554 6.149 17569 15078 1 24 . 1 1 56 56 SER HA H 210 4.365 4.365 4.746 -0.381 17569 15079 1 24 . 1 1 56 56 SER CA C 210 57.769 57.769 57.549 0.220 17569 15080 1 24 . 1 1 56 56 SER CB C 210 64.991 64.991 65.778 -0.787 17569 15081 1 24 . 1 1 56 56 SER H H 210 8.815 8.815 8.526 0.289 17569 15082 1 24 . 1 1 57 57 ARG N N 211 116.885 116.885 121.176 -4.291 17569 15083 1 24 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.524 0.518 17569 15084 1 24 . 1 1 57 57 ARG CA C 211 54.400 54.400 56.083 -1.683 17569 15085 1 24 . 1 1 57 57 ARG CB C 211 34.284 34.284 30.770 3.514 17569 15086 1 24 . 1 1 57 57 ARG H H 211 8.365 8.365 8.550 -0.185 17569 15087 1 24 . 1 1 58 58 ASP N N 212 121.982 121.982 123.740 -1.758 17569 15088 1 24 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.838 -0.223 17569 15089 1 24 . 1 1 58 58 ASP CA C 212 52.222 52.222 53.264 -1.042 17569 15090 1 24 . 1 1 58 58 ASP CB C 212 41.502 41.502 43.247 -1.745 17569 15091 1 24 . 1 1 58 58 ASP H H 212 8.706 8.706 8.521 0.185 17569 15092 1 24 . 1 1 59 59 SER N N 213 114.164 114.164 113.375 0.789 17569 15093 1 24 . 1 1 59 59 SER HA H 213 4.212 4.212 4.073 0.139 17569 15094 1 24 . 1 1 59 59 SER CA C 213 60.840 60.840 60.922 -0.083 17569 15095 1 24 . 1 1 59 59 SER CB C 213 62.714 62.714 62.975 -0.261 17569 15096 1 24 . 1 1 59 59 SER H H 213 8.687 8.687 8.663 0.024 17569 15097 1 24 . 1 1 60 60 ASP N N 214 120.899 120.899 121.086 -0.187 17569 15098 1 24 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.824 0.001 17569 15099 1 24 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.908 0.302 17569 15100 1 24 . 1 1 60 60 ASP CB C 214 41.558 41.558 41.495 0.062 17569 15101 1 24 . 1 1 60 60 ASP H H 214 8.193 8.193 8.171 0.022 17569 15102 1 24 . 1 1 61 61 GLY N N 215 108.300 108.300 108.645 -0.345 17569 15103 1 24 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.844 -0.447 17569 15104 1 24 . 1 1 61 61 GLY H H 215 8.234 8.234 8.141 0.093 17569 15105 1 24 . 1 1 62 62 MET N N 216 120.002 120.002 117.709 2.293 17569 15106 1 24 . 1 1 62 62 MET HA H 216 4.972 4.972 4.703 0.269 17569 15107 1 24 . 1 1 62 62 MET CA C 216 53.151 53.151 53.756 -0.605 17569 15108 1 24 . 1 1 62 62 MET CB C 216 32.311 32.311 36.529 -4.218 17569 15109 1 24 . 1 1 62 62 MET H H 216 8.376 8.376 7.355 1.021 17569 15110 1 24 . 1 1 63 63 ASP N N 217 127.300 127.300 121.403 5.897 17569 15111 1 24 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.788 0.178 17569 15112 1 24 . 1 1 63 63 ASP CA C 217 55.569 55.569 54.958 0.611 17569 15113 1 24 . 1 1 63 63 ASP H H 217 9.368 9.368 8.481 0.887 17569 15114 1 24 . 1 1 64 64 GLU N N 218 114.400 114.400 123.896 -9.496 17569 15115 1 24 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.607 -0.451 17569 15116 1 24 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.747 0.103 17569 15117 1 24 . 1 1 64 64 GLU H H 218 8.583 8.583 8.613 -0.030 17569 15118 1 24 . 1 1 65 65 GLN N N 219 115.500 115.500 116.991 -1.491 17569 15119 1 24 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.598 -0.287 17569 15120 1 24 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.214 0.132 17569 15121 1 24 . 1 1 65 65 GLN H H 219 7.158 7.158 7.956 -0.798 17569 15122 1 24 . 1 1 66 66 CYS N N 220 122.600 122.600 118.118 4.482 17569 15123 1 24 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.390 -1.313 17569 15124 1 24 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.113 1.416 17569 15125 1 24 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.282 1.690 17569 15126 1 24 . 1 1 66 66 CYS H H 220 8.248 8.248 8.681 -0.433 17569 15127 1 24 . 1 1 67 67 ARG N N 221 130.363 130.363 122.133 8.230 17569 15128 1 24 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.482 -0.415 17569 15129 1 24 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.328 -2.312 17569 15130 1 24 . 1 1 67 67 ARG H H 221 9.145 9.145 8.485 0.660 17569 15131 1 24 . 1 1 68 68 TRP N N 222 124.200 124.200 121.174 3.026 17569 15132 1 24 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.655 -0.219 17569 15133 1 24 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.513 0.568 17569 15134 1 24 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.230 0.964 17569 15135 1 24 . 1 1 68 68 TRP H H 222 9.689 9.689 8.240 1.449 17569 15136 1 24 . 1 1 69 69 CYS N N 223 116.297 116.297 110.855 5.442 17569 15137 1 24 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.102 -0.011 17569 15138 1 24 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.392 2.710 17569 15139 1 24 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.211 5.127 17569 15140 1 24 . 1 1 69 69 CYS H H 223 8.822 8.822 7.736 1.086 17569 15141 1 24 . 1 1 70 70 ALA N N 224 123.112 123.112 123.330 -0.218 17569 15142 1 24 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.239 0.167 17569 15143 1 24 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.565 -0.714 17569 15144 1 24 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.392 0.328 17569 15145 1 24 . 1 1 70 70 ALA H H 224 8.787 8.787 8.203 0.584 17569 15146 1 24 . 1 1 71 71 GLU N N 225 118.300 118.300 119.578 -1.278 17569 15147 1 24 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.452 0.856 17569 15148 1 24 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.509 -2.210 17569 15149 1 24 . 1 1 71 71 GLU H H 225 8.541 8.541 8.295 0.246 17569 15150 1 24 . 1 1 72 72 GLY N N 226 111.995 111.995 109.891 2.104 17569 15151 1 24 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.918 -0.515 17569 15152 1 24 . 1 1 72 72 GLY H H 226 9.837 9.837 8.503 1.334 17569 15153 1 24 . 1 1 73 73 GLY N N 227 106.600 106.600 106.881 -0.281 17569 15154 1 24 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.956 1.015 17569 15155 1 24 . 1 1 73 73 GLY H H 227 7.772 7.772 8.508 -0.736 17569 15156 1 24 . 1 1 74 74 ASN N N 228 124.277 124.277 119.404 4.873 17569 15157 1 24 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.433 0.648 17569 15158 1 24 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.651 -0.551 17569 15159 1 24 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.520 -0.436 17569 15160 1 24 . 1 1 74 74 ASN H H 228 8.876 8.876 8.489 0.387 17569 15161 1 24 . 1 1 75 75 LEU N N 229 123.050 123.050 122.665 0.385 17569 15162 1 24 . 1 1 75 75 LEU HA H 229 4.600 4.600 5.210 -0.610 17569 15163 1 24 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.463 0.899 17569 15164 1 24 . 1 1 75 75 LEU CB C 229 43.500 43.500 45.404 -1.904 17569 15165 1 24 . 1 1 75 75 LEU H H 229 8.901 8.901 8.012 0.889 17569 15166 1 24 . 1 1 76 76 ILE N N 230 123.552 123.552 120.620 2.932 17569 15167 1 24 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.358 0.127 17569 15168 1 24 . 1 1 76 76 ILE CA C 230 60.700 60.700 60.021 0.679 17569 15169 1 24 . 1 1 76 76 ILE CB C 230 37.399 37.399 40.250 -2.851 17569 15170 1 24 . 1 1 76 76 ILE H H 230 9.406 9.406 9.136 0.270 17569 15171 1 24 . 1 1 77 77 CYS N N 231 124.637 124.637 126.482 -1.845 17569 15172 1 24 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.484 -0.609 17569 15173 1 24 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.876 0.483 17569 15174 1 24 . 1 1 77 77 CYS CB C 231 29.434 29.434 29.603 -0.169 17569 15175 1 24 . 1 1 77 77 CYS H H 231 8.809 8.809 8.667 0.142 17569 15176 1 24 . 1 1 78 78 CYS N N 232 125.697 125.697 125.494 0.203 17569 15177 1 24 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.995 -0.711 17569 15178 1 24 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.049 3.835 17569 15179 1 24 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.416 1.754 17569 15180 1 24 . 1 1 78 78 CYS H H 232 8.579 8.579 8.521 0.058 17569 15181 1 24 . 1 1 79 79 ASP N N 233 123.600 123.600 126.282 -2.682 17569 15182 1 24 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.653 0.104 17569 15183 1 24 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.623 2.366 17569 15184 1 24 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.453 1.176 17569 15185 1 24 . 1 1 79 79 ASP H H 233 8.577 8.577 8.383 0.194 17569 15186 1 24 . 1 1 80 80 PHE N N 234 122.100 122.100 116.766 5.334 17569 15187 1 24 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.472 0.054 17569 15188 1 24 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.450 1.459 17569 15189 1 24 . 1 1 80 80 PHE CB C 234 41.849 41.849 39.841 2.008 17569 15190 1 24 . 1 1 80 80 PHE H H 234 10.432 10.432 7.649 2.783 17569 15191 1 24 . 1 1 81 81 CYS N N 235 124.300 124.300 117.808 6.492 17569 15192 1 24 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.614 0.542 17569 15193 1 24 . 1 1 81 81 CYS CA C 235 58.045 58.045 57.790 0.255 17569 15194 1 24 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.858 3.550 17569 15195 1 24 . 1 1 81 81 CYS H H 235 8.476 8.476 7.829 0.647 17569 15196 1 24 . 1 1 82 82 HIS N N 236 112.598 112.598 118.092 -5.494 17569 15197 1 24 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.109 0.874 17569 15198 1 24 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.779 -1.381 17569 15199 1 24 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.560 2.697 17569 15200 1 24 . 1 1 82 82 HIS H H 236 6.699 6.699 8.078 -1.379 17569 15201 1 24 . 1 1 83 83 ASN N N 237 123.600 123.600 118.278 5.322 17569 15202 1 24 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.965 -0.164 17569 15203 1 24 . 1 1 83 83 ASN CA C 237 55.616 55.616 53.239 2.377 17569 15204 1 24 . 1 1 83 83 ASN H H 237 9.097 9.097 7.844 1.253 17569 15205 1 24 . 1 1 84 84 ALA N N 238 122.000 122.000 122.866 -0.866 17569 15206 1 24 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.514 -0.105 17569 15207 1 24 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.911 -0.547 17569 15208 1 24 . 1 1 84 84 ALA CB C 238 25.070 25.070 21.936 3.134 17569 15209 1 24 . 1 1 84 84 ALA H H 238 9.885 9.885 8.401 1.484 17569 15210 1 24 . 1 1 85 85 PHE N N 239 116.707 116.707 121.231 -4.524 17569 15211 1 24 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.097 0.931 17569 15212 1 24 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.907 -0.690 17569 15213 1 24 . 1 1 85 85 PHE CB C 239 44.664 44.664 44.430 0.234 17569 15214 1 24 . 1 1 85 85 PHE H H 239 9.450 9.450 9.180 0.270 17569 15215 1 24 . 1 1 86 86 CYS N N 240 126.682 126.682 117.437 9.245 17569 15216 1 24 . 1 1 86 86 CYS HA H 240 5.622 5.622 5.315 0.307 17569 15217 1 24 . 1 1 86 86 CYS CA C 240 57.342 57.342 55.667 1.675 17569 15218 1 24 . 1 1 86 86 CYS CB C 240 32.257 32.257 31.620 0.637 17569 15219 1 24 . 1 1 86 86 CYS H H 240 11.309 11.309 8.966 2.343 17569 15220 1 24 . 1 1 87 87 LYS N N 241 117.865 117.865 123.833 -5.968 17569 15221 1 24 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.889 -0.040 17569 15222 1 24 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.527 -0.457 17569 15223 1 24 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.461 0.338 17569 15224 1 24 . 1 1 87 87 LYS H H 241 8.230 8.230 8.304 -0.074 17569 15225 1 24 . 1 1 88 88 LYS N N 242 117.949 117.949 118.220 -0.271 17569 15226 1 24 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.126 -0.148 17569 15227 1 24 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.005 1.365 17569 15228 1 24 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.100 0.216 17569 15229 1 24 . 1 1 88 88 LYS H H 242 7.945 7.945 8.477 -0.532 17569 15230 1 24 . 1 1 89 89 CYS N N 243 125.305 125.305 117.845 7.460 17569 15231 1 24 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.281 -0.539 17569 15232 1 24 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.672 2.155 17569 15233 1 24 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.540 0.701 17569 15234 1 24 . 1 1 89 89 CYS H H 243 9.297 9.297 7.959 1.338 17569 15235 1 24 . 1 1 90 90 ILE N N 244 119.687 119.687 121.450 -1.763 17569 15236 1 24 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.910 -0.303 17569 15237 1 24 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.806 0.144 17569 15238 1 24 . 1 1 90 90 ILE H H 244 7.997 7.997 8.115 -0.118 17569 15239 1 24 . 1 1 91 91 LEU N N 245 120.280 120.280 120.654 -0.374 17569 15240 1 24 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.343 -0.658 17569 15241 1 24 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.489 0.746 17569 15242 1 24 . 1 1 91 91 LEU CB C 245 41.958 41.958 42.070 -0.112 17569 15243 1 24 . 1 1 91 91 LEU H H 245 8.810 8.810 8.777 0.033 17569 15244 1 24 . 1 1 92 92 ARG N N 246 116.901 116.901 117.671 -0.770 17569 15245 1 24 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.086 -0.269 17569 15246 1 24 . 1 1 92 92 ARG CA C 246 58.980 58.980 57.986 0.994 17569 15247 1 24 . 1 1 92 92 ARG CB C 246 30.600 30.600 29.962 0.638 17569 15248 1 24 . 1 1 92 92 ARG H H 246 8.086 8.086 7.586 0.500 17569 15249 1 24 . 1 1 93 93 ASN N N 247 111.200 111.200 115.691 -4.491 17569 15250 1 24 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.533 0.070 17569 15251 1 24 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.733 1.075 17569 15252 1 24 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.112 3.372 17569 15253 1 24 . 1 1 93 93 ASN H H 247 7.136 7.136 8.165 -1.029 17569 15254 1 24 . 1 1 94 94 LEU N N 248 118.807 118.807 117.674 1.133 17569 15255 1 24 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.447 0.367 17569 15256 1 24 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.153 0.036 17569 15257 1 24 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.625 0.073 17569 15258 1 24 . 1 1 94 94 LEU H H 248 8.515 8.515 8.001 0.514 17569 15259 1 24 . 1 1 95 95 GLY N N 249 108.000 108.000 106.519 1.481 17569 15260 1 24 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.546 0.082 17569 15261 1 24 . 1 1 95 95 GLY H H 249 7.955 7.955 7.506 0.449 17569 15262 1 24 . 1 1 96 96 ARG N N 250 117.797 117.797 120.854 -3.057 17569 15263 1 24 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.348 -0.505 17569 15264 1 24 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.544 0.138 17569 15265 1 24 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.254 -0.394 17569 15266 1 24 . 1 1 96 96 ARG H H 250 8.559 8.559 8.710 -0.151 17569 15267 1 24 . 1 1 97 97 LYS N N 251 120.900 120.900 119.268 1.632 17569 15268 1 24 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.012 0.144 17569 15269 1 24 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.716 -0.560 17569 15270 1 24 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.391 -0.031 17569 15271 1 24 . 1 1 97 97 LYS H H 251 8.655 8.655 8.593 0.062 17569 15272 1 24 . 1 1 98 98 GLU N N 252 122.000 122.000 118.945 3.055 17569 15273 1 24 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.073 0.278 17569 15274 1 24 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.391 -0.809 17569 15275 1 24 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.407 -1.007 17569 15276 1 24 . 1 1 98 98 GLU H H 252 7.705 7.705 8.237 -0.532 17569 15277 1 24 . 1 1 99 99 LEU N N 253 117.400 117.400 120.913 -3.513 17569 15278 1 24 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.807 0.110 17569 15279 1 24 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.007 -0.009 17569 15280 1 24 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.781 -0.299 17569 15281 1 24 . 1 1 99 99 LEU H H 253 7.285 7.285 7.630 -0.345 17569 15282 1 24 . 1 1 100 100 SER N N 254 112.100 112.100 114.486 -2.386 17569 15283 1 24 . 1 1 100 100 SER HA H 254 4.107 4.107 4.062 0.045 17569 15284 1 24 . 1 1 100 100 SER CA C 254 61.603 61.603 61.790 -0.187 17569 15285 1 24 . 1 1 100 100 SER CB C 254 62.622 62.622 63.104 -0.482 17569 15286 1 24 . 1 1 100 100 SER H H 254 8.326 8.326 8.059 0.267 17569 15287 1 24 . 1 1 101 101 THR N N 255 118.151 118.151 118.955 -0.804 17569 15288 1 24 . 1 1 101 101 THR HA H 255 4.026 4.026 4.078 -0.052 17569 15289 1 24 . 1 1 101 101 THR CA C 255 66.261 66.261 66.740 -0.478 17569 15290 1 24 . 1 1 101 101 THR CB C 255 68.735 68.735 68.935 -0.200 17569 15291 1 24 . 1 1 101 101 THR H H 255 7.972 7.972 7.732 0.240 17569 15292 1 24 . 1 1 102 102 ILE N N 256 120.100 120.100 122.391 -2.291 17569 15293 1 24 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.617 -0.154 17569 15294 1 24 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.682 0.092 17569 15295 1 24 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.519 0.222 17569 15296 1 24 . 