data_25806 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25806 _Entry.PDB_ID 2N7I 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 25806 _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 1 205 205 SER CA C 205 58.498 58.498 58.285 0.213 25806 2 1 1 . 1 1 205 205 SER CB C 205 64.088 64.088 65.010 -0.922 25806 3 1 1 . 1 1 206 206 PHE N N 206 121.596 121.596 122.992 -1.396 25806 4 1 1 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.240 0.547 25806 5 1 1 . 1 1 206 206 PHE C C 206 175.282 175.282 174.637 0.645 25806 6 1 1 . 1 1 206 206 PHE CA C 206 57.711 57.711 58.558 -0.847 25806 7 1 1 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.039 1.100 25806 8 1 1 . 1 1 206 206 PHE H H 206 8.414 8.414 8.805 -0.391 25806 9 1 1 . 1 1 207 207 THR N N 207 116.011 116.011 118.939 -2.928 25806 10 1 1 . 1 1 207 207 THR HA H 207 4.442 4.442 4.416 0.026 25806 11 1 1 . 1 1 207 207 THR C C 207 174.188 174.188 174.128 0.060 25806 12 1 1 . 1 1 207 207 THR CA C 207 61.309 61.309 61.921 -0.612 25806 13 1 1 . 1 1 207 207 THR CB C 207 70.503 70.503 69.495 1.008 25806 14 1 1 . 1 1 207 207 THR H H 207 8.233 8.233 7.833 0.400 25806 15 1 1 . 1 1 208 208 MET N N 208 121.915 121.915 121.083 0.832 25806 16 1 1 . 1 1 208 208 MET HA H 208 4.475 4.475 4.576 -0.101 25806 17 1 1 . 1 1 208 208 MET C C 208 175.595 175.595 174.490 1.105 25806 18 1 1 . 1 1 208 208 MET CA C 208 55.865 55.865 53.828 2.037 25806 19 1 1 . 1 1 208 208 MET CB C 208 32.987 32.987 33.945 -0.958 25806 20 1 1 . 1 1 208 208 MET H H 208 8.474 8.474 7.545 0.929 25806 21 1 1 . 1 1 209 209 ASN N N 209 119.024 119.024 119.361 -0.337 25806 22 1 1 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.487 0.286 25806 23 1 1 . 1 1 209 209 ASN C C 209 175.125 175.125 175.736 -0.611 25806 24 1 1 . 1 1 209 209 ASN CA C 209 53.389 53.389 53.052 0.337 25806 25 1 1 . 1 1 209 209 ASN CB C 209 39.165 39.165 39.138 0.027 25806 26 1 1 . 1 1 209 209 ASN H H 209 8.274 8.274 8.342 -0.068 25806 27 1 1 . 1 1 210 210 ASP N N 210 119.941 119.941 117.587 2.354 25806 28 1 1 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.419 0.134 25806 29 1 1 . 1 1 210 210 ASP C C 210 177.325 177.325 177.400 -0.075 25806 30 1 1 . 1 1 210 210 ASP CA C 210 56.169 56.169 56.816 -0.647 25806 31 1 1 . 1 1 210 210 ASP CB C 210 41.255 41.255 40.370 0.885 25806 32 1 1 . 1 1 210 210 ASP H H 210 8.262 8.262 8.757 -0.495 25806 33 1 1 . 1 1 211 211 THR N N 211 115.882 115.882 115.729 0.153 25806 34 1 1 . 1 1 211 211 THR HA H 211 4.107 4.107 4.253 -0.146 25806 35 1 1 . 1 1 211 211 THR C C 211 175.855 175.855 176.826 -0.971 25806 36 1 1 . 1 1 211 211 THR CA C 211 65.947 65.947 66.684 -0.737 25806 37 1 1 . 1 1 211 211 THR CB C 211 68.808 68.808 68.583 0.225 25806 38 1 1 . 1 1 211 211 THR H H 211 8.320 8.320 8.073 0.247 25806 39 1 1 . 1 1 212 212 THR N N 212 115.754 115.754 118.207 -2.453 25806 40 1 1 . 1 1 212 212 THR HA H 212 4.004 4.004 4.027 -0.023 25806 41 1 1 . 1 1 212 212 THR C C 212 177.310 177.310 176.250 1.060 25806 42 1 1 . 1 1 212 212 THR CA C 212 66.199 66.199 66.440 -0.241 25806 43 1 1 . 1 1 212 212 THR CB C 212 68.580 68.580 68.352 0.228 25806 44 1 1 . 1 1 212 212 THR H H 212 8.216 8.216 7.741 0.475 25806 45 1 1 . 1 1 213 213 VAL N N 213 123.471 123.471 119.947 3.524 25806 46 1 1 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.565 0.089 25806 47 1 1 . 1 1 213 213 VAL C C 213 177.157 177.157 177.833 -0.676 25806 48 1 1 . 1 1 213 213 VAL CA C 213 66.937 66.937 65.683 1.253 25806 49 1 1 . 1 1 213 213 VAL CB C 213 31.552 31.552 30.953 0.599 25806 50 1 1 . 1 1 213 213 VAL H H 213 8.090 8.090 7.193 0.897 25806 51 1 1 . 