1 1 102 102 ILE H H 256 7.868 7.868 8.574 -0.706 17569 15297 1 24 . 1 1 103 103 MET N N 257 114.876 114.876 116.913 -2.037 17569 15298 1 24 . 1 1 103 103 MET HA H 257 4.211 4.211 4.124 0.087 17569 15299 1 24 . 1 1 103 103 MET CA C 257 55.691 55.691 57.669 -1.978 17569 15300 1 24 . 1 1 103 103 MET CB C 257 32.000 32.000 32.436 -0.436 17569 15301 1 24 . 1 1 103 103 MET H H 257 7.606 7.606 7.410 0.196 17569 15302 1 24 . 1 1 104 104 ASP N N 258 119.976 119.976 119.572 0.404 17569 15303 1 24 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.820 -0.282 17569 15304 1 24 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.973 0.939 17569 15305 1 24 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.243 1.257 17569 15306 1 24 . 1 1 104 104 ASP H H 258 7.444 7.444 7.548 -0.104 17569 15307 1 24 . 1 1 105 105 GLU N N 259 124.388 124.388 120.256 4.132 17569 15308 1 24 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.419 -0.132 17569 15309 1 24 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.354 2.217 17569 15310 1 24 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.977 -0.435 17569 15311 1 24 . 1 1 105 105 GLU H H 259 8.559 8.559 8.301 0.258 17569 15312 1 24 . 1 1 106 106 ASN N N 260 117.201 117.201 119.761 -2.560 17569 15313 1 24 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.427 0.315 17569 15314 1 24 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.009 -0.266 17569 15315 1 24 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.214 1.704 17569 15316 1 24 . 1 1 106 106 ASN H H 260 8.673 8.673 8.347 0.326 17569 15317 1 24 . 1 1 107 107 ASN N N 261 117.900 117.900 113.674 4.226 17569 15318 1 24 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.310 0.675 17569 15319 1 24 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.665 -2.363 17569 15320 1 24 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.656 2.958 17569 15321 1 24 . 1 1 107 107 ASN H H 261 7.956 7.956 8.756 -0.800 17569 15322 1 24 . 1 1 108 108 GLN N N 262 121.500 121.500 116.675 4.825 17569 15323 1 24 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.407 0.201 17569 15324 1 24 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.978 0.798 17569 15325 1 24 . 1 1 108 108 GLN CB C 262 30.558 30.558 30.002 0.556 17569 15326 1 24 . 1 1 108 108 GLN H H 262 8.493 8.493 7.937 0.556 17569 15327 1 24 . 1 1 109 109 TRP N N 263 128.056 128.056 124.150 3.906 17569 15328 1 24 . 1 1 109 109 TRP HA H 263 4.971 4.971 5.000 -0.029 17569 15329 1 24 . 1 1 109 109 TRP CA C 263 58.097 58.097 56.825 1.272 17569 15330 1 24 . 1 1 109 109 TRP CB C 263 30.493 30.493 30.041 0.452 17569 15331 1 24 . 1 1 109 109 TRP H H 263 10.497 10.497 8.137 2.360 17569 15332 1 24 . 1 1 110 110 TYR N N 264 126.600 126.600 126.243 0.357 17569 15333 1 24 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.192 0.210 17569 15334 1 24 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.653 -2.982 17569 15335 1 24 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.582 -0.574 17569 15336 1 24 . 1 1 110 110 TYR H H 264 7.545 7.545 8.342 -0.797 17569 15337 1 24 . 1 1 111 111 CYS N N 265 124.622 124.622 114.112 10.510 17569 15338 1 24 . 1 1 111 111 CYS H H 265 8.586 8.586 8.126 0.460 17569 15339 1 24 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.863 -0.671 17569 15340 1 24 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.849 0.866 17569 15341 1 24 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.645 1.275 17569 15342 1 24 . 1 1 113 113 ILE N N 267 119.504 119.504 119.792 -0.288 17569 15343 1 24 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.719 -0.769 17569 15344 1 24 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.986 0.263 17569 15345 1 24 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.615 -3.082 17569 15346 1 24 . 1 1 113 113 ILE H H 267 9.160 9.160 7.487 1.673 17569 15347 1 24 . 1 1 114 114 CYS N N 268 124.100 124.100 118.337 5.763 17569 15348 1 24 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.143 -0.329 17569 15349 1 24 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.548 3.752 17569 15350 1 24 . 1 1 114 114 CYS CB C 268 29.721 29.721 26.976 2.745 17569 15351 1 24 . 1 1 114 114 CYS H H 268 7.818 7.818 8.149 -0.331 17569 15352 1 24 . 1 1 115 115 HIS N N 269 117.127 117.127 111.675 5.452 17569 15353 1 24 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.757 0.372 17569 15354 1 24 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.019 -0.858 17569 15355 1 24 . 1 1 115 115 HIS CB C 269 31.192 31.192 29.111 2.081 17569 15356 1 24 . 1 1 115 115 HIS H H 269 8.953 8.953 7.824 1.129 17569 15357 1 24 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.524 0.418 17569 15358 1 24 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.536 -0.228 17569 15359 1 24 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.583 1.059 17569 15360 1 24 . 1 1 117 117 GLU N N 271 123.504 123.504 123.503 0.001 17569 15361 1 24 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.442 -0.422 17569 15362 1 24 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.086 3.783 17569 15363 1 24 . 1 1 117 117 GLU CB C 271 27.051 27.051 29.196 -2.145 17569 15364 1 24 . 1 1 117 117 GLU H H 271 8.402 8.402 8.140 0.262 17569 15365 1 24 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.527 0.015 17569 15366 1 24 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.541 1.818 17569 15367 1 24 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.367 0.775 17569 15368 1 24 . 1 1 119 119 LEU N N 273 112.296 112.296 113.951 -1.655 17569 15369 1 24 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.925 -0.451 17569 15370 1 24 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.459 0.083 17569 15371 1 24 . 1 1 119 119 LEU H H 273 8.090 8.090 7.403 0.687 17569 15372 1 24 . 1 1 120 120 LEU N N 274 121.388 121.388 123.736 -2.348 17569 15373 1 24 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.936 0.091 17569 15374 1 24 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.844 -0.543 17569 15375 1 24 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.157 0.943 17569 15376 1 24 . 1 1 120 120 LEU H H 274 7.823 7.823 8.549 -0.726 17569 15377 1 24 . 1 1 121 121 ASP N N 275 118.600 118.600 118.441 0.159 17569 15378 1 24 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.357 0.184 17569 15379 1 24 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.809 -0.105 17569 15380 1 24 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.187 -0.744 17569 15381 1 24 . 1 1 121 121 ASP H H 275 8.694 8.694 8.694 -0.000 17569 15382 1 24 . 1 1 122 122 LEU N N 276 123.192 123.192 120.820 2.372 17569 15383 1 24 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.884 0.508 17569 15384 1 24 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.747 0.224 17569 15385 1 24 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.028 0.514 17569 15386 1 24 . 1 1 122 122 LEU H H 276 8.013 8.013 7.329 0.684 17569 15387 1 24 . 1 1 123 123 VAL N N 277 126.898 126.898 118.655 8.243 17569 15388 1 24 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.601 0.254 17569 15389 1 24 . 1 1 123 123 VAL CA C 277 66.663 66.663 67.002 -0.340 17569 15390 1 24 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.628 0.429 17569 15391 1 24 . 1 1 123 123 VAL H H 277 8.781 8.781 7.795 0.986 17569 15392 1 24 . 1 1 124 124 THR N N 278 117.500 117.500 116.339 1.161 17569 15393 1 24 . 1 1 124 124 THR HA H 278 4.030 4.030 3.894 0.136 17569 15394 1 24 . 1 1 124 124 THR CA C 278 66.589 66.589 67.216 -0.627 17569 15395 1 24 . 1 1 124 124 THR CB C 278 68.410 68.410 68.555 -0.144 17569 15396 1 24 . 1 1 124 124 THR H H 278 8.722 8.722 8.479 0.243 17569 15397 1 24 . 1 1 125 125 ALA N N 279 124.700 124.700 123.680 1.020 17569 15398 1 24 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.104 0.157 17569 15399 1 24 . 1 1 125 125 ALA CA C 279 55.296 55.296 54.983 0.313 17569 15400 1 24 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.908 0.041 17569 15401 1 24 . 1 1 125 125 ALA H H 279 8.239 8.239 7.948 0.291 17569 15402 1 24 . 1 1 126 126 CYS N N 280 119.276 119.276 117.977 1.299 17569 15403 1 24 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.964 0.150 17569 15404 1 24 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.034 -0.931 17569 15405 1 24 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.053 -0.557 17569 15406 1 24 . 1 1 126 126 CYS H H 280 8.128 8.128 7.743 0.385 17569 15407 1 24 . 1 1 127 127 ASN N N 281 118.000 118.000 118.735 -0.735 17569 15408 1 24 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.610 -0.050 17569 15409 1 24 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.645 -0.506 17569 15410 1 24 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.736 -0.771 17569 15411 1 24 . 1 1 127 127 ASN H H 281 8.725 8.725 7.987 0.738 17569 15412 1 24 . 1 1 128 128 SER N N 282 116.601 116.601 116.370 0.231 17569 15413 1 24 . 1 1 128 128 SER HA H 282 4.363 4.363 4.270 0.093 17569 15414 1 24 . 1 1 128 128 SER CA C 282 61.899 61.899 61.580 0.319 17569 15415 1 24 . 1 1 128 128 SER CB C 282 62.630 62.630 63.072 -0.442 17569 15416 1 24 . 1 1 128 128 SER H H 282 8.542 8.542 7.600 0.942 17569 15417 1 24 . 1 1 129 129 VAL N N 283 123.272 123.272 121.710 1.562 17569 15418 1 24 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.539 0.138 17569 15419 1 24 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.829 -0.321 17569 15420 1 24 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.526 -0.308 17569 15421 1 24 . 1 1 129 129 VAL H H 283 7.990 7.990 7.842 0.148 17569 15422 1 24 . 1 1 130 130 PHE N N 284 118.594 118.594 119.266 -0.672 17569 15423 1 24 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.286 -0.273 17569 15424 1 24 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.210 2.290 17569 15425 1 24 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.326 0.670 17569 15426 1 24 . 1 1 130 130 PHE H H 284 8.190 8.190 8.132 0.058 17569 15427 1 24 . 1 1 131 131 GLU N N 285 120.905 120.905 120.187 0.718 17569 15428 1 24 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.063 0.142 17569 15429 1 24 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.633 -0.419 17569 15430 1 24 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.283 0.217 17569 15431 1 24 . 1 1 131 131 GLU H H 285 8.699 8.699 8.785 -0.086 17569 15432 1 24 . 1 1 132 132 ASN N N 286 117.997 117.997 118.032 -0.035 17569 15433 1 24 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.690 -0.095 17569 15434 1 24 . 1 1 132 132 ASN CA C 286 55.615 55.615 55.972 -0.357 17569 15435 1 24 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.703 0.149 17569 15436 1 24 . 1 1 132 132 ASN H H 286 8.082 8.082 7.833 0.249 17569 15437 1 24 . 1 1 133 133 LEU N N 287 120.800 120.800 122.348 -1.548 17569 15438 1 24 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.373 -0.256 17569 15439 1 24 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.184 -0.386 17569 15440 1 24 . 1 1 133 133 LEU H H 287 7.904 7.904 8.482 -0.578 17569 15441 1 24 . 1 1 134 134 GLU N N 288 118.200 118.200 119.467 -1.267 17569 15442 1 24 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.930 0.149 17569 15443 1 24 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.238 -1.241 17569 15444 1 24 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.256 -0.014 17569 15445 1 24 . 1 1 134 134 GLU H H 288 8.157 8.157 8.627 -0.470 17569 15446 1 24 . 1 1 135 135 GLN N N 289 117.400 117.400 118.779 -1.379 17569 15447 1 24 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.122 0.052 17569 15448 1 24 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.771 -0.782 17569 15449 1 24 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.108 -0.028 17569 15450 1 24 . 1 1 135 135 GLN H H 289 7.869 7.869 7.786 0.083 17569 15451 1 24 . 1 1 136 136 LEU N N 290 121.000 121.000 120.842 0.158 17569 15452 1 24 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.900 0.273 17569 15453 1 24 . 1 1 136 136 LEU CA C 290 57.138 57.138 58.123 -0.985 17569 15454 1 24 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.706 0.294 17569 15455 1 24 . 1 1 136 136 LEU H H 290 7.968 7.968 7.621 0.347 17569 15456 1 24 . 1 1 137 137 LEU N N 291 118.900 118.900 118.211 0.689 17569 15457 1 24 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.028 0.213 17569 15458 1 24 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.402 -1.042 17569 15459 1 24 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.224 -0.752 17569 15460 1 24 . 1 1 137 137 LEU H H 291 8.154 8.154 7.880 0.274 17569 15461 1 24 . 1 1 138 138 GLN N N 292 117.993 117.993 115.406 2.587 17569 15462 1 24 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.092 0.180 17569 15463 1 24 . 1 1 138 138 GLN CA C 292 56.632 56.632 57.586 -0.954 17569 15464 1 24 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.534 -0.950 17569 15465 1 24 . 1 1 138 138 GLN H H 292 7.896 7.896 7.593 0.303 17569 15466 1 24 . 1 1 139 139 GLN N N 293 118.889 118.889 119.381 -0.492 17569 15467 1 24 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.346 -0.077 17569 15468 1 24 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.632 0.822 17569 15469 1 24 . 1 1 139 139 GLN CB C 293 29.069 29.069 27.716 1.353 17569 15470 1 24 . 1 1 139 139 GLN H H 293 8.091 8.091 8.118 -0.027 17569 15471 1 24 . 1 1 140 140 ASN N N 294 118.604 118.604 120.026 -1.422 17569 15472 1 24 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.918 -0.159 17569 15473 1 24 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.032 0.189 17569 15474 1 24 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.404 -1.671 17569 15475 1 24 . 1 1 140 140 ASN H H 294 8.273 8.273 7.727 0.546 17569 15476 1 24 . 1 1 141 141 LYS N N 295 121.685 121.685 121.491 0.194 17569 15477 1 24 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.429 -0.069 17569 15478 1 24 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.625 -0.452 17569 15479 1 24 . 1 1 141 141 LYS CB C 295 32.535 32.535 31.702 0.833 17569 15480 1 24 . 1 1 141 141 LYS H H 295 8.089 8.089 8.540 -0.451 17569 15481 1 25 . 1 1 2 2 ALA HA H 156 4.387 4.387 4.703 -0.316 17569 15482 1 25 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.026 0.419 17569 15483 1 25 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.331 -0.075 17569 15484 1 25 . 1 1 3 3 MET HA H 157 4.476 4.476 4.643 -0.167 17569 15485 1 25 . 1 1 3 3 MET CA C 157 55.401 55.401 55.788 -0.387 17569 15486 1 25 . 1 1 4 4 ALA N N 158 124.828 124.828 123.777 1.051 17569 15487 1 25 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.649 -0.335 17569 15488 1 25 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.635 0.876 17569 15489 1 25 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.078 -1.077 17569 15490 1 25 . 1 1 4 4 ALA H H 158 8.382 8.382 7.839 0.543 17569 15491 1 25 . 1 1 5 5 ASP N N 159 119.418 119.418 120.554 -1.136 17569 15492 1 25 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.869 -0.279 17569 15493 1 25 . 1 1 5 5 ASP CA C 159 54.136 54.136 53.825 0.311 17569 15494 1 25 . 1 1 5 5 ASP CB C 159 41.015 41.015 42.376 -1.361 17569 15495 1 25 . 1 1 5 5 ASP H H 159 8.312 8.312 8.420 -0.108 17569 15496 1 25 . 1 1 6 6 LYS N N 160 121.604 121.604 120.352 1.252 17569 15497 1 25 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.645 -0.302 17569 15498 1 25 . 1 1 6 6 LYS H H 160 8.274 8.274 8.595 -0.321 17569 15499 1 25 . 1 1 7 7 ARG N N 161 121.611 121.611 120.176 1.435 17569 15500 1 25 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.481 -0.154 17569 15501 1 25 . 1 1 7 7 ARG H H 161 8.430 8.430 8.519 -0.089 17569 15502 1 25 . 1 1 8 8 GLY N N 162 109.606 109.606 108.469 1.137 17569 15503 1 25 . 1 1 8 8 GLY CA C 162 45.047 45.047 45.440 -0.393 17569 15504 1 25 . 1 1 8 8 GLY H H 162 8.473 8.473 7.933 0.540 17569 15505 1 25 . 1 1 9 9 ASP N N 163 120.187 120.187 119.621 0.566 17569 15506 1 25 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.771 -0.122 17569 15507 1 25 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.436 0.715 17569 15508 1 25 . 1 1 9 9 ASP H H 163 8.296 8.296 7.745 0.551 17569 15509 1 25 . 1 1 10 10 GLY N N 164 108.816 108.816 109.233 -0.417 17569 15510 1 25 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.277 0.090 17569 15511 1 25 . 1 1 10 10 GLY H H 164 8.458 8.458 8.230 0.228 17569 15512 1 25 . 1 1 11 11 LEU N N 165 121.195 121.195 123.653 -2.458 17569 15513 1 25 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.719 -0.403 17569 15514 1 25 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.694 0.306 17569 15515 1 25 . 1 1 11 11 LEU CB C 165 41.932 41.932 40.440 1.492 17569 15516 1 25 . 1 1 11 11 LEU H H 165 8.137 8.137 8.169 -0.032 17569 15517 1 25 . 1 1 12 12 HIS N N 166 119.387 119.387 123.187 -3.800 17569 15518 1 25 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.719 -0.064 17569 15519 1 25 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.401 0.868 17569 15520 1 25 . 1 1 12 12 HIS CB C 166 30.697 30.697 29.779 0.918 17569 15521 1 25 . 1 1 12 12 HIS H H 166 8.270 8.270 8.799 -0.529 17569 15522 1 25 . 1 1 13 13 GLY N N 167 109.899 109.899 111.860 -1.961 17569 15523 1 25 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.964 0.141 17569 15524 1 25 . 1 1 13 13 GLY H H 167 8.276 8.276 8.419 -0.143 17569 15525 1 25 . 1 1 14 14 ILE N N 168 119.597 119.597 123.249 -3.652 17569 15526 1 25 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.283 0.040 17569 15527 1 25 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.401 0.199 17569 15528 1 25 . 1 1 14 14 ILE CB C 168 38.950 38.950 41.997 -3.047 17569 15529 1 25 . 1 1 14 14 ILE H H 168 7.962 7.962 8.199 -0.237 17569 15530 1 25 . 1 1 15 15 VAL N N 169 127.578 127.578 125.821 1.757 17569 15531 1 25 . 1 1 15 15 VAL HA H 169 4.280 4.280 3.977 0.303 17569 15532 1 25 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.653 -1.336 17569 15533 1 25 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.620 2.782 17569 15534 1 25 . 1 1 15 15 VAL H H 169 9.011 9.011 8.513 0.498 17569 15535 1 25 . 1 1 16 16 SER N N 170 118.596 118.596 120.047 -1.451 17569 15536 1 25 . 1 1 16 16 SER HA H 170 5.140 5.140 4.684 0.456 17569 15537 1 25 . 1 1 16 16 SER CA C 170 55.985 55.985 56.295 -0.310 17569 15538 1 25 . 1 1 16 16 SER CB C 170 65.261 65.261 65.698 -0.437 17569 15539 1 25 . 1 1 16 16 SER H H 170 8.242 8.242 7.764 0.478 17569 15540 1 25 . 1 1 17 17 CYS N N 171 123.783 123.783 123.363 0.420 17569 15541 1 25 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.166 0.015 17569 15542 1 25 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.820 -0.976 17569 15543 1 25 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.500 2.873 17569 15544 1 25 . 1 1 17 17 CYS H H 171 8.894 8.894 8.513 0.381 17569 15545 1 25 . 1 1 18 18 THR N N 172 121.703 121.703 117.557 4.146 17569 15546 1 25 . 1 1 18 18 THR HA H 172 4.386 4.386 4.093 0.293 17569 15547 1 25 . 1 1 18 18 THR CA C 172 64.667 64.667 64.310 0.357 17569 15548 1 25 . 1 1 18 18 THR CB C 172 69.498 69.498 68.805 0.693 17569 15549 1 25 . 1 1 18 18 THR H H 172 8.788 8.788 8.301 0.487 17569 15550 1 25 . 1 1 19 19 ALA N N 173 131.364 131.364 121.220 10.144 17569 15551 1 25 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.166 0.330 17569 15552 1 25 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.405 0.620 17569 15553 1 25 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.394 3.788 17569 15554 1 25 . 1 1 19 19 ALA H H 173 9.680 9.680 8.054 1.626 17569 15555 1 25 . 1 1 20 20 CYS N N 174 115.498 115.498 115.032 0.466 17569 15556 1 25 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.718 0.250 17569 15557 1 25 . 1 1 20 20 CYS CA C 174 58.094 58.094 58.838 -0.744 17569 15558 1 25 . 1 1 20 20 CYS CB C 174 33.244 33.244 29.264 3.980 17569 15559 1 25 . 1 1 20 20 CYS H H 174 8.470 8.470 7.608 0.862 17569 15560 1 25 . 1 1 21 21 GLY N N 175 112.464 112.464 108.833 3.631 17569 15561 1 25 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.123 0.583 17569 15562 1 25 . 1 1 21 21 GLY H H 175 7.884 7.884 7.982 -0.098 17569 15563 1 25 . 1 1 22 22 GLN N N 176 121.784 121.784 118.007 3.777 17569 15564 1 25 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.419 -0.043 17569 15565 1 25 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.346 1.945 17569 15566 1 25 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.587 -2.246 17569 15567 1 25 . 1 1 22 22 GLN H H 176 8.723 8.723 7.814 0.909 17569 15568 1 25 . 1 1 23 23 GLN N N 177 122.900 122.900 124.161 -1.261 17569 15569 1 25 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.233 0.297 17569 15570 1 25 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.736 -0.186 17569 15571 1 25 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.280 -0.820 17569 15572 1 25 . 1 1 23 23 GLN H H 177 8.721 8.721 8.576 0.145 17569 15573 1 25 . 1 1 24 24 VAL N N 178 121.000 121.000 126.075 -5.075 17569 15574 1 25 . 1 1 24 24 VAL HA H 178 4.524 4.524 4.030 0.494 17569 15575 1 25 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.329 -1.452 17569 15576 1 25 . 1 1 24 24 VAL H H 178 8.689 8.689 7.976 0.713 17569 15577 1 25 . 1 1 25 25 ASN N N 179 121.392 121.392 122.634 -1.242 17569 15578 1 25 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.376 0.500 17569 15579 1 25 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.372 -2.223 17569 15580 1 25 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.985 -1.008 17569 15581 1 25 . 1 1 25 25 ASN H H 179 8.635 8.635 7.892 0.743 17569 15582 1 25 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.607 -0.147 17569 15583 1 25 . 1 1 27 27 PHE CA C 181 56.998 56.998 56.836 0.162 17569 15584 1 25 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.088 -0.695 17569 15585 1 25 . 1 1 28 28 GLN N N 182 119.300 119.300 122.494 -3.194 17569 15586 1 25 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.289 0.229 17569 15587 1 25 . 1 1 28 28 GLN CA C 182 54.342 54.342 56.465 -2.123 17569 15588 1 25 . 1 1 28 28 GLN CB C 182 30.350 30.350 29.665 0.685 17569 15589 1 25 . 1 1 28 28 GLN H H 182 7.494 7.494 7.898 -0.404 17569 15590 1 25 . 1 1 29 29 LYS N N 183 124.516 124.516 126.029 -1.513 17569 15591 1 25 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.365 -0.443 17569 15592 1 25 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.525 1.787 17569 15593 1 25 . 1 1 29 29 LYS CB C 183 32.286 32.286 33.289 -1.004 17569 15594 1 25 . 1 1 29 29 LYS H H 183 8.779 8.779 8.382 0.397 17569 15595 1 25 . 1 1 30 30 ASP N N 184 116.500 116.500 119.035 -2.535 17569 15596 1 25 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.492 -0.033 17569 15597 1 25 . 1 1 30 30 ASP CA C 184 54.536 54.536 55.479 -0.943 17569 15598 1 25 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.535 -0.564 17569 15599 1 25 . 1 1 30 30 ASP H H 184 8.556 8.556 8.700 -0.144 17569 15600 1 25 . 1 1 31 31 SER N N 185 111.505 111.505 112.039 -0.534 17569 15601 1 25 . 1 1 31 31 SER HA H 185 4.695 4.695 4.699 -0.004 17569 15602 1 25 . 1 1 31 31 SER CA C 185 59.747 59.747 57.580 2.167 17569 15603 1 25 . 1 1 31 31 SER CB C 185 65.198 65.198 63.720 1.478 17569 15604 1 25 . 1 1 31 31 SER H H 185 7.933 7.933 8.224 -0.291 17569 15605 1 25 . 1 1 32 32 ILE N N 186 113.394 113.394 116.404 -3.010 17569 15606 1 25 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.898 -0.012 17569 15607 1 25 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.443 -0.864 17569 15608 1 25 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.309 1.503 17569 15609 1 25 . 1 1 32 32 ILE H H 186 7.105 7.105 7.527 -0.422 17569 15610 1 25 . 1 1 33 33 TYR N N 187 119.098 119.098 121.593 -2.495 17569 15611 1 25 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.247 -0.724 17569 15612 1 25 . 1 1 33 33 TYR CA C 187 57.260 57.260 55.697 1.563 17569 15613 1 25 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.389 2.051 17569 15614 1 25 . 1 1 33 33 TYR H H 187 8.954 8.954 7.595 1.359 17569 15615 1 25 . 1 1 34 34 ARG N N 188 118.502 118.502 123.405 -4.903 17569 15616 1 25 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.743 -0.106 17569 15617 1 25 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.261 -1.508 17569 15618 1 25 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.398 0.853 17569 15619 1 25 . 1 1 34 34 ARG H H 188 8.412 8.412 8.715 -0.303 17569 15620 1 25 . 1 1 35 35 HIS N N 189 126.596 126.596 128.789 -2.193 17569 15621 1 25 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.902 -0.310 17569 15622 1 25 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.160 -0.439 17569 15623 1 25 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.157 1.315 17569 15624 1 25 . 1 1 35 35 HIS H H 189 9.813 9.813 9.129 0.684 17569 15625 1 25 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.555 -0.257 17569 15626 1 25 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.951 0.325 17569 15627 1 25 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.203 0.648 17569 15628 1 25 . 1 1 37 37 SER N N 191 110.003 110.003 113.855 -3.852 17569 15629 1 25 . 1 1 37 37 SER HA H 191 4.918 4.918 4.308 0.610 17569 15630 1 25 . 1 1 37 37 SER CA C 191 59.031 59.031 61.001 -1.970 17569 15631 1 25 . 1 1 37 37 SER CB C 191 65.104 65.104 63.315 1.789 17569 15632 1 25 . 1 1 37 37 SER H H 191 8.934 8.934 8.542 0.392 17569 15633 1 25 . 1 1 38 38 LEU N N 192 120.959 120.959 113.775 7.184 17569 15634 1 25 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.923 -0.794 17569 15635 1 25 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.211 1.935 17569 15636 1 25 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.544 1.452 17569 15637 1 25 . 1 1 38 38 LEU H H 192 8.649 8.649 7.058 1.591 17569 15638 1 25 . 1 1 39 39 GLN N N 193 108.600 108.600 119.506 -10.906 17569 15639 1 25 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.081 -0.176 17569 15640 1 25 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.669 0.145 17569 15641 1 25 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.853 -1.819 17569 15642 1 25 . 1 1 39 39 GLN H H 193 8.465 8.465 7.876 0.589 17569 15643 1 25 . 1 1 40 40 VAL N N 194 105.325 105.325 117.524 -12.199 17569 15644 1 25 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.520 0.030 17569 15645 1 25 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.667 -1.026 17569 15646 1 25 . 1 1 40 40 VAL H H 194 6.256 6.256 7.824 -1.568 17569 15647 1 25 . 1 1 41 41 LEU N N 195 123.100 123.100 122.138 0.962 17569 15648 1 25 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.759 0.057 17569 15649 1 25 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.643 3.539 17569 15650 1 25 . 1 1 41 41 LEU CB C 195 43.570 43.570 42.999 0.571 17569 15651 1 25 . 1 1 41 41 LEU H H 195 9.154 9.154 8.532 0.622 17569 15652 1 25 . 1 1 42 42 ILE N N 196 124.396 124.396 117.253 7.143 17569 15653 1 25 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.798 1.554 17569 15654 1 25 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.273 0.957 17569 15655 1 25 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.820 1.450 17569 15656 1 25 . 1 1 42 42 ILE H H 196 9.766 9.766 7.806 1.960 17569 15657 1 25 . 1 1 43 43 CYS N N 197 121.500 121.500 115.013 6.487 17569 15658 1 25 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.002 0.260 17569 15659 1 25 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.127 0.576 17569 15660 1 25 . 1 1 43 43 CYS CB C 197 33.300 33.300 30.877 2.423 17569 15661 1 25 . 1 1 43 43 CYS H H 197 9.882 9.882 8.320 1.562 17569 15662 1 25 . 1 1 44 44 LYS N N 198 117.995 117.995 122.450 -4.455 17569 15663 1 25 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.227 -0.238 17569 15664 1 25 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.048 -0.388 17569 15665 1 25 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.487 0.213 17569 15666 1 25 . 1 1 44 44 LYS H H 198 8.089 8.089 8.920 -0.831 17569 15667 1 25 . 1 1 45 45 ASN N N 199 119.200 119.200 117.003 2.197 17569 15668 1 25 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.567 -0.053 17569 15669 1 25 . 1 1 45 45 ASN CA C 199 56.720 56.720 55.961 0.759 17569 15670 1 25 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.496 -0.329 17569 15671 1 25 . 1 1 45 45 ASN H H 199 8.356 8.356 8.562 -0.206 17569 15672 1 25 . 1 1 46 46 CYS N N 200 126.600 126.600 119.115 7.485 17569 15673 1 25 . 1 1 46 46 CYS HA H 200 4.181 4.181 4.036 0.145 17569 15674 1 25 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.393 2.102 17569 15675 1 25 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.150 2.032 17569 15676 1 25 . 1 1 46 46 CYS H H 200 9.189 9.189 7.571 1.618 17569 15677 1 25 . 1 1 47 47 PHE N N 201 121.962 121.962 120.219 1.743 17569 15678 1 25 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.047 -0.177 17569 15679 1 25 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.774 1.495 17569 15680 1 25 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.469 0.698 17569 15681 1 25 . 1 1 47 47 PHE H H 201 8.826 8.826 8.346 0.480 17569 15682 1 25 . 1 1 48 48 LYS N N 202 117.400 117.400 120.396 -2.996 17569 15683 1 25 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.918 -0.220 17569 15684 1 25 . 1 1 48 48 LYS CA C 202 58.952 58.952 60.110 -1.158 17569 15685 1 25 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.239 -0.697 17569 15686 1 25 . 1 1 48 48 LYS H H 202 8.512 8.512 7.884 0.628 17569 15687 1 25 . 1 1 49 49 TYR N N 203 120.400 120.400 120.238 0.162 17569 15688 1 25 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.190 0.224 17569 15689 1 25 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.967 -1.195 17569 15690 1 25 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.526 -0.080 17569 15691 1 25 . 1 1 49 49 TYR H H 203 8.133 8.133 7.579 0.554 17569 15692 1 25 . 1 1 50 50 TYR N N 204 121.783 121.783 117.790 3.993 17569 15693 1 25 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.617 -1.122 17569 15694 1 25 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.916 3.034 17569 15695 1 25 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.565 0.928 17569 15696 1 25 . 1 1 50 50 TYR H H 204 8.765 8.765 7.463 1.302 17569 15697 1 25 . 1 1 51 51 MET N N 205 110.800 110.800 116.117 -5.317 17569 15698 1 25 . 1 1 51 51 MET HA H 205 4.349 4.349 4.131 0.218 17569 15699 1 25 . 1 1 51 51 MET CA C 205 53.505 53.505 58.146 -4.641 17569 15700 1 25 . 1 1 51 51 MET CB C 205 30.384 30.384 33.200 -2.816 17569 15701 1 25 . 1 1 51 51 MET H H 205 7.771 7.771 8.521 -0.750 17569 15702 1 25 . 1 1 52 52 SER N N 206 116.800 116.800 112.574 4.226 17569 15703 1 25 . 1 1 52 52 SER HA H 206 3.919 3.919 4.481 -0.562 17569 15704 1 25 . 1 1 52 52 SER CA C 206 61.621 61.621 59.951 1.670 17569 15705 1 25 . 1 1 52 52 SER CB C 206 62.611 62.611 64.489 -1.878 17569 15706 1 25 . 1 1 52 52 SER H H 206 7.581 7.581 8.206 -0.625 17569 15707 1 25 . 1 1 53 53 ASP N N 207 117.400 117.400 121.974 -4.574 17569 15708 1 25 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.753 -0.181 17569 15709 1 25 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.485 -0.386 17569 15710 1 25 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.268 -0.080 17569 15711 1 25 . 1 1 53 53 ASP H H 207 7.085 7.085 7.919 -0.834 17569 15712 1 25 . 1 1 54 54 ASP N N 208 119.405 119.405 122.925 -3.520 17569 15713 1 25 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.954 -0.565 17569 15714 1 25 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.111 0.789 17569 15715 1 25 . 1 1 54 54 ASP CB C 208 41.349 41.349 43.462 -2.113 17569 15716 1 25 . 1 1 54 54 ASP H H 208 8.439 8.439 8.416 0.023 17569 15717 1 25 . 1 1 55 55 ILE N N 209 124.698 124.698 122.616 2.082 17569 15718 1 25 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.143 -0.143 17569 15719 1 25 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.547 1.731 17569 15720 1 25 . 1 1 55 55 ILE CB C 209 39.291 39.291 37.291 2.000 17569 15721 1 25 . 1 1 55 55 ILE H H 209 8.128 8.128 8.499 -0.371 17569 15722 1 25 . 1 1 56 56 SER N N 210 126.703 126.703 123.410 3.293 17569 15723 1 25 . 1 1 56 56 SER HA H 210 4.365 4.365 4.179 0.186 17569 15724 1 25 . 1 1 56 56 SER CA C 210 57.769 57.769 61.032 -3.263 17569 15725 1 25 . 1 1 56 56 SER CB C 210 64.991 64.991 63.540 1.451 17569 15726 1 25 . 