1 1 214 214 TRP N N 214 119.814 119.814 118.378 1.436 25806 52 1 1 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.491 -0.070 25806 53 1 1 . 1 1 214 214 TRP C C 214 178.622 178.622 178.446 0.176 25806 54 1 1 . 1 1 214 214 TRP CA C 214 60.857 60.857 59.868 0.989 25806 55 1 1 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.343 0.134 25806 56 1 1 . 1 1 214 214 TRP H H 214 7.966 7.966 7.722 0.244 25806 57 1 1 . 1 1 215 215 ILE N N 215 118.030 118.030 121.237 -3.207 25806 58 1 1 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.592 0.143 25806 59 1 1 . 1 1 215 215 ILE C C 215 177.589 177.589 177.971 -0.382 25806 60 1 1 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.927 0.383 25806 61 1 1 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.507 0.304 25806 62 1 1 . 1 1 215 215 ILE H H 215 8.388 8.388 7.556 0.832 25806 63 1 1 . 1 1 216 216 SER N N 216 116.314 116.314 115.456 0.858 25806 64 1 1 . 1 1 216 216 SER HA H 216 4.083 4.083 4.168 -0.085 25806 65 1 1 . 1 1 216 216 SER C C 216 175.835 175.835 176.826 -0.991 25806 66 1 1 . 1 1 216 216 SER CA C 216 63.777 63.777 62.398 1.379 25806 67 1 1 . 1 1 216 216 SER CB C 216 62.965 62.965 62.927 0.038 25806 68 1 1 . 1 1 216 216 SER H H 216 8.010 8.010 8.247 -0.237 25806 69 1 1 . 1 1 217 217 VAL N N 217 120.711 120.711 121.192 -0.481 25806 70 1 1 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.852 -0.275 25806 71 1 1 . 1 1 217 217 VAL C C 217 178.640 178.640 177.106 1.534 25806 72 1 1 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.205 1.665 25806 73 1 1 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.484 0.127 25806 74 1 1 . 1 1 217 217 VAL H H 217 8.381 8.381 7.156 1.225 25806 75 1 1 . 1 1 218 218 ALA N N 218 125.445 125.445 123.079 2.366 25806 76 1 1 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.078 -0.075 25806 77 1 1 . 1 1 218 218 ALA C C 218 178.882 178.882 179.888 -1.006 25806 78 1 1 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.416 0.635 25806 79 1 1 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.068 0.144 25806 80 1 1 . 1 1 218 218 ALA H H 218 8.565 8.565 8.030 0.535 25806 81 1 1 . 1 1 219 219 VAL N N 219 116.767 116.767 118.128 -1.361 25806 82 1 1 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.584 -0.029 25806 83 1 1 . 1 1 219 219 VAL C C 219 177.632 177.632 177.922 -0.290 25806 84 1 1 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.201 1.107 25806 85 1 1 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.610 -0.199 25806 86 1 1 . 1 1 219 219 VAL H H 219 8.575 8.575 7.614 0.961 25806 87 1 1 . 1 1 220 220 LEU N N 220 118.644 118.644 119.847 -1.203 25806 88 1 1 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.843 0.130 25806 89 1 1 . 1 1 220 220 LEU C C 220 178.641 178.641 178.972 -0.331 25806 90 1 1 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.117 0.410 25806 91 1 1 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.912 1.002 25806 92 1 1 . 1 1 220 220 LEU H H 220 8.434 8.434 7.359 1.075 25806 93 1 1 . 1 1 221 221 SER N N 221 114.238 114.238 114.169 0.069 25806 94 1 1 . 1 1 221 221 SER HA H 221 4.026 4.026 4.089 -0.063 25806 95 1 1 . 1 1 221 221 SER C C 221 175.620 175.620 176.290 -0.670 25806 96 1 1 . 1 1 221 221 SER CA C 221 63.606 63.606 61.966 1.640 25806 97 1 1 . 1 1 221 221 SER CB C 221 62.966 62.966 62.937 0.029 25806 98 1 1 . 1 1 221 221 SER H H 221 8.478 8.478 7.979 0.499 25806 99 1 1 . 1 1 222 222 ALA N N 222 124.323 124.323 123.316 1.007 25806 100 1 1 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.182 -0.215 25806 101 1 1 . 1 1 222 222 ALA C C 222 178.799 178.799 179.651 -0.852 25806 102 1 1 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.702 1.094 25806 103 1 1 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.203 -0.199 25806 104 1 1 . 