1 1 56 56 SER H H 210 8.815 8.815 8.894 -0.079 17569 15727 1 25 . 1 1 57 57 ARG N N 211 116.885 116.885 117.484 -0.599 17569 15728 1 25 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.337 0.705 17569 15729 1 25 . 1 1 57 57 ARG CA C 211 54.400 54.400 56.282 -1.882 17569 15730 1 25 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.605 2.679 17569 15731 1 25 . 1 1 57 57 ARG H H 211 8.365 8.365 7.417 0.948 17569 15732 1 25 . 1 1 58 58 ASP N N 212 121.982 121.982 117.441 4.541 17569 15733 1 25 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.382 0.233 17569 15734 1 25 . 1 1 58 58 ASP CA C 212 52.222 52.222 57.034 -4.812 17569 15735 1 25 . 1 1 58 58 ASP CB C 212 41.502 41.502 39.550 1.952 17569 15736 1 25 . 1 1 58 58 ASP H H 212 8.706 8.706 8.177 0.529 17569 15737 1 25 . 1 1 59 59 SER N N 213 114.164 114.164 116.541 -2.377 17569 15738 1 25 . 1 1 59 59 SER HA H 213 4.212 4.212 4.184 0.028 17569 15739 1 25 . 1 1 59 59 SER CA C 213 60.840 60.840 60.840 -0.000 17569 15740 1 25 . 1 1 59 59 SER CB C 213 62.714 62.714 63.247 -0.533 17569 15741 1 25 . 1 1 59 59 SER H H 213 8.687 8.687 7.970 0.717 17569 15742 1 25 . 1 1 60 60 ASP N N 214 120.899 120.899 119.230 1.669 17569 15743 1 25 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.750 0.075 17569 15744 1 25 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.191 1.020 17569 15745 1 25 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.293 1.265 17569 15746 1 25 . 1 1 60 60 ASP H H 214 8.193 8.193 7.585 0.608 17569 15747 1 25 . 1 1 61 61 GLY N N 215 108.300 108.300 108.609 -0.309 17569 15748 1 25 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.886 -0.489 17569 15749 1 25 . 1 1 61 61 GLY H H 215 8.234 8.234 8.129 0.105 17569 15750 1 25 . 1 1 62 62 MET N N 216 120.002 120.002 118.307 1.695 17569 15751 1 25 . 1 1 62 62 MET HA H 216 4.972 4.972 4.732 0.240 17569 15752 1 25 . 1 1 62 62 MET CA C 216 53.151 53.151 53.958 -0.807 17569 15753 1 25 . 1 1 62 62 MET CB C 216 32.311 32.311 32.958 -0.646 17569 15754 1 25 . 1 1 62 62 MET H H 216 8.376 8.376 7.547 0.829 17569 15755 1 25 . 1 1 63 63 ASP N N 217 127.300 127.300 122.884 4.416 17569 15756 1 25 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.583 0.383 17569 15757 1 25 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.550 0.019 17569 15758 1 25 . 1 1 63 63 ASP H H 217 9.368 9.368 8.389 0.979 17569 15759 1 25 . 1 1 64 64 GLU N N 218 114.400 114.400 123.297 -8.897 17569 15760 1 25 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.421 -0.265 17569 15761 1 25 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.413 0.437 17569 15762 1 25 . 1 1 64 64 GLU H H 218 8.583 8.583 8.449 0.134 17569 15763 1 25 . 1 1 65 65 GLN N N 219 115.500 115.500 116.761 -1.261 17569 15764 1 25 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.517 -0.206 17569 15765 1 25 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.194 0.152 17569 15766 1 25 . 1 1 65 65 GLN H H 219 7.158 7.158 7.681 -0.523 17569 15767 1 25 . 1 1 66 66 CYS N N 220 122.600 122.600 117.748 4.852 17569 15768 1 25 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.318 -1.241 17569 15769 1 25 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.504 1.025 17569 15770 1 25 . 1 1 66 66 CYS CB C 220 31.972 31.972 31.018 0.954 17569 15771 1 25 . 1 1 66 66 CYS H H 220 8.248 8.248 8.394 -0.146 17569 15772 1 25 . 1 1 67 67 ARG N N 221 130.363 130.363 124.326 6.037 17569 15773 1 25 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.345 -0.278 17569 15774 1 25 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.737 -2.721 17569 15775 1 25 . 1 1 67 67 ARG H H 221 9.145 9.145 8.465 0.680 17569 15776 1 25 . 1 1 68 68 TRP N N 222 124.200 124.200 120.731 3.469 17569 15777 1 25 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.614 -0.178 17569 15778 1 25 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.372 0.708 17569 15779 1 25 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.455 0.739 17569 15780 1 25 . 1 1 68 68 TRP H H 222 9.689 9.689 8.194 1.495 17569 15781 1 25 . 1 1 69 69 CYS N N 223 116.297 116.297 110.669 5.628 17569 15782 1 25 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.106 -0.015 17569 15783 1 25 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.076 3.026 17569 15784 1 25 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.543 4.795 17569 15785 1 25 . 1 1 69 69 CYS H H 223 8.822 8.822 7.687 1.135 17569 15786 1 25 . 1 1 70 70 ALA N N 224 123.112 123.112 124.560 -1.448 17569 15787 1 25 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.341 0.065 17569 15788 1 25 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.275 -0.424 17569 15789 1 25 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.787 -0.067 17569 15790 1 25 . 1 1 70 70 ALA H H 224 8.787 8.787 8.272 0.515 17569 15791 1 25 . 1 1 71 71 GLU N N 225 118.300 118.300 120.763 -2.463 17569 15792 1 25 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.586 0.722 17569 15793 1 25 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.958 -2.659 17569 15794 1 25 . 1 1 71 71 GLU H H 225 8.541 8.541 7.797 0.744 17569 15795 1 25 . 1 1 72 72 GLY N N 226 111.995 111.995 109.207 2.788 17569 15796 1 25 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.227 0.176 17569 15797 1 25 . 1 1 72 72 GLY H H 226 9.837 9.837 8.667 1.170 17569 15798 1 25 . 1 1 73 73 GLY N N 227 106.600 106.600 107.513 -0.913 17569 15799 1 25 . 1 1 73 73 GLY CA C 227 44.971 44.971 43.986 0.985 17569 15800 1 25 . 1 1 73 73 GLY H H 227 7.772 7.772 8.403 -0.631 17569 15801 1 25 . 1 1 74 74 ASN N N 228 124.277 124.277 119.759 4.518 17569 15802 1 25 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.453 0.628 17569 15803 1 25 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.849 -0.749 17569 15804 1 25 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.431 -0.347 17569 15805 1 25 . 1 1 74 74 ASN H H 228 8.876 8.876 8.557 0.319 17569 15806 1 25 . 1 1 75 75 LEU N N 229 123.050 123.050 121.641 1.409 17569 15807 1 25 . 1 1 75 75 LEU HA H 229 4.600 4.600 5.287 -0.687 17569 15808 1 25 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.221 1.141 17569 15809 1 25 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.938 -1.438 17569 15810 1 25 . 1 1 75 75 LEU H H 229 8.901 8.901 7.923 0.979 17569 15811 1 25 . 1 1 76 76 ILE N N 230 123.552 123.552 120.644 2.908 17569 15812 1 25 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.337 0.148 17569 15813 1 25 . 1 1 76 76 ILE CA C 230 60.700 60.700 60.048 0.652 17569 15814 1 25 . 1 1 76 76 ILE CB C 230 37.399 37.399 39.793 -2.394 17569 15815 1 25 . 1 1 76 76 ILE H H 230 9.406 9.406 9.061 0.345 17569 15816 1 25 . 1 1 77 77 CYS N N 231 124.637 124.637 127.157 -2.520 17569 15817 1 25 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.447 -0.572 17569 15818 1 25 . 1 1 77 77 CYS CA C 231 58.359 58.359 58.232 0.127 17569 15819 1 25 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.855 0.579 17569 15820 1 25 . 1 1 77 77 CYS H H 231 8.809 8.809 8.627 0.182 17569 15821 1 25 . 1 1 78 78 CYS N N 232 125.697 125.697 125.141 0.556 17569 15822 1 25 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.770 -0.486 17569 15823 1 25 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.228 3.656 17569 15824 1 25 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.571 1.599 17569 15825 1 25 . 1 1 78 78 CYS H H 232 8.579 8.579 8.815 -0.236 17569 15826 1 25 . 1 1 79 79 ASP N N 233 123.600 123.600 123.993 -0.393 17569 15827 1 25 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.626 0.131 17569 15828 1 25 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.388 2.601 17569 15829 1 25 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.034 1.595 17569 15830 1 25 . 1 1 79 79 ASP H H 233 8.577 8.577 8.576 0.001 17569 15831 1 25 . 1 1 80 80 PHE N N 234 122.100 122.100 116.300 5.800 17569 15832 1 25 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.656 -0.130 17569 15833 1 25 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.382 1.528 17569 15834 1 25 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.072 1.777 17569 15835 1 25 . 1 1 80 80 PHE H H 234 10.432 10.432 7.354 3.078 17569 15836 1 25 . 1 1 81 81 CYS N N 235 124.300 124.300 117.242 7.058 17569 15837 1 25 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.751 0.405 17569 15838 1 25 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.009 0.036 17569 15839 1 25 . 1 1 81 81 CYS CB C 235 31.407 31.407 26.743 4.664 17569 15840 1 25 . 1 1 81 81 CYS H H 235 8.476 8.476 7.928 0.548 17569 15841 1 25 . 1 1 82 82 HIS N N 236 112.598 112.598 118.888 -6.290 17569 15842 1 25 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.210 0.773 17569 15843 1 25 . 1 1 82 82 HIS CA C 236 55.398 55.398 57.224 -1.827 17569 15844 1 25 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.862 2.395 17569 15845 1 25 . 1 1 82 82 HIS H H 236 6.699 6.699 8.032 -1.333 17569 15846 1 25 . 1 1 83 83 ASN N N 237 123.600 123.600 118.099 5.501 17569 15847 1 25 . 1 1 83 83 ASN HA H 237 4.801 4.801 5.125 -0.324 17569 15848 1 25 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.635 2.981 17569 15849 1 25 . 1 1 83 83 ASN H H 237 9.097 9.097 7.884 1.213 17569 15850 1 25 . 1 1 84 84 ALA N N 238 122.000 122.000 123.831 -1.831 17569 15851 1 25 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.474 -0.065 17569 15852 1 25 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.453 -0.089 17569 15853 1 25 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.389 2.681 17569 15854 1 25 . 1 1 84 84 ALA H H 238 9.885 9.885 9.002 0.883 17569 15855 1 25 . 1 1 85 85 PHE N N 239 116.707 116.707 119.958 -3.251 17569 15856 1 25 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.118 0.910 17569 15857 1 25 . 1 1 85 85 PHE CA C 239 56.217 56.217 57.254 -1.037 17569 15858 1 25 . 1 1 85 85 PHE CB C 239 44.664 44.664 44.477 0.187 17569 15859 1 25 . 1 1 85 85 PHE H H 239 9.450 9.450 9.138 0.312 17569 15860 1 25 . 1 1 86 86 CYS N N 240 126.682 126.682 117.430 9.252 17569 15861 1 25 . 1 1 86 86 CYS HA H 240 5.622 5.622 5.321 0.301 17569 15862 1 25 . 1 1 86 86 CYS CA C 240 57.342 57.342 55.654 1.688 17569 15863 1 25 . 1 1 86 86 CYS CB C 240 32.257 32.257 31.421 0.836 17569 15864 1 25 . 1 1 86 86 CYS H H 240 11.309 11.309 8.989 2.320 17569 15865 1 25 . 1 1 87 87 LYS N N 241 117.865 117.865 124.033 -6.168 17569 15866 1 25 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.863 -0.014 17569 15867 1 25 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.784 -0.714 17569 15868 1 25 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.508 0.290 17569 15869 1 25 . 1 1 87 87 LYS H H 241 8.230 8.230 8.177 0.053 17569 15870 1 25 . 1 1 88 88 LYS N N 242 117.949 117.949 118.076 -0.127 17569 15871 1 25 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.100 -0.122 17569 15872 1 25 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.074 1.296 17569 15873 1 25 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.066 0.250 17569 15874 1 25 . 1 1 88 88 LYS H H 242 7.945 7.945 8.417 -0.472 17569 15875 1 25 . 1 1 89 89 CYS N N 243 125.305 125.305 117.639 7.666 17569 15876 1 25 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.276 -0.534 17569 15877 1 25 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.691 2.136 17569 15878 1 25 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.095 1.146 17569 15879 1 25 . 1 1 89 89 CYS H H 243 9.297 9.297 7.796 1.501 17569 15880 1 25 . 1 1 90 90 ILE N N 244 119.687 119.687 121.472 -1.785 17569 15881 1 25 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.889 -0.282 17569 15882 1 25 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.719 0.231 17569 15883 1 25 . 1 1 90 90 ILE H H 244 7.997 7.997 7.997 -0.000 17569 15884 1 25 . 1 1 91 91 LEU N N 245 120.280 120.280 120.792 -0.512 17569 15885 1 25 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.283 -0.598 17569 15886 1 25 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.650 0.585 17569 15887 1 25 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.953 0.005 17569 15888 1 25 . 1 1 91 91 LEU H H 245 8.810 8.810 8.776 0.034 17569 15889 1 25 . 1 1 92 92 ARG N N 246 116.901 116.901 116.423 0.478 17569 15890 1 25 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.067 -0.250 17569 15891 1 25 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.309 0.671 17569 15892 1 25 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.179 0.421 17569 15893 1 25 . 1 1 92 92 ARG H H 246 8.086 8.086 7.617 0.469 17569 15894 1 25 . 1 1 93 93 ASN N N 247 111.200 111.200 116.281 -5.081 17569 15895 1 25 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.492 0.111 17569 15896 1 25 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.761 1.047 17569 15897 1 25 . 1 1 93 93 ASN CB C 247 42.484 42.484 38.971 3.513 17569 15898 1 25 . 1 1 93 93 ASN H H 247 7.136 7.136 8.122 -0.986 17569 15899 1 25 . 1 1 94 94 LEU N N 248 118.807 118.807 117.403 1.404 17569 15900 1 25 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.421 0.393 17569 15901 1 25 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.174 0.015 17569 15902 1 25 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.629 0.069 17569 15903 1 25 . 1 1 94 94 LEU H H 248 8.515 8.515 7.959 0.556 17569 15904 1 25 . 1 1 95 95 GLY N N 249 108.000 108.000 106.367 1.633 17569 15905 1 25 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.523 0.105 17569 15906 1 25 . 1 1 95 95 GLY H H 249 7.955 7.955 7.520 0.435 17569 15907 1 25 . 1 1 96 96 ARG N N 250 117.797 117.797 120.802 -3.005 17569 15908 1 25 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.285 -0.442 17569 15909 1 25 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.388 0.294 17569 15910 1 25 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.323 -0.463 17569 15911 1 25 . 1 1 96 96 ARG H H 250 8.559 8.559 8.715 -0.156 17569 15912 1 25 . 1 1 97 97 LYS N N 251 120.900 120.900 119.428 1.472 17569 15913 1 25 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.046 0.110 17569 15914 1 25 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.631 -0.475 17569 15915 1 25 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.745 -0.385 17569 15916 1 25 . 1 1 97 97 LYS H H 251 8.655 8.655 8.449 0.206 17569 15917 1 25 . 1 1 98 98 GLU N N 252 122.000 122.000 118.825 3.175 17569 15918 1 25 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.126 0.225 17569 15919 1 25 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.173 -0.591 17569 15920 1 25 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.360 -0.960 17569 15921 1 25 . 1 1 98 98 GLU H H 252 7.705 7.705 8.250 -0.545 17569 15922 1 25 . 1 1 99 99 LEU N N 253 117.400 117.400 121.371 -3.971 17569 15923 1 25 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.816 0.101 17569 15924 1 25 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.072 -0.074 17569 15925 1 25 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.833 -0.351 17569 15926 1 25 . 1 1 99 99 LEU H H 253 7.285 7.285 7.535 -0.250 17569 15927 1 25 . 1 1 100 100 SER N N 254 112.100 112.100 114.452 -2.352 17569 15928 1 25 . 1 1 100 100 SER HA H 254 4.107 4.107 4.153 -0.046 17569 15929 1 25 . 1 1 100 100 SER CA C 254 61.603 61.603 62.165 -0.562 17569 15930 1 25 . 1 1 100 100 SER CB C 254 62.622 62.622 63.035 -0.413 17569 15931 1 25 . 1 1 100 100 SER H H 254 8.326 8.326 7.803 0.523 17569 15932 1 25 . 1 1 101 101 THR N N 255 118.151 118.151 118.392 -0.241 17569 15933 1 25 . 1 1 101 101 THR HA H 255 4.026 4.026 4.061 -0.035 17569 15934 1 25 . 1 1 101 101 THR CA C 255 66.261 66.261 66.225 0.036 17569 15935 1 25 . 1 1 101 101 THR CB C 255 68.735 68.735 68.610 0.125 17569 15936 1 25 . 1 1 101 101 THR H H 255 7.972 7.972 7.660 0.312 17569 15937 1 25 . 1 1 102 102 ILE N N 256 120.100 120.100 121.637 -1.537 17569 15938 1 25 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.594 -0.131 17569 15939 1 25 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.583 0.191 17569 15940 1 25 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.381 0.360 17569 15941 1 25 . 1 1 102 102 ILE H H 256 7.868 7.868 8.408 -0.540 17569 15942 1 25 . 1 1 103 103 MET N N 257 114.876 114.876 117.616 -2.740 17569 15943 1 25 . 1 1 103 103 MET HA H 257 4.211 4.211 4.081 0.130 17569 15944 1 25 . 1 1 103 103 MET CA C 257 55.691 55.691 58.232 -2.541 17569 15945 1 25 . 1 1 103 103 MET CB C 257 32.000 32.000 32.846 -0.846 17569 15946 1 25 . 1 1 103 103 MET H H 257 7.606 7.606 7.266 0.340 17569 15947 1 25 . 1 1 104 104 ASP N N 258 119.976 119.976 119.271 0.705 17569 15948 1 25 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.804 -0.266 17569 15949 1 25 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.958 0.954 17569 15950 1 25 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.253 1.247 17569 15951 1 25 . 1 1 104 104 ASP H H 258 7.444 7.444 7.669 -0.225 17569 15952 1 25 . 1 1 105 105 GLU N N 259 124.388 124.388 120.562 3.826 17569 15953 1 25 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.570 -0.283 17569 15954 1 25 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.386 2.185 17569 15955 1 25 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.902 -0.360 17569 15956 1 25 . 1 1 105 105 GLU H H 259 8.559 8.559 8.145 0.414 17569 15957 1 25 . 1 1 106 106 ASN N N 260 117.201 117.201 116.563 0.638 17569 15958 1 25 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.411 0.331 17569 15959 1 25 . 1 1 106 106 ASN CA C 260 53.743 53.743 53.959 -0.216 17569 15960 1 25 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.392 1.526 17569 15961 1 25 . 1 1 106 106 ASN H H 260 8.673 8.673 8.529 0.144 17569 15962 1 25 . 1 1 107 107 ASN N N 261 117.900 117.900 113.222 4.678 17569 15963 1 25 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.308 0.677 17569 15964 1 25 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.672 -2.370 17569 15965 1 25 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.945 2.669 17569 15966 1 25 . 1 1 107 107 ASN H H 261 7.956 7.956 8.686 -0.730 17569 15967 1 25 . 1 1 108 108 GLN N N 262 121.500 121.500 115.225 6.275 17569 15968 1 25 . 1 1 108 108 GLN HA H 262 4.608 4.608 3.993 0.615 17569 15969 1 25 . 1 1 108 108 GLN CA C 262 55.776 55.776 55.002 0.774 17569 15970 1 25 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.776 0.782 17569 15971 1 25 . 1 1 108 108 GLN H H 262 8.493 8.493 7.563 0.930 17569 15972 1 25 . 1 1 109 109 TRP N N 263 128.056 128.056 123.065 4.991 17569 15973 1 25 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.670 0.301 17569 15974 1 25 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.576 0.521 17569 15975 1 25 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.541 0.952 17569 15976 1 25 . 1 1 109 109 TRP H H 263 10.497 10.497 8.098 2.399 17569 15977 1 25 . 1 1 110 110 TYR N N 264 126.600 126.600 126.086 0.514 17569 15978 1 25 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.198 0.204 17569 15979 1 25 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.826 -3.155 17569 15980 1 25 . 1 1 110 110 TYR CB C 264 39.008 39.008 39.683 -0.675 17569 15981 1 25 . 1 1 110 110 TYR H H 264 7.545 7.545 8.053 -0.508 17569 15982 1 25 . 1 1 111 111 CYS N N 265 124.622 124.622 114.231 10.391 17569 15983 1 25 . 1 1 111 111 CYS H H 265 8.586 8.586 8.364 0.222 17569 15984 1 25 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.798 -0.606 17569 15985 1 25 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.710 1.005 17569 15986 1 25 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.642 1.278 17569 15987 1 25 . 1 1 113 113 ILE N N 267 119.504 119.504 119.593 -0.089 17569 15988 1 25 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.524 -0.574 17569 15989 1 25 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.973 0.276 17569 15990 1 25 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.549 -3.016 17569 15991 1 25 . 1 1 113 113 ILE H H 267 9.160 9.160 7.477 1.683 17569 15992 1 25 . 1 1 114 114 CYS N N 268 124.100 124.100 118.380 5.720 17569 15993 1 25 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.173 -0.359 17569 15994 1 25 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.685 3.615 17569 15995 1 25 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.096 2.625 17569 15996 1 25 . 1 1 114 114 CYS H H 268 7.818 7.818 8.241 -0.423 17569 15997 1 25 . 1 1 115 115 HIS N N 269 117.127 117.127 111.169 5.958 17569 15998 1 25 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.663 0.466 17569 15999 1 25 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.045 -0.884 17569 16000 1 25 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.797 2.395 17569 16001 1 25 . 1 1 115 115 HIS H H 269 8.953 8.953 7.804 1.149 17569 16002 1 25 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.438 0.504 17569 16003 1 25 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.483 -0.175 17569 16004 1 25 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.516 1.126 17569 16005 1 25 . 1 1 117 117 GLU N N 271 123.504 123.504 122.697 0.807 17569 16006 1 25 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.356 -0.336 17569 16007 1 25 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.120 3.749 17569 16008 1 25 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.818 -1.767 17569 16009 1 25 . 1 1 117 117 GLU H H 271 8.402 8.402 8.161 0.241 17569 16010 1 25 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.550 -0.008 17569 16011 1 25 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.742 1.617 17569 16012 1 25 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.415 0.727 17569 16013 1 25 . 1 1 119 119 LEU N N 273 112.296 112.296 114.377 -2.081 17569 16014 1 25 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.905 -0.431 17569 16015 1 25 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.350 0.192 17569 16016 1 25 . 1 1 119 119 LEU H H 273 8.090 8.090 7.456 0.634 17569 16017 1 25 . 1 1 120 120 LEU N N 274 121.388 121.388 122.870 -1.482 17569 16018 1 25 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.917 0.110 17569 16019 1 25 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.420 -0.119 17569 16020 1 25 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.836 0.264 17569 16021 1 25 . 1 1 120 120 LEU H H 274 7.823 7.823 7.917 -0.094 17569 16022 1 25 . 1 1 121 121 ASP N N 275 118.600 118.600 118.253 0.347 17569 16023 1 25 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.323 0.218 17569 16024 1 25 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.484 0.218 17569 16025 1 25 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.757 -1.314 17569 16026 1 25 . 1 1 121 121 ASP H H 275 8.694 8.694 8.408 0.286 17569 16027 1 25 . 1 1 122 122 LEU N N 276 123.192 123.192 120.057 3.135 17569 16028 1 25 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.994 0.398 17569 16029 1 25 . 1 1 122 122 LEU CA C 276 57.971 57.971 58.042 -0.071 17569 16030 1 25 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.071 0.471 17569 16031 1 25 . 1 1 122 122 LEU H H 276 8.013 8.013 7.373 0.640 17569 16032 1 25 . 1 1 123 123 VAL N N 277 126.898 126.898 118.487 8.411 17569 16033 1 25 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.589 0.266 17569 16034 1 25 . 1 1 123 123 VAL CA C 277 66.663 66.663 67.367 -0.704 17569 16035 1 25 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.525 0.533 17569 16036 1 25 . 1 1 123 123 VAL H H 277 8.781 8.781 7.826 0.955 17569 16037 1 25 . 1 1 124 124 THR N N 278 117.500 117.500 116.317 1.183 17569 16038 1 25 . 1 1 124 124 THR HA H 278 4.030 4.030 3.864 0.166 17569 16039 1 25 . 1 1 124 124 THR CA C 278 66.589 66.589 67.076 -0.487 17569 16040 1 25 . 1 1 124 124 THR CB C 278 68.410 68.410 68.495 -0.084 17569 16041 1 25 . 1 1 124 124 THR H H 278 8.722 8.722 8.090 0.632 17569 16042 1 25 . 1 1 125 125 ALA N N 279 124.700 124.700 124.006 0.694 17569 16043 1 25 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.087 0.174 17569 16044 1 25 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.001 0.295 17569 16045 1 25 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.997 -0.048 17569 16046 1 25 . 1 1 125 125 ALA H H 279 8.239 8.239 7.900 0.339 17569 16047 1 25 . 1 1 126 126 CYS N N 280 119.276 119.276 117.457 1.819 17569 16048 1 25 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.874 0.240 17569 16049 1 25 . 1 1 126 126 CYS CA C 280 62.103 62.103 64.040 -1.937 17569 16050 1 25 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.883 -1.387 17569 16051 1 25 . 1 1 126 126 CYS H H 280 8.128 8.128 7.787 0.341 17569 16052 1 25 . 1 1 127 127 ASN N N 281 118.000 118.000 117.937 0.063 17569 16053 1 25 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.547 0.013 17569 16054 1 25 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.453 -0.314 17569 16055 1 25 . 1 1 127 127 ASN CB C 281 36.965 36.965 37.894 -0.929 17569 16056 1 25 . 1 1 127 127 ASN H H 281 8.725 8.725 7.975 0.750 17569 16057 1 25 . 1 1 128 128 SER N N 282 116.601 116.601 116.512 0.089 17569 16058 1 25 . 1 1 128 128 SER HA H 282 4.363 4.363 4.165 0.198 17569 16059 1 25 . 1 1 128 128 SER CA C 282 61.899 61.899 61.429 0.470 17569 16060 1 25 . 1 1 128 128 SER CB C 282 62.630 62.630 62.914 -0.284 17569 16061 1 25 . 1 1 128 128 SER H H 282 8.542 8.542 7.641 0.901 17569 16062 1 25 . 1 1 129 129 VAL N N 283 123.272 123.272 121.747 1.525 17569 16063 1 25 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.624 0.053 17569 16064 1 25 . 1 1 129 129 VAL CA C 283 66.508 66.508 65.979 0.529 17569 16065 1 25 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.068 0.150 17569 16066 1 25 . 1 1 129 129 VAL H H 283 7.990 7.990 7.925 0.065 17569 16067 1 25 . 1 1 130 130 PHE N N 284 118.594 118.594 119.444 -0.850 17569 16068 1 25 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.241 -0.228 17569 16069 1 25 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.375 2.125 17569 16070 1 25 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.250 0.746 17569 16071 1 25 . 1 1 130 130 PHE H H 284 8.190 8.190 8.081 0.109 17569 16072 1 25 . 1 1 131 131 GLU N N 285 120.905 120.905 120.560 0.345 17569 16073 1 25 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.132 0.073 17569 16074 1 25 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.233 -0.020 17569 16075 1 25 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.333 0.167 17569 16076 1 25 . 1 1 131 131 GLU H H 285 8.699 8.699 8.780 -0.081 17569 16077 1 25 . 1 1 132 132 ASN N N 286 117.997 117.997 118.380 -0.383 17569 16078 1 25 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.712 -0.117 17569 16079 1 25 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.232 -0.617 17569 16080 1 25 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.606 0.246 17569 16081 1 25 . 1 1 132 132 ASN H H 286 8.082 8.082 7.872 0.210 17569 16082 1 25 . 1 1 133 133 LEU N N 287 120.800 120.800 122.608 -1.808 17569 16083 1 25 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.311 -0.194 17569 16084 1 25 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.471 -0.673 17569 16085 1 25 . 1 1 133 133 LEU H H 287 7.904 7.904 8.509 -0.605 17569 16086 1 25 . 1 1 134 134 GLU N N 288 118.200 118.200 119.290 -1.090 17569 16087 1 25 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.901 0.178 17569 16088 1 25 . 1 1 134 134 GLU CA C 288 58.997 58.997 59.925 -0.928 17569 16089 1 25 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.627 -0.385 17569 16090 1 25 . 1 1 134 134 GLU H H 288 8.157 8.157 8.744 -0.587 17569 16091 1 25 . 1 1 135 135 GLN N N 289 117.400 117.400 119.149 -1.749 17569 16092 1 25 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.086 0.088 17569 16093 1 25 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.660 -0.671 17569 16094 1 25 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.806 -0.726 17569 16095 1 25 . 1 1 135 135 GLN H H 289 7.869 7.869 7.550 0.319 17569 16096 1 25 . 1 1 136 136 LEU N N 290 121.000 121.000 120.390 0.610 17569 16097 1 25 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.837 0.336 17569 16098 1 25 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.747 -0.609 17569 16099 1 25 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.529 0.471 17569 16100 1 25 . 1 1 136 136 LEU H H 290 7.968 7.968 7.698 0.270 17569 16101 1 25 . 1 1 137 137 LEU N N 291 118.900 118.900 117.585 1.315 17569 16102 1 25 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.037 0.204 17569 16103 1 25 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.376 -1.016 17569 16104 1 25 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.247 -0.775 17569 16105 1 25 . 1 1 137 137 LEU H H 291 8.154 8.154 7.640 0.514 17569 16106 1 25 . 1 1 138 138 GLN N N 292 117.993 117.993 116.507 1.486 17569 16107 1 25 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.282 -0.010 17569 16108 1 25 . 1 1 138 138 GLN CA C 292 56.632 56.632 57.489 -0.857 17569 16109 1 25 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.612 -1.028 17569 16110 1 25 . 1 1 138 138 GLN H H 292 7.896 7.896 7.590 0.306 17569 16111 1 25 . 1 1 139 139 GLN N N 293 118.889 118.889 119.660 -0.771 17569 16112 1 25 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.392 -0.123 17569 16113 1 25 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.184 1.270 17569 16114 1 25 . 1 1 139 139 GLN CB C 293 29.069 29.069 28.598 0.471 17569 16115 1 25 . 1 1 139 139 GLN H H 293 8.091 8.091 8.362 -0.271 17569 16116 1 25 . 1 1 140 140 ASN N N 294 118.604 118.604 121.998 -3.394 17569 16117 1 25 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.793 -0.034 17569 16118 1 25 . 1 1 140 140 ASN CA C 294 53.221 53.221 52.615 0.606 17569 16119 1 25 . 1 1 140 140 ASN CB C 294 38.733 38.733 40.355 -1.621 17569 16120 1 25 . 1 1 140 140 ASN H H 294 8.273 8.273 8.387 -0.114 17569 16121 1 25 . 1 1 141 141 LYS N N 295 121.685 121.685 120.326 1.359 17569 16122 1 25 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.623 -0.263 17569 16123 1 25 . 1 1 141 141 LYS CA C 295 56.173 56.173 55.867 0.305 17569 16124 1 25 . 1 1 141 141 LYS CB C 295 32.535 32.535 34.221 -1.686 17569 16125 1 25 . 1 1 141 141 LYS H H 295 8.089 8.089 8.540 -0.451 17569 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 132 3.873 -0.251 3.880 17569 2 1 1 "Average Difference" HA 146 0.395 -0.009 0.396 17569 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17569 4 1 1 "Average Difference" CA 135 1.385 -0.135 1.384 17569 5 1 1 "Average Difference" CB 116 1.520 -0.392 1.475 17569 6 1 1 "Average Difference" HN 132 0.754 -0.279 0.704 17569 7 1 2 "Average Difference" N 132 4.002 -0.378 4.000 17569 8 1 2 "Average Difference" HA 146 0.402 -0.015 0.403 17569 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17569 10 1 2 "Average Difference" CA 135 1.413 -0.202 1.403 17569 11 1 2 "Average Difference" CB 116 1.602 -0.373 1.564 17569 12 1 2 "Average Difference" HN 132 0.802 -0.289 0.751 17569 13 1 3 "Average Difference" N 132 3.958 -0.361 3.957 17569 14 1 3 "Average Difference" HA 146 0.407 -0.026 0.408 17569 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17569 16 1 3 "Average Difference" CA 135 1.413 -0.193 1.405 17569 17 1 3 "Average Difference" CB 116 1.572 -0.350 1.539 17569 18 1 3 "Average Difference" HN 132 0.766 -0.289 0.712 17569 19 1 4 "Average Difference" N 132 3.931 -0.529 3.910 17569 20 1 4 "Average Difference" HA 146 0.407 -0.018 0.408 17569 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17569 22 1 4 "Average Difference" CA 135 1.357 -0.141 1.355 17569 23 1 4 "Average Difference" CB 116 1.559 -0.389 1.516 17569 24 1 4 "Average Difference" HN 132 0.795 -0.305 0.737 17569 25 1 5 "Average Difference" N 132 3.866 -0.304 3.869 17569 26 1 5 "Average Difference" HA 146 0.396 -0.015 0.397 17569 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17569 28 1 5 "Average Difference" CA 135 1.384 -0.185 1.377 17569 29 1 5 "Average Difference" CB 116 1.595 -0.342 1.565 17569 30 1 5 "Average Difference" HN 132 0.792 -0.303 0.735 17569 31 1 6 "Average Difference" N 132 3.971 -0.443 3.961 17569 32 1 6 "Average Difference" HA 146 0.400 -0.023 0.400 17569 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17569 34 1 6 "Average Difference" CA 135 1.436 -0.227 1.423 17569 35 1 6 "Average Difference" CB 116 1.562 -0.386 1.520 17569 36 1 6 "Average Difference" HN 132 0.766 -0.279 0.716 17569 37 1 7 "Average Difference" N 132 3.793 -0.438 3.782 17569 38 1 7 "Average Difference" HA 146 0.405 -0.019 0.406 17569 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17569 40 1 7 "Average Difference" CA 135 1.407 -0.212 1.396 17569 41 1 7 "Average Difference" CB 116 1.628 -0.374 1.592 17569 42 1 7 "Average Difference" HN 132 0.783 -0.285 0.732 17569 43 1 8 "Average Difference" N 132 3.844 -0.401 3.838 17569 44 1 8 "Average Difference" HA 146 0.391 -0.046 0.390 17569 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17569 46 1 8 "Average Difference" CA 135 1.456 -0.137 1.455 17569 47 1 8 "Average Difference" CB 116 1.587 -0.427 1.535 17569 48 1 8 "Average Difference" HN 132 0.758 -0.302 0.698 17569 49 1 9 "Average Difference" N 132 3.886 -0.350 3.885 17569 50 1 9 "Average Difference" HA 146 0.407 -0.029 0.407 17569 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17569 52 1 9 "Average Difference" CA 135 1.406 -0.141 1.404 17569 53 1 9 "Average Difference" CB 116 1.653 -0.359 1.621 17569 54 1 9 "Average Difference" HN 132 0.789 -0.290 0.736 17569 55 1 10 "Average Difference" N 132 3.994 -0.401 3.989 17569 56 1 10 "Average Difference" HA 146 0.404 -0.041 0.403 17569 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17569 58 1 10 "Average Difference" CA 135 1.391 -0.178 1.385 17569 59 1 10 "Average Difference" CB 116 1.461 -0.393 1.413 17569 60 1 10 "Average Difference" HN 132 0.763 -0.279 0.713 17569 61 1 11 "Average Difference" N 132 4.012 -0.378 4.009 17569 62 1 11 "Average Difference" HA 146 0.411 -0.033 0.411 17569 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17569 64 1 11 "Average Difference" CA 135 1.446 -0.148 1.444 17569 65 1 11 "Average Difference" CB 116 1.556 -0.403 1.510 17569 66 1 11 "Average Difference" HN 132 0.779 -0.287 0.727 17569 67 1 12 "Average Difference" N 132 3.921 -0.329 3.922 17569 68 1 12 "Average Difference" HA 146 0.417 -0.028 0.418 17569 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17569 70 1 12 "Average Difference" CA 135 1.405 -0.164 1.401 17569 71 1 12 "Average Difference" CB 116 1.630 -0.424 1.580 17569 72 1 12 "Average Difference" HN 132 0.786 -0.268 0.742 17569 73 1 13 "Average Difference" N 132 3.941 -0.341 3.941 17569 74 1 13 "Average Difference" HA 146 0.405 -0.021 0.405 17569 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17569 76 1 13 "Average Difference" CA 135 1.406 -0.123 1.406 17569 77 1 13 "Average Difference" CB 116 1.572 -0.428 1.519 17569 78 1 13 "Average Difference" HN 132 0.782 -0.293 0.728 17569 79 1 14 "Average Difference" N 132 3.911 -0.456 3.899 17569 80 1 14 "Average Difference" HA 146 0.405 -0.030 0.406 17569 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17569 82 1 14 "Average Difference" CA 135 1.411 -0.154 1.407 17569 83 1 14 "Average Difference" CB 116 1.616 -0.389 1.575 17569 84 1 14 "Average Difference" HN 132 0.801 -0.310 0.741 17569 85 1 15 "Average Difference" N 132 4.016 -0.433 4.007 17569 86 1 15 "Average Difference" HA 146 0.409 -0.026 0.410 17569 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17569 88 1 15 "Average Difference" CA 135 1.419 -0.175 1.413 17569 89 1 15 "Average Difference" CB 116 1.553 -0.376 1.514 17569 90 1 15 "Average Difference" HN 132 0.777 -0.284 0.726 17569 91 1 16 "Average Difference" N 132 3.961 -0.475 3.948 17569 92 1 16 "Average Difference" HA 146 0.417 -0.029 0.418 17569 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17569 94 1 16 "Average Difference" CA 135 1.395 -0.182 1.388 17569 95 1 16 "Average Difference" CB 116 1.596 -0.422 1.546 17569 96 1 16 "Average Difference" HN 132 0.798 -0.309 0.739 17569 97 1 17 "Average Difference" N 132 3.844 -0.283 3.848 17569 98 1 17 "Average Difference" HA 146 0.416 -0.034 0.416 17569 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17569 100 1 17 "Average Difference" CA 135 1.445 -0.158 1.442 17569 101 1 17 "Average Difference" CB 116 1.617 -0.425 1.567 17569 102 1 17 "Average Difference" HN 132 0.800 -0.272 0.755 17569 103 1 18 "Average Difference" N 132 4.063 -0.326 4.065 17569 104 1 18 "Average Difference" HA 146 0.409 -0.003 0.410 17569 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17569 106 1 18 "Average Difference" CA 135 1.448 -0.229 1.435 17569 107 1 18 "Average Difference" CB 116 1.590 -0.279 1.573 17569 108 1 18 "Average Difference" HN 132 0.778 -0.279 0.730 17569 109 1 19 "Average Difference" N 132 3.936 -0.487 3.920 17569 110 1 19 "Average Difference" HA 146 0.413 -0.035 0.413 17569 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17569 112 1 19 "Average Difference" CA 135 1.495 -0.095 1.498 17569 113 1 19 "Average Difference" CB 116 1.622 -0.462 1.561 17569 114 1 19 "Average Difference" HN 132 0.793 -0.304 0.735 17569 115 1 20 "Average Difference" N 132 3.814 -0.251 3.820 17569 116 1 20 "Average Difference" HA 146 0.402 -0.018 0.403 17569 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17569 118 1 20 "Average Difference" CA 135 1.430 -0.162 1.426 17569 119 1 20 "Average Difference" CB 116 1.641 -0.367 1.606 17569 120 1 20 "Average Difference" HN 132 0.779 -0.282 0.729 17569 121 1 21 "Average Difference" N 132 3.875 -0.153 3.886 17569 122 1 21 "Average Difference" HA 146 0.395 -0.036 0.395 17569 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 17569 124 1 21 "Average Difference" CA 135 1.383 -0.139 1.381 17569 125 1 21 "Average Difference" CB 116 1.566 -0.403 1.520 17569 126 1 21 "Average Difference" HN 132 0.787 -0.291 0.734 17569 127 1 22 "Average Difference" N 132 3.908 -0.352 3.907 17569 128 1 22 "Average Difference" HA 146 0.407 -0.014 0.408 17569 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 17569 130 1 22 "Average Difference" CA 135 1.468 -0.171 1.463 17569 131 1 22 "Average Difference" CB 116 1.638 -0.435 1.586 17569 132 1 22 "Average Difference" HN 132 0.795 -0.303 0.737 17569 133 1 23 "Average Difference" N 132 3.875 -0.391 3.870 17569 134 1 23 "Average Difference" HA 146 0.400 -0.031 0.400 17569 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 17569 136 1 23 "Average Difference" CA 135 1.400 -0.158 1.396 17569 137 1 23 "Average Difference" CB 116 1.628 -0.468 1.566 17569 138 1 23 "Average Difference" HN 132 0.782 -0.303 0.724 17569 139 1 24 "Average Difference" N 132 3.968 -0.416 3.961 17569 140 1 24 "Average Difference" HA 146 0.411 -0.006 0.413 17569 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 17569 142 1 24 "Average Difference" CA 135 1.391 -0.128 1.391 17569 143 1 24 "Average Difference" CB 116 1.590 -0.329 1.563 17569 144 1 24 "Average Difference" HN 132 0.790 -0.293 0.737 17569 145 1 25 "Average Difference" N 132 3.941 -0.509 3.923 17569 146 1 25 "Average Difference" HA 146 0.391 -0.028 0.392 17569 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 17569 148 1 25 "Average Difference" CA 135 1.490 -0.112 1.491 17569 149 1 25 "Average Difference" CB 116 1.580 -0.404 1.534 17569 150 1 25 "Average Difference" HN 132 0.800 -0.332 0.731 17569 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 17569 _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 ALA HA H 156 4.387 4.387 4.807 -0.420 17569 2 1 . 1 1 2 2 ALA CA C 156 52.445 52.445 52.152 0.293 17569 3 1 . 1 1 2 2 ALA CB C 156 19.256 19.256 19.653 -0.397 17569 4 1 . 1 1 3 3 MET HA H 157 4.476 4.476 4.681 -0.205 17569 5 1 . 1 1 3 3 MET CA C 157 55.401 55.401 55.399 0.002 17569 6 1 . 1 1 4 4 ALA N N 158 124.828 124.828 124.155 0.673 17569 7 1 . 1 1 4 4 ALA HA H 158 4.314 4.314 4.620 -0.306 17569 8 1 . 1 1 4 4 ALA CA C 158 52.511 52.511 51.886 0.625 17569 9 1 . 1 1 4 4 ALA CB C 158 19.001 19.001 20.194 -1.193 17569 10 1 . 1 1 4 4 ALA H H 158 8.382 8.382 8.226 0.156 17569 11 1 . 1 1 5 5 ASP N N 159 119.418 119.418 121.129 -1.711 17569 12 1 . 1 1 5 5 ASP HA H 159 4.590 4.590 4.801 -0.211 17569 13 1 . 1 1 5 5 ASP CA C 159 54.136 54.136 54.125 0.011 17569 14 1 . 1 1 5 5 ASP CB C 159 41.015 41.015 41.759 -0.744 17569 15 1 . 1 1 5 5 ASP H H 159 8.312 8.312 8.422 -0.110 17569 16 1 . 1 1 6 6 LYS N N 160 121.604 121.604 120.629 0.975 17569 17 1 . 1 1 6 6 LYS HA H 160 4.343 4.343 4.583 -0.240 17569 18 1 . 1 1 6 6 LYS H H 160 8.274 8.274 8.234 0.040 17569 19 1 . 1 1 7 7 ARG N N 161 121.611 121.611 121.056 0.555 17569 20 1 . 1 1 7 7 ARG HA H 161 4.327 4.327 4.464 -0.137 17569 21 1 . 1 1 7 7 ARG H H 161 8.430 8.430 8.714 -0.284 17569 22 1 . 1 1 8 8 GLY N N 162 109.606 109.606 110.457 -0.851 17569 23 1 . 1 1 8 8 GLY CA C 162 45.047 45.047 44.912 0.135 17569 24 1 . 1 1 8 8 GLY H H 162 8.473 8.473 8.346 0.127 17569 25 1 . 1 1 9 9 ASP N N 163 120.187 120.187 120.031 0.156 17569 26 1 . 1 1 9 9 ASP HA H 163 4.649 4.649 4.787 -0.138 17569 27 1 . 1 1 9 9 ASP CA C 163 54.151 54.151 53.646 0.505 17569 28 1 . 1 1 9 9 ASP H H 163 8.296 8.296 8.000 0.296 17569 29 1 . 1 1 10 10 GLY N N 164 108.816 108.816 109.488 -0.672 17569 30 1 . 1 1 10 10 GLY CA C 164 45.367 45.367 45.175 0.192 17569 31 1 . 1 1 10 10 GLY H H 164 8.458 8.458 8.425 0.033 17569 32 1 . 1 1 11 11 LEU N N 165 121.195 121.195 121.416 -0.221 17569 33 1 . 1 1 11 11 LEU HA H 165 4.316 4.316 4.643 -0.327 17569 34 1 . 1 1 11 11 LEU CA C 165 55.000 55.000 54.680 0.320 17569 35 1 . 1 1 11 11 LEU CB C 165 41.932 41.932 43.359 -1.427 17569 36 1 . 1 1 11 11 LEU H H 165 8.137 8.137 7.934 0.203 17569 37 1 . 1 1 12 12 HIS N N 166 119.387 119.387 121.484 -2.097 17569 38 1 . 1 1 12 12 HIS HA H 166 4.655 4.655 4.740 -0.085 17569 39 1 . 1 1 12 12 HIS CA C 166 56.269 56.269 55.735 0.534 17569 40 1 . 1 1 12 12 HIS CB C 166 30.697 30.697 30.732 -0.035 17569 41 1 . 1 1 12 12 HIS H H 166 8.270 8.270 8.493 -0.223 17569 42 1 . 1 1 13 13 GLY N N 167 109.899 109.899 111.656 -1.757 17569 43 1 . 1 1 13 13 GLY CA C 167 45.105 45.105 44.741 0.364 17569 44 1 . 1 1 13 13 GLY H H 167 8.276 8.276 8.346 -0.070 17569 45 1 . 1 1 14 14 ILE N N 168 119.597 119.597 121.874 -2.277 17569 46 1 . 1 1 14 14 ILE HA H 168 4.323 4.323 4.263 0.060 17569 47 1 . 1 1 14 14 ILE CA C 168 60.600 60.600 60.143 0.457 17569 48 1 . 1 1 14 14 ILE CB C 168 38.950 38.950 40.882 -1.932 17569 49 1 . 1 1 14 14 ILE H H 168 7.962 7.962 8.053 -0.091 17569 50 1 . 1 1 15 15 VAL N N 169 127.578 127.578 126.561 1.017 17569 51 1 . 1 1 15 15 VAL HA H 169 4.280 4.280 4.043 0.237 17569 52 1 . 1 1 15 15 VAL CA C 169 61.317 61.317 62.438 -1.121 17569 53 1 . 1 1 15 15 VAL CB C 169 33.402 33.402 30.941 2.461 17569 54 1 . 1 1 15 15 VAL H H 169 9.011 9.011 8.446 0.565 17569 55 1 . 1 1 16 16 SER N N 170 118.596 118.596 120.411 -1.815 17569 56 1 . 1 1 16 16 SER HA H 170 5.140 5.140 4.752 0.388 17569 57 1 . 1 1 16 16 SER CA C 170 55.985 55.985 56.402 -0.417 17569 58 1 . 1 1 16 16 SER CB C 170 65.261 65.261 65.640 -0.379 17569 59 1 . 1 1 16 16 SER H H 170 8.242 8.242 7.816 0.426 17569 60 1 . 1 1 17 17 CYS N N 171 123.783 123.783 123.260 0.523 17569 61 1 . 1 1 17 17 CYS HA H 171 4.181 4.181 4.180 0.001 17569 62 1 . 1 1 17 17 CYS CA C 171 59.844 59.844 60.532 -0.688 17569 63 1 . 1 1 17 17 CYS CB C 171 31.373 31.373 28.735 2.638 17569 64 1 . 1 1 17 17 CYS H H 171 8.894 8.894 8.493 0.401 17569 65 1 . 1 1 18 18 THR N N 172 121.703 121.703 117.853 3.850 17569 66 1 . 1 1 18 18 THR HA H 172 4.386 4.386 4.099 0.287 17569 67 1 . 1 1 18 18 THR CA C 172 64.667 64.667 64.325 0.342 17569 68 1 . 1 1 18 18 THR CB C 172 69.498 69.498 68.709 0.789 17569 69 1 . 1 1 18 18 THR H H 172 8.788 8.788 8.267 0.521 17569 70 1 . 1 1 19 19 ALA N N 173 131.364 131.364 121.593 9.771 17569 71 1 . 1 1 19 19 ALA HA H 173 4.496 4.496 4.124 0.372 17569 72 1 . 1 1 19 19 ALA CA C 173 54.025 54.025 53.530 0.495 17569 73 1 . 1 1 19 19 ALA CB C 173 22.182 22.182 18.724 3.458 17569 74 1 . 1 1 19 19 ALA H H 173 9.680 9.680 7.969 1.711 17569 75 1 . 1 1 20 20 CYS N N 174 115.498 115.498 114.690 0.808 17569 76 1 . 1 1 20 20 CYS HA H 174 4.968 4.968 4.540 0.429 17569 77 1 . 1 1 20 20 CYS CA C 174 58.094 58.094 59.347 -1.253 17569 78 1 . 1 1 20 20 CYS CB C 174 33.244 33.244 28.990 4.254 17569 79 1 . 1 1 20 20 CYS H H 174 8.470 8.470 7.681 0.789 17569 80 1 . 1 1 21 21 GLY N N 175 112.464 112.464 108.823 3.641 17569 81 1 . 1 1 21 21 GLY CA C 175 45.706 45.706 45.069 0.637 17569 82 1 . 1 1 21 21 GLY H H 175 7.884 7.884 7.955 -0.071 17569 83 1 . 1 1 22 22 GLN N N 176 121.784 121.784 118.076 3.708 17569 84 1 . 1 1 22 22 GLN HA H 176 4.376 4.376 4.468 -0.092 17569 85 1 . 1 1 22 22 GLN CA C 176 56.291 56.291 54.475 1.817 17569 86 1 . 1 1 22 22 GLN CB C 176 29.341 29.341 31.932 -2.591 17569 87 1 . 1 1 22 22 GLN H H 176 8.723 8.723 7.894 0.829 17569 88 1 . 1 1 23 23 GLN N N 177 122.900 122.900 122.866 0.034 17569 89 1 . 1 1 23 23 GLN HA H 177 4.530 4.530 4.221 0.309 17569 90 1 . 1 1 23 23 GLN CA C 177 56.550 56.550 56.831 -0.281 17569 91 1 . 1 1 23 23 GLN CB C 177 28.460 28.460 29.193 -0.733 17569 92 1 . 1 1 23 23 GLN H H 177 8.721 8.721 8.561 0.160 17569 93 1 . 1 1 24 24 VAL N N 178 121.000 121.000 124.492 -3.492 17569 94 1 . 1 1 24 24 VAL HA H 178 4.524 4.524 3.996 0.528 17569 95 1 . 1 1 24 24 VAL CA C 178 59.877 59.877 61.754 -1.877 17569 96 1 . 1 1 24 24 VAL H H 178 8.689 8.689 7.999 0.690 17569 97 1 . 1 1 25 25 ASN N N 179 121.392 121.392 123.313 -1.921 17569 98 1 . 1 1 25 25 ASN HA H 179 4.876 4.876 4.323 0.553 17569 99 1 . 1 1 25 25 ASN CA C 179 52.149 52.149 54.356 -2.207 17569 100 1 . 1 1 25 25 ASN CB C 179 37.977 37.977 38.334 -0.357 17569 101 1 . 1 1 25 25 ASN H H 179 8.635 8.635 8.211 0.424 17569 102 1 . 1 1 27 27 PHE HA H 181 4.460 4.460 4.498 -0.038 17569 103 1 . 1 1 27 27 PHE CA C 181 56.998 56.998 57.579 -0.581 17569 104 1 . 1 1 27 27 PHE CB C 181 38.393 38.393 39.136 -0.743 17569 105 1 . 1 1 28 28 GLN N N 182 119.300 119.300 122.457 -3.157 17569 106 1 . 1 1 28 28 GLN HA H 182 4.518 4.518 4.438 0.080 17569 107 1 . 1 1 28 28 GLN CA C 182 54.342 54.342 55.940 -1.598 17569 108 1 . 1 1 28 28 GLN CB C 182 30.350 30.350 30.519 -0.169 17569 109 1 . 1 1 28 28 GLN H H 182 7.494 7.494 8.037 -0.543 17569 110 1 . 1 1 29 29 LYS N N 183 124.516 124.516 125.668 -1.152 17569 111 1 . 1 1 29 29 LYS HA H 183 3.922 3.922 4.475 -0.553 17569 112 1 . 1 1 29 29 LYS CA C 183 58.312 58.312 56.499 1.813 17569 113 1 . 1 1 29 29 LYS CB C 183 32.286 32.286 32.624 -0.338 17569 114 1 . 1 1 29 29 LYS H H 183 8.779 8.779 8.578 0.201 17569 115 1 . 1 1 30 30 ASP N N 184 116.500 116.500 119.141 -2.641 17569 116 1 . 1 1 30 30 ASP HA H 184 4.459 4.459 4.706 -0.247 17569 117 1 . 1 1 30 30 ASP CA C 184 54.536 54.536 54.802 -0.266 17569 118 1 . 1 1 30 30 ASP CB C 184 39.971 39.971 40.950 -0.979 17569 119 1 . 1 1 30 30 ASP H H 184 8.556 8.556 8.333 0.223 17569 120 1 . 1 1 31 31 SER N N 185 111.505 111.505 113.702 -2.197 17569 121 1 . 1 1 31 31 SER HA H 185 4.695 4.695 4.713 -0.018 17569 122 1 . 1 1 31 31 SER CA C 185 59.747 59.747 58.156 1.591 17569 123 1 . 1 1 31 31 SER CB C 185 65.198 65.198 63.735 1.463 17569 124 1 . 1 1 31 31 SER H H 185 7.933 7.933 8.392 -0.459 17569 125 1 . 1 1 32 32 ILE N N 186 113.394 113.394 116.236 -2.842 17569 126 1 . 1 1 32 32 ILE HA H 186 4.886 4.886 4.942 -0.056 17569 127 1 . 1 1 32 32 ILE CA C 186 59.579 59.579 60.280 -0.701 17569 128 1 . 1 1 32 32 ILE CB C 186 41.812 41.812 40.763 1.049 17569 129 1 . 1 1 32 32 ILE H H 186 7.105 7.105 7.485 -0.380 17569 130 1 . 1 1 33 33 TYR N N 187 119.098 119.098 120.974 -1.876 17569 131 1 . 1 1 33 33 TYR HA H 187 4.523 4.523 5.087 -0.564 17569 132 1 . 1 1 33 33 TYR CA C 187 57.260 57.260 56.200 1.060 17569 133 1 . 1 1 33 33 TYR CB C 187 43.440 43.440 41.372 2.068 17569 134 1 . 1 1 33 33 TYR H H 187 8.954 8.954 7.882 1.072 17569 135 1 . 1 1 34 34 ARG N N 188 118.502 118.502 123.189 -4.687 17569 136 1 . 1 1 34 34 ARG HA H 188 4.637 4.637 4.839 -0.202 17569 137 1 . 1 1 34 34 ARG CA C 188 54.752 54.752 56.152 -1.400 17569 138 1 . 1 1 34 34 ARG CB C 188 31.251 31.251 30.267 0.984 17569 139 1 . 1 1 34 34 ARG H H 188 8.412 8.412 8.634 -0.222 17569 140 1 . 1 1 35 35 HIS N N 189 126.596 126.596 127.986 -1.390 17569 141 1 . 1 1 35 35 HIS HA H 189 4.592 4.592 4.911 -0.319 17569 142 1 . 1 1 35 35 HIS CA C 189 55.721 55.721 56.020 -0.299 17569 143 1 . 1 1 35 35 HIS CB C 189 32.472 32.472 31.075 1.397 17569 144 1 . 1 1 35 35 HIS H H 189 9.813 9.813 9.095 0.718 17569 145 1 . 1 1 36 36 PRO HA H 190 4.298 4.298 4.572 -0.274 17569 146 1 . 1 1 36 36 PRO CA C 190 65.276 65.276 64.882 0.394 17569 147 1 . 1 1 36 36 PRO CB C 190 32.851 32.851 32.204 0.647 17569 148 1 . 1 1 37 37 SER N N 191 110.003 110.003 113.762 -3.759 17569 149 1 . 1 1 37 37 SER HA H 191 4.918 4.918 4.304 0.614 17569 150 1 . 1 1 37 37 SER CA C 191 59.031 59.031 61.084 -2.053 17569 151 1 . 1 1 37 37 SER CB C 191 65.104 65.104 63.305 1.799 17569 152 1 . 1 1 37 37 SER H H 191 8.934 8.934 8.528 0.406 17569 153 1 . 1 1 38 38 LEU N N 192 120.959 120.959 114.025 6.934 17569 154 1 . 1 1 38 38 LEU HA H 192 4.129 4.129 4.937 -0.808 17569 155 1 . 1 1 38 38 LEU CA C 192 55.146 55.146 53.229 1.917 17569 156 1 . 1 1 38 38 LEU CB C 192 43.996 43.996 42.419 1.577 17569 157 1 . 1 1 38 38 LEU H H 192 8.649 8.649 7.018 1.631 17569 158 1 . 1 1 39 39 GLN N N 193 108.600 108.600 119.119 -10.519 17569 159 1 . 1 1 39 39 GLN HA H 193 3.905 3.905 4.090 -0.185 17569 160 1 . 1 1 39 39 GLN CA C 193 56.814 56.814 56.639 0.175 17569 161 1 . 1 1 39 39 GLN CB C 193 25.034 25.034 26.884 -1.850 17569 162 1 . 1 1 39 39 GLN H H 193 8.465 8.465 7.846 0.619 17569 163 1 . 1 1 40 40 VAL N N 194 105.325 105.325 118.217 -12.892 17569 164 1 . 1 1 40 40 VAL HA H 194 4.550 4.550 4.499 0.051 17569 165 1 . 1 1 40 40 VAL CA C 194 58.641 58.641 59.837 -1.196 17569 166 1 . 1 1 40 40 VAL H H 194 6.256 6.256 7.856 -1.600 17569 167 1 . 1 1 41 41 LEU N N 195 123.100 123.100 122.186 0.914 17569 168 1 . 1 1 41 41 LEU HA H 195 4.816 4.816 4.819 -0.003 17569 169 1 . 1 1 41 41 LEU CA C 195 58.182 58.182 54.562 3.620 17569 170 1 . 1 1 41 41 LEU CB C 195 43.570 43.570 43.189 0.381 17569 171 1 . 1 1 41 41 LEU H H 195 9.154 9.154 8.530 0.624 17569 172 1 . 1 1 42 42 ILE N N 196 124.396 124.396 117.205 7.191 17569 173 1 . 1 1 42 42 ILE HA H 196 6.352 6.352 4.874 1.478 17569 174 1 . 1 1 42 42 ILE CA C 196 59.230 59.230 58.328 0.902 17569 175 1 . 1 1 42 42 ILE CB C 196 43.270 43.270 41.881 1.389 17569 176 1 . 1 1 42 42 ILE H H 196 9.766 9.766 8.030 1.736 17569 177 1 . 1 1 43 43 CYS N N 197 121.500 121.500 115.050 6.450 17569 178 1 . 1 1 43 43 CYS HA H 197 5.262 5.262 5.202 0.060 17569 179 1 . 1 1 43 43 CYS CA C 197 56.703 56.703 56.123 0.580 17569 180 1 . 1 1 43 43 CYS CB C 197 33.300 33.300 31.125 2.175 17569 181 1 . 1 1 43 43 CYS H H 197 9.882 9.882 8.344 1.538 17569 182 1 . 1 1 44 44 LYS N N 198 117.995 117.995 122.290 -4.295 17569 183 1 . 1 1 44 44 LYS HA H 198 3.989 3.989 4.076 -0.087 17569 184 1 . 1 1 44 44 LYS CA C 198 59.660 59.660 60.207 -0.547 17569 185 1 . 1 1 44 44 LYS CB C 198 32.700 32.700 32.410 0.291 17569 186 1 . 1 1 44 44 LYS H H 198 8.089 8.089 8.676 -0.587 17569 187 1 . 1 1 45 45 ASN N N 199 119.200 119.200 117.306 1.894 17569 188 1 . 1 1 45 45 ASN HA H 199 4.514 4.514 4.569 -0.055 17569 189 1 . 1 1 45 45 ASN CA C 199 56.720 56.720 56.105 0.615 17569 190 1 . 1 1 45 45 ASN CB C 199 38.167 38.167 38.141 0.026 17569 191 1 . 1 1 45 45 ASN H H 199 8.356 8.356 8.556 -0.200 17569 192 1 . 1 1 46 46 CYS N N 200 126.600 126.600 118.708 7.892 17569 193 1 . 1 1 46 46 CYS HA H 200 4.181 4.181 3.989 0.192 17569 194 1 . 1 1 46 46 CYS CA C 200 65.495 65.495 63.203 2.292 17569 195 1 . 1 1 46 46 CYS CB C 200 28.182 28.182 26.155 2.027 17569 196 1 . 1 1 46 46 CYS H H 200 9.189 9.189 7.827 1.362 17569 197 1 . 1 1 47 47 PHE N N 201 121.962 121.962 120.350 1.612 17569 198 1 . 1 1 47 47 PHE HA H 201 3.870 3.870 4.095 -0.225 17569 199 1 . 1 1 47 47 PHE CA C 201 62.269 62.269 60.656 1.613 17569 200 1 . 1 1 47 47 PHE CB C 201 39.167 39.167 38.461 0.706 17569 201 1 . 1 1 47 47 PHE H H 201 8.826 8.826 7.926 0.900 17569 202 1 . 1 1 48 48 LYS N N 202 117.400 117.400 120.165 -2.765 17569 203 1 . 1 1 48 48 LYS HA H 202 3.698 3.698 3.902 -0.204 17569 204 1 . 1 1 48 48 LYS CA C 202 58.952 58.952 59.882 -0.930 17569 205 1 . 1 1 48 48 LYS CB C 202 31.542 31.542 32.247 -0.705 17569 206 1 . 1 1 48 48 LYS H H 202 8.512 8.512 8.091 0.421 17569 207 1 . 1 1 49 49 TYR N N 203 120.400 120.400 120.622 -0.222 17569 208 1 . 1 1 49 49 TYR HA H 203 4.414 4.414 4.198 0.216 17569 209 1 . 1 1 49 49 TYR CA C 203 60.772 60.772 61.666 -0.893 17569 210 1 . 1 1 49 49 TYR CB C 203 38.446 38.446 38.640 -0.194 17569 211 1 . 1 1 49 49 TYR H H 203 8.133 8.133 7.742 0.391 17569 212 1 . 1 1 50 50 TYR N N 204 121.783 121.783 117.909 3.874 17569 213 1 . 1 1 50 50 TYR HA H 204 3.495 3.495 4.647 -1.152 17569 214 1 . 1 1 50 50 TYR CA C 204 61.950 61.950 58.948 3.002 17569 215 1 . 1 1 50 50 TYR CB C 204 38.492 38.492 37.589 0.903 17569 216 1 . 1 1 50 50 TYR H H 204 8.765 8.765 7.562 1.203 17569 217 1 . 1 1 51 51 MET N N 205 110.800 110.800 115.648 -4.848 17569 218 1 . 1 1 51 51 MET HA H 205 4.349 4.349 4.185 0.164 17569 219 1 . 1 1 51 51 MET CA C 205 53.505 53.505 57.644 -4.139 17569 220 1 . 1 1 51 51 MET CB C 205 30.384 30.384 33.031 -2.647 17569 221 1 . 1 1 51 51 MET H H 205 7.771 7.771 8.341 -0.570 17569 222 1 . 1 1 52 52 SER N N 206 116.800 116.800 113.064 3.736 17569 223 1 . 1 1 52 52 SER HA H 206 3.919 3.919 4.379 -0.460 17569 224 1 . 1 1 52 52 SER CA C 206 61.621 61.621 59.847 1.774 17569 225 1 . 1 1 52 52 SER CB C 206 62.611 62.611 64.338 -1.727 17569 226 1 . 1 1 52 52 SER H H 206 7.581 7.581 8.245 -0.664 17569 227 1 . 1 1 53 53 ASP N N 207 117.400 117.400 121.543 -4.143 17569 228 1 . 1 1 53 53 ASP HA H 207 4.572 4.572 4.773 -0.201 17569 229 1 . 1 1 53 53 ASP CA C 207 53.099 53.099 53.572 -0.473 17569 230 1 . 1 1 53 53 ASP CB C 207 43.188 43.188 43.021 0.167 17569 231 1 . 1 1 53 53 ASP H H 207 7.085 7.085 8.050 -0.965 17569 232 1 . 1 1 54 54 ASP N N 208 119.405 119.405 122.665 -3.260 17569 233 1 . 1 1 54 54 ASP HA H 208 4.389 4.389 4.955 -0.566 17569 234 1 . 1 1 54 54 ASP CA C 208 53.900 53.900 53.367 0.533 17569 235 1 . 1 1 54 54 ASP CB C 208 41.349 41.349 42.948 -1.599 17569 236 1 . 1 1 54 54 ASP H H 208 8.439 8.439 8.422 0.017 17569 237 1 . 1 1 55 55 ILE N N 209 124.698 124.698 121.083 3.615 17569 238 1 . 1 1 55 55 ILE HA H 209 4.000 4.000 4.333 -0.333 17569 239 1 . 1 1 55 55 ILE CA C 209 62.278 62.278 60.338 1.940 17569 240 1 . 1 1 55 55 ILE CB C 209 39.291 39.291 38.087 1.204 17569 241 1 . 1 1 55 55 ILE H H 209 8.128 8.128 8.428 -0.300 17569 242 1 . 1 1 56 56 SER N N 210 126.703 126.703 120.745 5.958 17569 243 1 . 1 1 56 56 SER HA H 210 4.365 4.365 4.650 -0.285 17569 244 1 . 1 1 56 56 SER CA C 210 57.769 57.769 57.806 -0.037 17569 245 1 . 1 1 56 56 SER CB C 210 64.991 64.991 64.520 0.471 17569 246 1 . 1 1 56 56 SER H H 210 8.815 8.815 8.578 0.237 17569 247 1 . 1 1 57 57 ARG N N 211 116.885 116.885 119.684 -2.799 17569 248 1 . 1 1 57 57 ARG HA H 211 5.042 5.042 4.602 0.440 17569 249 1 . 1 1 57 57 ARG CA C 211 54.400 54.400 55.787 -1.387 17569 250 1 . 1 1 57 57 ARG CB C 211 34.284 34.284 31.281 3.003 17569 251 1 . 1 1 57 57 ARG H H 211 8.365 8.365 8.319 0.046 17569 252 1 . 1 1 58 58 ASP N N 212 121.982 121.982 121.897 0.085 17569 253 1 . 1 1 58 58 ASP HA H 212 4.615 4.615 4.653 -0.038 17569 254 1 . 1 1 58 58 ASP CA C 212 52.222 52.222 54.483 -2.261 17569 255 1 . 1 1 58 58 ASP CB C 212 41.502 41.502 42.509 -1.007 17569 256 1 . 1 1 58 58 ASP H H 212 8.706 8.706 8.502 0.204 17569 257 1 . 1 1 59 59 SER N N 213 114.164 114.164 115.459 -1.295 17569 258 1 . 1 1 59 59 SER HA H 213 4.212 4.212 4.161 0.051 17569 259 1 . 1 1 59 59 SER CA C 213 60.840 60.840 60.833 0.007 17569 260 1 . 1 1 59 59 SER CB C 213 62.714 62.714 63.066 -0.352 17569 261 1 . 1 1 59 59 SER H H 213 8.687 8.687 8.572 0.115 17569 262 1 . 1 1 60 60 ASP N N 214 120.899 120.899 120.447 0.452 17569 263 1 . 1 1 60 60 ASP HA H 214 4.825 4.825 4.749 0.076 17569 264 1 . 1 1 60 60 ASP CA C 214 54.211 54.211 53.553 0.658 17569 265 1 . 1 1 60 60 ASP CB C 214 41.558 41.558 40.500 1.058 17569 266 1 . 1 1 60 60 ASP H H 214 8.193 8.193 7.932 0.261 17569 267 1 . 1 1 61 61 GLY N N 215 108.300 108.300 107.983 0.317 17569 268 1 . 1 1 61 61 GLY CA C 215 45.397 45.397 45.881 -0.484 17569 269 1 . 1 1 61 61 GLY H H 215 8.234 8.234 8.138 0.096 17569 270 1 . 1 1 62 62 MET N N 216 120.002 120.002 117.679 2.323 17569 271 1 . 1 1 62 62 MET HA H 216 4.972 4.972 4.600 0.372 17569 272 1 . 1 1 62 62 MET CA C 216 53.151 53.151 54.343 -1.192 17569 273 1 . 1 1 62 62 MET CB C 216 32.311 32.311 34.849 -2.538 17569 274 1 . 1 1 62 62 MET H H 216 8.376 8.376 7.457 0.919 17569 275 1 . 1 1 63 63 ASP N N 217 127.300 127.300 121.884 5.416 17569 276 1 . 1 1 63 63 ASP HA H 217 4.966 4.966 4.660 0.306 17569 277 1 . 1 1 63 63 ASP CA C 217 55.569 55.569 55.187 0.382 17569 278 1 . 1 1 63 63 ASP H H 217 9.368 9.368 8.487 0.881 17569 279 1 . 1 1 64 64 GLU N N 218 114.400 114.400 124.688 -10.288 17569 280 1 . 1 1 64 64 GLU HA H 218 4.156 4.156 4.502 -0.346 17569 281 1 . 1 1 64 64 GLU CA C 218 55.850 55.850 55.630 0.220 17569 282 1 . 1 1 64 64 GLU H H 218 8.583 8.583 8.486 0.097 17569 283 1 . 1 1 65 65 GLN N N 219 115.500 115.500 117.118 -1.618 17569 284 1 . 1 1 65 65 GLN HA H 219 4.311 4.311 4.538 -0.227 17569 285 1 . 1 1 65 65 GLN CA C 219 55.346 55.346 55.150 0.196 17569 286 1 . 1 1 65 65 GLN H H 219 7.158 7.158 7.795 -0.637 17569 287 1 . 1 1 66 66 CYS N N 220 122.600 122.600 117.796 4.804 17569 288 1 . 1 1 66 66 CYS HA H 220 4.077 4.077 5.287 -1.210 17569 289 1 . 1 1 66 66 CYS CA C 220 57.529 57.529 56.532 0.997 17569 290 1 . 1 1 66 66 CYS CB C 220 31.972 31.972 30.262 1.710 17569 291 1 . 1 1 66 66 CYS H H 220 8.248 8.248 8.439 -0.191 17569 292 1 . 1 1 67 67 ARG N N 221 130.363 130.363 124.034 6.329 17569 293 1 . 1 1 67 67 ARG HA H 221 4.067 4.067 4.439 -0.372 17569 294 1 . 1 1 67 67 ARG CA C 221 55.016 55.016 57.798 -2.782 17569 295 1 . 1 1 67 67 ARG H H 221 9.145 9.145 8.634 0.511 17569 296 1 . 1 1 68 68 TRP N N 222 124.200 124.200 120.692 3.508 17569 297 1 . 1 1 68 68 TRP HA H 222 4.436 4.436 4.709 -0.273 17569 298 1 . 1 1 68 68 TRP CA C 222 60.080 60.080 59.413 0.667 17569 299 1 . 1 1 68 68 TRP CB C 222 31.194 31.194 30.463 0.731 17569 300 1 . 1 1 68 68 TRP H H 222 9.689 9.689 8.230 1.459 17569 301 1 . 1 1 69 69 CYS N N 223 116.297 116.297 110.962 5.335 17569 302 1 . 1 1 69 69 CYS HA H 223 5.091 5.091 5.065 0.026 17569 303 1 . 1 1 69 69 CYS CA C 223 59.102 59.102 56.174 2.928 17569 304 1 . 1 1 69 69 CYS CB C 223 32.338 32.338 27.288 5.050 17569 305 1 . 1 1 69 69 CYS H H 223 8.822 8.822 7.752 1.070 17569 306 1 . 1 1 70 70 ALA N N 224 123.112 123.112 123.769 -0.657 17569 307 1 . 1 1 70 70 ALA HA H 224 4.406 4.406 4.301 0.105 17569 308 1 . 1 1 70 70 ALA CA C 224 52.851 52.851 53.302 -0.451 17569 309 1 . 1 1 70 70 ALA CB C 224 17.720 17.720 17.760 -0.040 17569 310 1 . 1 1 70 70 ALA H H 224 8.787 8.787 8.201 0.586 17569 311 1 . 1 1 71 71 GLU N N 225 118.300 118.300 120.483 -2.183 17569 312 1 . 1 1 71 71 GLU HA H 225 5.308 5.308 4.497 0.811 17569 313 1 . 1 1 71 71 GLU CA C 225 53.299 53.299 55.827 -2.527 17569 314 1 . 1 1 71 71 GLU H H 225 8.541 8.541 8.108 0.432 17569 315 1 . 1 1 72 72 GLY N N 226 111.995 111.995 110.010 1.985 17569 316 1 . 1 1 72 72 GLY CA C 226 44.403 44.403 44.868 -0.465 17569 317 1 . 1 1 72 72 GLY H H 226 9.837 9.837 8.484 1.353 17569 318 1 . 1 1 73 73 GLY N N 227 106.600 106.600 107.305 -0.705 17569 319 1 . 1 1 73 73 GLY CA C 227 44.971 44.971 44.118 0.853 17569 320 1 . 1 1 73 73 GLY H H 227 7.772 7.772 8.354 -0.582 17569 321 1 . 1 1 74 74 ASN N N 228 124.277 124.277 119.574 4.703 17569 322 1 . 1 1 74 74 ASN HA H 228 5.081 5.081 4.501 0.580 17569 323 1 . 1 1 74 74 ASN CA C 228 53.100 53.100 53.714 -0.614 17569 324 1 . 1 1 74 74 ASN CB C 228 38.084 38.084 38.441 -0.357 17569 325 1 . 1 1 74 74 ASN H H 228 8.876 8.876 8.516 0.360 17569 326 1 . 1 1 75 75 LEU N N 229 123.050 123.050 122.326 0.724 17569 327 1 . 1 1 75 75 LEU HA H 229 4.600 4.600 4.923 -0.323 17569 328 1 . 1 1 75 75 LEU CA C 229 54.362 54.362 53.436 0.926 17569 329 1 . 1 1 75 75 LEU CB C 229 43.500 43.500 44.031 -0.531 17569 330 1 . 1 1 75 75 LEU H H 229 8.901 8.901 8.065 0.836 17569 331 1 . 1 1 76 76 ILE N N 230 123.552 123.552 123.052 0.500 17569 332 1 . 1 1 76 76 ILE HA H 230 4.485 4.485 4.125 0.360 17569 333 1 . 1 1 76 76 ILE CA C 230 60.700 60.700 61.165 -0.465 17569 334 1 . 1 1 76 76 ILE CB C 230 37.399 37.399 38.303 -0.904 17569 335 1 . 1 1 76 76 ILE H H 230 9.406 9.406 9.177 0.229 17569 336 1 . 1 1 77 77 CYS N N 231 124.637 124.637 125.990 -1.353 17569 337 1 . 1 1 77 77 CYS HA H 231 4.875 4.875 5.424 -0.549 17569 338 1 . 1 1 77 77 CYS CA C 231 58.359 58.359 57.855 0.504 17569 339 1 . 1 1 77 77 CYS CB C 231 29.434 29.434 28.940 0.494 17569 340 1 . 1 1 77 77 CYS H H 231 8.809 8.809 8.487 0.322 17569 341 1 . 1 1 78 78 CYS N N 232 125.697 125.697 123.772 1.925 17569 342 1 . 1 1 78 78 CYS HA H 232 4.284 4.284 4.837 -0.553 17569 343 1 . 1 1 78 78 CYS CA C 232 61.884 61.884 58.039 3.845 17569 344 1 . 1 1 78 78 CYS CB C 232 31.170 31.170 29.744 1.426 17569 345 1 . 1 1 78 78 CYS H H 232 8.579 8.579 8.731 -0.152 17569 346 1 . 1 1 79 79 ASP N N 233 123.600 123.600 125.650 -2.050 17569 347 1 . 1 1 79 79 ASP HA H 233 4.757 4.757 4.625 0.132 17569 348 1 . 1 1 79 79 ASP CA C 233 56.989 56.989 54.320 2.669 17569 349 1 . 1 1 79 79 ASP CB C 233 41.629 41.629 40.236 1.393 17569 350 1 . 1 1 79 79 ASP H H 233 8.577 8.577 8.260 0.317 17569 351 1 . 1 1 80 80 PHE N N 234 122.100 122.100 116.899 5.201 17569 352 1 . 1 1 80 80 PHE HA H 234 4.526 4.526 4.600 -0.074 17569 353 1 . 1 1 80 80 PHE CA C 234 59.909 59.909 58.342 1.567 17569 354 1 . 1 1 80 80 PHE CB C 234 41.849 41.849 40.103 1.746 17569 355 1 . 1 1 80 80 PHE H H 234 10.432 10.432 7.403 3.029 17569 356 1 . 1 1 81 81 CYS N N 235 124.300 124.300 117.622 6.678 17569 357 1 . 1 1 81 81 CYS HA H 235 5.156 5.156 4.741 0.415 17569 358 1 . 1 1 81 81 CYS CA C 235 58.045 58.045 58.022 0.023 17569 359 1 . 1 1 81 81 CYS CB C 235 31.407 31.407 27.490 3.917 17569 360 1 . 1 1 81 81 CYS H H 235 8.476 8.476 8.017 0.459 17569 361 1 . 1 1 82 82 HIS N N 236 112.598 112.598 118.916 -6.318 17569 362 1 . 1 1 82 82 HIS HA H 236 4.983 4.983 4.159 0.824 17569 363 1 . 1 1 82 82 HIS CA C 236 55.398 55.398 56.930 -1.532 17569 364 1 . 1 1 82 82 HIS CB C 236 30.257 30.257 27.820 2.437 17569 365 1 . 1 1 82 82 HIS H H 236 6.699 6.699 8.172 -1.473 17569 366 1 . 1 1 83 83 ASN N N 237 123.600 123.600 118.737 4.863 17569 367 1 . 1 1 83 83 ASN HA H 237 4.801 4.801 4.949 -0.148 17569 368 1 . 1 1 83 83 ASN CA C 237 55.616 55.616 52.920 2.696 17569 369 1 . 1 1 83 83 ASN H H 237 9.097 9.097 7.917 1.180 17569 370 1 . 1 1 84 84 ALA N N 238 122.000 122.000 124.044 -2.044 17569 371 1 . 1 1 84 84 ALA HA H 238 5.409 5.409 5.279 0.130 17569 372 1 . 1 1 84 84 ALA CA C 238 50.364 50.364 50.246 0.118 17569 373 1 . 1 1 84 84 ALA CB C 238 25.070 25.070 22.120 2.950 17569 374 1 . 1 1 84 84 ALA H H 238 9.885 9.885 8.586 1.299 17569 375 1 . 1 1 85 85 PHE N N 239 116.707 116.707 121.465 -4.758 17569 376 1 . 1 1 85 85 PHE HA H 239 6.028 6.028 5.139 0.889 17569 377 1 . 1 1 85 85 PHE CA C 239 56.217 56.217 56.552 -0.335 17569 378 1 . 1 1 85 85 PHE CB C 239 44.664 44.664 42.990 1.674 17569 379 1 . 1 1 85 85 PHE H H 239 9.450 9.450 9.095 0.355 17569 380 1 . 1 1 86 86 CYS N N 240 126.682 126.682 123.505 3.177 17569 381 1 . 1 1 86 86 CYS HA H 240 5.622 5.622 4.834 0.788 17569 382 1 . 1 1 86 86 CYS CA C 240 57.342 57.342 57.475 -0.133 17569 383 1 . 1 1 86 86 CYS CB C 240 32.257 32.257 29.501 2.756 17569 384 1 . 1 1 86 86 CYS H H 240 11.309 11.309 9.393 1.916 17569 385 1 . 1 1 87 87 LYS N N 241 117.865 117.865 124.026 -6.161 17569 386 1 . 1 1 87 87 LYS HA H 241 3.849 3.849 3.915 -0.066 17569 387 1 . 1 1 87 87 LYS CA C 241 60.070 60.070 60.219 -0.149 17569 388 1 . 1 1 87 87 LYS CB C 241 32.798 32.798 32.442 0.357 17569 389 1 . 1 1 87 87 LYS H H 241 8.230 8.230 8.732 -0.502 17569 390 1 . 1 1 88 88 LYS N N 242 117.949 117.949 118.459 -0.510 17569 391 1 . 1 1 88 88 LYS HA H 242 3.978 3.978 4.112 -0.134 17569 392 1 . 1 1 88 88 LYS CA C 242 60.370 60.370 59.027 1.343 17569 393 1 . 1 1 88 88 LYS CB C 242 32.316 32.316 32.053 0.263 17569 394 1 . 1 1 88 88 LYS H H 242 7.945 7.945 8.498 -0.553 17569 395 1 . 1 1 89 89 CYS N N 243 125.305 125.305 117.592 7.713 17569 396 1 . 1 1 89 89 CYS HA H 243 3.742 3.742 4.264 -0.522 17569 397 1 . 1 1 89 89 CYS CA C 243 64.827 64.827 62.564 2.263 17569 398 1 . 1 1 89 89 CYS CB C 243 28.241 28.241 27.186 1.055 17569 399 1 . 1 1 89 89 CYS H H 243 9.297 9.297 7.701 1.596 17569 400 1 . 1 1 90 90 ILE N N 244 119.687 119.687 121.505 -1.818 17569 401 1 . 1 1 90 90 ILE HA H 244 3.607 3.607 3.968 -0.361 17569 402 1 . 1 1 90 90 ILE CA C 244 65.950 65.950 65.204 0.746 17569 403 1 . 1 1 90 90 ILE H H 244 7.997 7.997 7.732 0.265 17569 404 1 . 1 1 91 91 LEU N N 245 120.280 120.280 121.060 -0.780 17569 405 1 . 1 1 91 91 LEU HA H 245 3.685 3.685 4.344 -0.659 17569 406 1 . 1 1 91 91 LEU CA C 245 58.235 58.235 57.618 0.617 17569 407 1 . 1 1 91 91 LEU CB C 245 41.958 41.958 41.974 -0.016 17569 408 1 . 1 1 91 91 LEU H H 245 8.810 8.810 8.783 0.027 17569 409 1 . 1 1 92 92 ARG N N 246 116.901 116.901 117.287 -0.386 17569 410 1 . 1 1 92 92 ARG HA H 246 3.817 3.817 4.115 -0.298 17569 411 1 . 1 1 92 92 ARG CA C 246 58.980 58.980 58.084 0.896 17569 412 1 . 1 1 92 92 ARG CB C 246 30.600 30.600 30.098 0.502 17569 413 1 . 1 1 92 92 ARG H H 246 8.086 8.086 7.634 0.452 17569 414 1 . 1 1 93 93 ASN N N 247 111.200 111.200 116.133 -4.933 17569 415 1 . 1 1 93 93 ASN HA H 247 4.603 4.603 4.510 0.093 17569 416 1 . 1 1 93 93 ASN CA C 247 55.808 55.808 54.716 1.092 17569 417 1 . 1 1 93 93 ASN CB C 247 42.484 42.484 39.039 3.445 17569 418 1 . 1 1 93 93 ASN H H 247 7.136 7.136 8.195 -1.059 17569 419 1 . 1 1 94 94 LEU N N 248 118.807 118.807 117.397 1.410 17569 420 1 . 1 1 94 94 LEU HA H 248 4.814 4.814 4.464 0.350 17569 421 1 . 1 1 94 94 LEU CA C 248 55.189 55.189 55.140 0.049 17569 422 1 . 1 1 94 94 LEU CB C 248 43.698 43.698 43.673 0.025 17569 423 1 . 1 1 94 94 LEU H H 248 8.515 8.515 7.961 0.554 17569 424 1 . 1 1 95 95 GLY N N 249 108.000 108.000 106.163 1.837 17569 425 1 . 1 1 95 95 GLY CA C 249 44.628 44.628 44.642 -0.014 17569 426 1 . 1 1 95 95 GLY H H 249 7.955 7.955 7.713 0.242 17569 427 1 . 1 1 96 96 ARG N N 250 117.797 117.797 121.528 -3.731 17569 428 1 . 1 1 96 96 ARG HA H 250 3.843 3.843 4.290 -0.447 17569 429 1 . 1 1 96 96 ARG CA C 250 58.682 58.682 58.193 0.489 17569 430 1 . 1 1 96 96 ARG CB C 250 29.860 29.860 30.235 -0.375 17569 431 1 . 1 1 96 96 ARG H H 250 8.559 8.559 8.659 -0.100 17569 432 1 . 1 1 97 97 LYS N N 251 120.900 120.900 119.576 1.324 17569 433 1 . 1 1 97 97 LYS HA H 251 4.156 4.156 4.031 0.125 17569 434 1 . 1 1 97 97 LYS CA C 251 59.156 59.156 59.583 -0.427 17569 435 1 . 1 1 97 97 LYS CB C 251 31.360 31.360 31.638 -0.278 17569 436 1 . 1 1 97 97 LYS H H 251 8.655 8.655 8.541 0.114 17569 437 1 . 1 1 98 98 GLU N N 252 122.000 122.000 118.910 3.090 17569 438 1 . 1 1 98 98 GLU HA H 252 4.351 4.351 4.091 0.260 17569 439 1 . 1 1 98 98 GLU CA C 252 58.582 58.582 59.356 -0.774 17569 440 1 . 1 1 98 98 GLU CB C 252 28.400 28.400 29.334 -0.934 17569 441 1 . 1 1 98 98 GLU H H 252 7.705 7.705 8.343 -0.638 17569 442 1 . 1 1 99 99 LEU N N 253 117.400 117.400 120.866 -3.466 17569 443 1 . 1 1 99 99 LEU HA H 253 3.917 3.917 3.804 0.113 17569 444 1 . 1 1 99 99 LEU CA C 253 57.998 57.998 58.076 -0.078 17569 445 1 . 1 1 99 99 LEU CB C 253 41.482 41.482 41.839 -0.357 17569 446 1 . 1 1 99 99 LEU H H 253 7.285 7.285 7.652 -0.367 17569 447 1 . 1 1 100 100 SER N N 254 112.100 112.100 114.351 -2.251 17569 448 1 . 1 1 100 100 SER HA H 254 4.107 4.107 4.120 -0.013 17569 449 1 . 1 1 100 100 SER CA C 254 61.603 61.603 61.883 -0.280 17569 450 1 . 1 1 100 100 SER CB C 254 62.622 62.622 63.068 -0.446 17569 451 1 . 1 1 100 100 SER H H 254 8.326 8.326 8.059 0.267 17569 452 1 . 1 1 101 101 THR N N 255 118.151 118.151 118.667 -0.516 17569 453 1 . 1 1 101 101 THR HA H 255 4.026 4.026 4.064 -0.038 17569 454 1 . 1 1 101 101 THR CA C 255 66.261 66.261 66.558 -0.297 17569 455 1 . 1 1 101 101 THR CB C 255 68.735 68.735 68.768 -0.033 17569 456 1 . 1 1 101 101 THR H H 255 7.972 7.972 7.818 0.154 17569 457 1 . 1 1 102 102 ILE N N 256 120.100 120.100 122.726 -2.626 17569 458 1 . 1 1 102 102 ILE HA H 256 3.463 3.463 3.693 -0.230 17569 459 1 . 1 1 102 102 ILE CA C 256 64.774 64.774 64.758 0.016 17569 460 1 . 1 1 102 102 ILE CB C 256 37.741 37.741 37.443 0.298 17569 461 1 . 1 1 102 102 ILE H H 256 7.868 7.868 8.543 -0.675 17569 462 1 . 1 1 103 103 MET N N 257 114.876 114.876 116.697 -1.821 17569 463 1 . 1 1 103 103 MET HA H 257 4.211 4.211 4.071 0.140 17569 464 1 . 1 1 103 103 MET CA C 257 55.691 55.691 58.242 -2.551 17569 465 1 . 1 1 103 103 MET CB C 257 32.000 32.000 32.707 -0.707 17569 466 1 . 1 1 103 103 MET H H 257 7.606 7.606 7.306 0.300 17569 467 1 . 1 1 104 104 ASP N N 258 119.976 119.976 118.781 1.195 17569 468 1 . 1 1 104 104 ASP HA H 258 4.538 4.538 4.786 -0.248 17569 469 1 . 1 1 104 104 ASP CA C 258 54.912 54.912 53.832 1.080 17569 470 1 . 1 1 104 104 ASP CB C 258 41.500 41.500 40.392 1.108 17569 471 1 . 1 1 104 104 ASP H H 258 7.444 7.444 7.617 -0.173 17569 472 1 . 1 1 105 105 GLU N N 259 124.388 124.388 121.417 2.971 17569 473 1 . 1 1 105 105 GLU HA H 259 4.287 4.287 4.521 -0.234 17569 474 1 . 1 1 105 105 GLU CA C 259 57.571 57.571 55.049 2.522 17569 475 1 . 1 1 105 105 GLU CB C 259 29.542 29.542 29.856 -0.314 17569 476 1 . 1 1 105 105 GLU H H 259 8.559 8.559 8.189 0.370 17569 477 1 . 1 1 106 106 ASN N N 260 117.201 117.201 118.096 -0.895 17569 478 1 . 1 1 106 106 ASN HA H 260 4.742 4.742 4.414 0.328 17569 479 1 . 1 1 106 106 ASN CA C 260 53.743 53.743 54.023 -0.280 17569 480 1 . 1 1 106 106 ASN CB C 260 38.918 38.918 37.421 1.497 17569 481 1 . 1 1 106 106 ASN H H 260 8.673 8.673 8.554 0.119 17569 482 1 . 1 1 107 107 ASN N N 261 117.900 117.900 113.060 4.840 17569 483 1 . 1 1 107 107 ASN HA H 261 4.985 4.985 4.294 0.691 17569 484 1 . 1 1 107 107 ASN CA C 261 52.302 52.302 54.667 -2.365 17569 485 1 . 1 1 107 107 ASN CB C 261 40.614 40.614 37.517 3.097 17569 486 1 . 1 1 107 107 ASN H H 261 7.956 7.956 8.724 -0.768 17569 487 1 . 1 1 108 108 GLN N N 262 121.500 121.500 115.337 6.163 17569 488 1 . 1 1 108 108 GLN HA H 262 4.608 4.608 4.060 0.548 17569 489 1 . 1 1 108 108 GLN CA C 262 55.776 55.776 54.691 1.085 17569 490 1 . 1 1 108 108 GLN CB C 262 30.558 30.558 29.766 0.792 17569 491 1 . 1 1 108 108 GLN H H 262 8.493 8.493 7.695 0.798 17569 492 1 . 1 1 109 109 TRP N N 263 128.056 128.056 123.305 4.751 17569 493 1 . 1 1 109 109 TRP HA H 263 4.971 4.971 4.787 0.184 17569 494 1 . 1 1 109 109 TRP CA C 263 58.097 58.097 57.607 0.490 17569 495 1 . 1 1 109 109 TRP CB C 263 30.493 30.493 29.894 0.599 17569 496 1 . 1 1 109 109 TRP H H 263 10.497 10.497 8.016 2.481 17569 497 1 . 1 1 110 110 TYR N N 264 126.600 126.600 125.589 1.011 17569 498 1 . 1 1 110 110 TYR HA H 264 4.402 4.402 4.319 0.083 17569 499 1 . 1 1 110 110 TYR CA C 264 56.671 56.671 59.185 -2.514 17569 500 1 . 1 1 110 110 TYR CB C 264 39.008 39.008 40.130 -1.122 17569 501 1 . 1 1 110 110 TYR H H 264 7.545 7.545 8.105 -0.560 17569 502 1 . 1 1 111 111 CYS N N 265 124.622 124.622 114.455 10.167 17569 503 1 . 1 1 111 111 CYS H H 265 8.586 8.586 8.290 0.296 17569 504 1 . 1 1 112 112 TYR HA H 266 4.192 4.192 4.817 -0.625 17569 505 1 . 1 1 112 112 TYR CA C 266 57.715 57.715 56.684 1.031 17569 506 1 . 1 1 112 112 TYR CB C 266 37.920 37.920 36.648 1.272 17569 507 1 . 1 1 113 113 ILE N N 267 119.504 119.504 119.688 -0.184 17569 508 1 . 1 1 113 113 ILE HA H 267 3.950 3.950 4.632 -0.682 17569 509 1 . 1 1 113 113 ILE CA C 267 61.249 61.249 60.959 0.290 17569 510 1 . 1 1 113 113 ILE CB C 267 35.533 35.533 38.562 -3.029 17569 511 1 . 1 1 113 113 ILE H H 267 9.160 9.160 7.493 1.667 17569 512 1 . 1 1 114 114 CYS N N 268 124.100 124.100 118.369 5.731 17569 513 1 . 1 1 114 114 CYS HA H 268 3.814 3.814 4.173 -0.359 17569 514 1 . 1 1 114 114 CYS CA C 268 65.300 65.300 61.670 3.630 17569 515 1 . 1 1 114 114 CYS CB C 268 29.721 29.721 27.087 2.634 17569 516 1 . 1 1 114 114 CYS H H 268 7.818 7.818 8.244 -0.426 17569 517 1 . 1 1 115 115 HIS N N 269 117.127 117.127 111.261 5.866 17569 518 1 . 1 1 115 115 HIS HA H 269 5.129 5.129 4.664 0.465 17569 519 1 . 1 1 115 115 HIS CA C 269 52.161 52.161 53.019 -0.858 17569 520 1 . 1 1 115 115 HIS CB C 269 31.192 31.192 28.841 2.351 17569 521 1 . 1 1 115 115 HIS H H 269 8.953 8.953 7.796 1.157 17569 522 1 . 1 1 116 116 PRO HA H 270 4.942 4.942 4.456 0.486 17569 523 1 . 1 1 116 116 PRO CA C 270 63.308 63.308 63.496 -0.188 17569 524 1 . 1 1 116 116 PRO CB C 270 32.642 32.642 31.609 1.033 17569 525 1 . 1 1 117 117 GLU N N 271 123.504 123.504 123.109 0.395 17569 526 1 . 1 1 117 117 GLU HA H 271 4.020 4.020 4.383 -0.363 17569 527 1 . 1 1 117 117 GLU CA C 271 61.869 61.869 58.007 3.863 17569 528 1 . 1 1 117 117 GLU CB C 271 27.051 27.051 28.951 -1.900 17569 529 1 . 1 1 117 117 GLU H H 271 8.402 8.402 8.144 0.258 17569 530 1 . 1 1 118 118 PRO HA H 272 4.542 4.542 4.549 -0.007 17569 531 1 . 1 1 118 118 PRO CA C 272 65.359 65.359 63.640 1.719 17569 532 1 . 1 1 118 118 PRO CB C 272 32.142 32.142 31.400 0.742 17569 533 1 . 1 1 119 119 LEU N N 273 112.296 112.296 114.311 -2.015 17569 534 1 . 1 1 119 119 LEU HA H 273 4.474 4.474 4.922 -0.448 17569 535 1 . 1 1 119 119 LEU CB C 273 41.542 41.542 41.474 0.068 17569 536 1 . 1 1 119 119 LEU H H 273 8.090 8.090 7.449 0.641 17569 537 1 . 1 1 120 120 LEU N N 274 121.388 121.388 123.335 -1.947 17569 538 1 . 1 1 120 120 LEU HA H 274 4.027 4.027 3.928 0.099 17569 539 1 . 1 1 120 120 LEU CA C 274 59.301 59.301 59.483 -0.182 17569 540 1 . 1 1 120 120 LEU CB C 274 42.100 42.100 41.506 0.594 17569 541 1 . 1 1 120 120 LEU H H 274 7.823 7.823 8.185 -0.362 17569 542 1 . 1 1 121 121 ASP N N 275 118.600 118.600 118.651 -0.051 17569 543 1 . 1 1 121 121 ASP HA H 275 4.541 4.541 4.347 0.194 17569 544 1 . 1 1 121 121 ASP CA C 275 57.703 57.703 57.489 0.214 17569 545 1 . 1 1 121 121 ASP CB C 275 39.443 39.443 40.297 -0.854 17569 546 1 . 1 1 121 121 ASP H H 275 8.694 8.694 8.489 0.205 17569 547 1 . 1 1 122 122 LEU N N 276 123.192 123.192 120.523 2.669 17569 548 1 . 1 1 122 122 LEU HA H 276 4.392 4.392 3.975 0.417 17569 549 1 . 1 1 122 122 LEU CA C 276 57.971 57.971 57.978 -0.007 17569 550 1 . 1 1 122 122 LEU CB C 276 42.542 42.542 42.046 0.496 17569 551 1 . 1 1 122 122 LEU H H 276 8.013 8.013 7.434 0.579 17569 552 1 . 1 1 123 123 VAL N N 277 126.898 126.898 118.709 8.189 17569 553 1 . 1 1 123 123 VAL HA H 277 3.855 3.855 3.648 0.207 17569 554 1 . 1 1 123 123 VAL CA C 277 66.663 66.663 66.829 -0.166 17569 555 1 . 1 1 123 123 VAL CB C 277 32.058 32.058 31.230 0.828 17569 556 1 . 1 1 123 123 VAL H H 277 8.781 8.781 7.893 0.888 17569 557 1 . 1 1 124 124 THR N N 278 117.500 117.500 116.405 1.095 17569 558 1 . 1 1 124 124 THR HA H 278 4.030 4.030 3.911 0.119 17569 559 1 . 1 1 124 124 THR CA C 278 66.589 66.589 67.045 -0.456 17569 560 1 . 1 1 124 124 THR CB C 278 68.410 68.410 68.369 0.041 17569 561 1 . 1 1 124 124 THR H H 278 8.722 8.722 8.318 0.404 17569 562 1 . 1 1 125 125 ALA N N 279 124.700 124.700 124.032 0.668 17569 563 1 . 1 1 125 125 ALA HA H 279 4.261 4.261 4.080 0.181 17569 564 1 . 1 1 125 125 ALA CA C 279 55.296 55.296 55.013 0.283 17569 565 1 . 1 1 125 125 ALA CB C 279 17.949 17.949 17.974 -0.025 17569 566 1 . 1 1 125 125 ALA H H 279 8.239 8.239 7.974 0.265 17569 567 1 . 1 1 126 126 CYS N N 280 119.276 119.276 117.701 1.575 17569 568 1 . 1 1 126 126 CYS HA H 280 4.114 4.114 3.904 0.210 17569 569 1 . 1 1 126 126 CYS CA C 280 62.103 62.103 63.409 -1.306 17569 570 1 . 1 1 126 126 CYS CB C 280 26.496 26.496 27.477 -0.981 17569 571 1 . 1 1 126 126 CYS H H 280 8.128 8.128 7.792 0.336 17569 572 1 . 1 1 127 127 ASN N N 281 118.000 118.000 118.300 -0.300 17569 573 1 . 1 1 127 127 ASN HA H 281 4.560 4.560 4.570 -0.010 17569 574 1 . 1 1 127 127 ASN CA C 281 56.139 56.139 56.609 -0.470 17569 575 1 . 1 1 127 127 ASN CB C 281 36.965 36.965 38.029 -1.064 17569 576 1 . 1 1 127 127 ASN H H 281 8.725 8.725 7.987 0.738 17569 577 1 . 1 1 128 128 SER N N 282 116.601 116.601 116.912 -0.311 17569 578 1 . 1 1 128 128 SER HA H 282 4.363 4.363 4.199 0.164 17569 579 1 . 1 1 128 128 SER CA C 282 61.899 61.899 61.675 0.224 17569 580 1 . 1 1 128 128 SER CB C 282 62.630 62.630 63.023 -0.393 17569 581 1 . 1 1 128 128 SER H H 282 8.542 8.542 7.681 0.861 17569 582 1 . 1 1 129 129 VAL N N 283 123.272 123.272 121.934 1.338 17569 583 1 . 1 1 129 129 VAL HA H 283 3.677 3.677 3.552 0.125 17569 584 1 . 1 1 129 129 VAL CA C 283 66.508 66.508 66.475 0.033 17569 585 1 . 1 1 129 129 VAL CB C 283 31.218 31.218 31.258 -0.040 17569 586 1 . 1 1 129 129 VAL H H 283 7.990 7.990 8.000 -0.010 17569 587 1 . 1 1 130 130 PHE N N 284 118.594 118.594 119.204 -0.610 17569 588 1 . 1 1 130 130 PHE HA H 284 4.013 4.013 4.277 -0.264 17569 589 1 . 1 1 130 130 PHE CA C 284 63.500 63.500 61.241 2.259 17569 590 1 . 1 1 130 130 PHE CB C 284 38.996 38.996 38.335 0.661 17569 591 1 . 1 1 130 130 PHE H H 284 8.190 8.190 8.114 0.076 17569 592 1 . 1 1 131 131 GLU N N 285 120.905 120.905 120.319 0.586 17569 593 1 . 1 1 131 131 GLU HA H 285 4.205 4.205 4.037 0.168 17569 594 1 . 1 1 131 131 GLU CA C 285 59.214 59.214 59.802 -0.588 17569 595 1 . 1 1 131 131 GLU CB C 285 29.500 29.500 29.445 0.055 17569 596 1 . 1 1 131 131 GLU H H 285 8.699 8.699 8.832 -0.133 17569 597 1 . 1 1 132 132 ASN N N 286 117.997 117.997 118.214 -0.217 17569 598 1 . 1 1 132 132 ASN HA H 286 4.595 4.595 4.654 -0.059 17569 599 1 . 1 1 132 132 ASN CA C 286 55.615 55.615 56.018 -0.403 17569 600 1 . 1 1 132 132 ASN CB C 286 38.852 38.852 38.743 0.109 17569 601 1 . 1 1 132 132 ASN H H 286 8.082 8.082 8.069 0.013 17569 602 1 . 1 1 133 133 LEU N N 287 120.800 120.800 122.237 -1.437 17569 603 1 . 1 1 133 133 LEU HA H 287 4.117 4.117 4.319 -0.202 17569 604 1 . 1 1 133 133 LEU CA C 287 57.798 57.798 58.301 -0.503 17569 605 1 . 1 1 133 133 LEU H H 287 7.904 7.904 8.493 -0.589 17569 606 1 . 1 1 134 134 GLU N N 288 118.200 118.200 118.817 -0.617 17569 607 1 . 1 1 134 134 GLU HA H 288 4.079 4.079 3.922 0.157 17569 608 1 . 1 1 134 134 GLU CA C 288 58.997 58.997 60.036 -1.039 17569 609 1 . 1 1 134 134 GLU CB C 288 29.242 29.242 29.321 -0.079 17569 610 1 . 1 1 134 134 GLU H H 288 8.157 8.157 8.467 -0.310 17569 611 1 . 1 1 135 135 GLN N N 289 117.400 117.400 118.621 -1.221 17569 612 1 . 1 1 135 135 GLN HA H 289 4.174 4.174 4.103 0.071 17569 613 1 . 1 1 135 135 GLN CA C 289 57.989 57.989 58.518 -0.529 17569 614 1 . 1 1 135 135 GLN CB C 289 28.080 28.080 28.508 -0.428 17569 615 1 . 1 1 135 135 GLN H H 289 7.869 7.869 7.671 0.198 17569 616 1 . 1 1 136 136 LEU N N 290 121.000 121.000 121.475 -0.475 17569 617 1 . 1 1 136 136 LEU HA H 290 4.173 4.173 3.900 0.273 17569 618 1 . 1 1 136 136 LEU CA C 290 57.138 57.138 57.807 -0.669 17569 619 1 . 1 1 136 136 LEU CB C 290 42.000 42.000 41.691 0.309 17569 620 1 . 1 1 136 136 LEU H H 290 7.968 7.968 7.719 0.249 17569 621 1 . 1 1 137 137 LEU N N 291 118.900 118.900 118.426 0.474 17569 622 1 . 1 1 137 137 LEU HA H 291 4.241 4.241 4.025 0.216 17569 623 1 . 1 1 137 137 LEU CA C 291 56.360 56.360 57.385 -1.025 17569 624 1 . 1 1 137 137 LEU CB C 291 41.472 41.472 42.219 -0.748 17569 625 1 . 1 1 137 137 LEU H H 291 8.154 8.154 7.729 0.425 17569 626 1 . 1 1 138 138 GLN N N 292 117.993 117.993 115.714 2.279 17569 627 1 . 1 1 138 138 GLN HA H 292 4.272 4.272 4.353 -0.081 17569 628 1 . 1 1 138 138 GLN CA C 292 56.632 56.632 56.027 0.605 17569 629 1 . 1 1 138 138 GLN CB C 292 28.584 28.584 29.319 -0.735 17569 630 1 . 1 1 138 138 GLN H H 292 7.896 7.896 7.588 0.308 17569 631 1 . 1 1 139 139 GLN N N 293 118.889 118.889 119.636 -0.747 17569 632 1 . 1 1 139 139 GLN HA H 293 4.269 4.269 4.415 -0.146 17569 633 1 . 1 1 139 139 GLN CA C 293 56.454 56.454 55.525 0.929 17569 634 1 . 1 1 139 139 GLN CB C 293 29.069 29.069 29.390 -0.321 17569 635 1 . 1 1 139 139 GLN H H 293 8.091 8.091 7.790 0.301 17569 636 1 . 1 1 140 140 ASN N N 294 118.604 118.604 121.250 -2.646 17569 637 1 . 1 1 140 140 ASN HA H 294 4.759 4.759 4.829 -0.070 17569 638 1 . 1 1 140 140 ASN CA C 294 53.221 53.221 53.183 0.038 17569 639 1 . 1 1 140 140 ASN CB C 294 38.733 38.733 39.673 -0.940 17569 640 1 . 1 1 140 140 ASN H H 294 8.273 8.273 8.440 -0.167 17569 641 1 . 1 1 141 141 LYS N N 295 121.685 121.685 121.113 0.572 17569 642 1 . 1 1 141 141 LYS HA H 295 4.360 4.360 4.534 -0.174 17569 643 1 . 1 1 141 141 LYS CA C 295 56.173 56.173 56.212 -0.039 17569 644 1 . 1 1 141 141 LYS CB C 295 32.535 32.535 33.385 -0.850 17569 645 1 . 1 1 141 141 LYS H H 295 8.089 8.089 8.332 -0.243 17569 stop_ save_