1 1 222 222 ALA H H 222 8.160 8.160 7.457 0.703 25806 105 1 1 . 1 1 223 223 VAL N N 223 116.763 116.763 120.265 -3.502 25806 106 1 1 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.665 -0.131 25806 107 1 1 . 1 1 223 223 VAL C C 223 177.402 177.402 177.934 -0.532 25806 108 1 1 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.636 0.756 25806 109 1 1 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.578 -0.261 25806 110 1 1 . 1 1 223 223 VAL H H 223 8.274 8.274 8.083 0.191 25806 111 1 1 . 1 1 224 224 ILE N N 224 118.686 118.686 117.156 1.530 25806 112 1 1 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.813 -0.180 25806 113 1 1 . 1 1 224 224 ILE C C 224 177.422 177.422 177.629 -0.207 25806 114 1 1 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.823 1.004 25806 115 1 1 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.036 0.265 25806 116 1 1 . 1 1 224 224 ILE H H 224 8.375 8.375 8.307 0.068 25806 117 1 1 . 1 1 225 225 CYS N N 225 116.617 116.617 118.172 -1.555 25806 118 1 1 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.113 -0.095 25806 119 1 1 . 1 1 225 225 CYS C C 225 176.120 176.120 176.900 -0.780 25806 120 1 1 . 1 1 225 225 CYS CA C 225 65.013 65.013 63.235 1.778 25806 121 1 1 . 1 1 225 225 CYS CB C 225 26.856 26.856 27.116 -0.261 25806 122 1 1 . 1 1 225 225 CYS H H 225 8.202 8.202 7.505 0.697 25806 123 1 1 . 1 1 226 226 LEU N N 226 118.552 118.552 121.479 -2.927 25806 124 1 1 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.943 0.073 25806 125 1 1 . 1 1 226 226 LEU C C 226 177.990 177.990 178.547 -0.557 25806 126 1 1 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.284 0.275 25806 127 1 1 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.189 -0.440 25806 128 1 1 . 1 1 226 226 LEU H H 226 8.210 8.210 7.612 0.598 25806 129 1 1 . 1 1 227 227 ILE N N 227 118.243 118.243 117.560 0.683 25806 130 1 1 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.898 -0.074 25806 131 1 1 . 1 1 227 227 ILE C C 227 177.429 177.429 177.889 -0.460 25806 132 1 1 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.362 0.487 25806 133 1 1 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.532 0.010 25806 134 1 1 . 1 1 227 227 ILE H H 227 8.233 8.233 7.950 0.283 25806 135 1 1 . 1 1 228 228 ILE N N 228 118.904 118.904 119.484 -0.580 25806 136 1 1 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.699 -0.003 25806 137 1 1 . 1 1 228 228 ILE C C 228 177.269 177.269 177.644 -0.375 25806 138 1 1 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.172 1.053 25806 139 1 1 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.540 -0.090 25806 140 1 1 . 1 1 228 228 ILE H H 228 8.161 8.161 7.561 0.600 25806 141 1 1 . 1 1 229 229 VAL N N 229 118.028 118.028 118.580 -0.552 25806 142 1 1 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.592 -0.019 25806 143 1 1 . 1 1 229 229 VAL C C 229 177.312 177.312 178.412 -1.100 25806 144 1 1 . 1 1 229 229 VAL CA C 229 67.509 67.509 65.647 1.862 25806 145 1 1 . 1 1 229 229 VAL CB C 229 31.319 31.319 31.405 -0.086 25806 146 1 1 . 1 1 229 229 VAL H H 229 8.366 8.366 7.423 0.943 25806 147 1 1 . 1 1 230 230 TRP N N 230 120.511 120.511 120.060 0.451 25806 148 1 1 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.446 -0.152 25806 149 1 1 . 1 1 230 230 TRP C C 230 177.236 177.236 178.648 -1.412 25806 150 1 1 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.276 0.517 25806 151 1 1 . 1 1 230 230 TRP CB C 230 29.170 29.170 28.907 0.263 25806 152 1 1 . 1 1 230 230 TRP H H 230 8.618 8.618 7.649 0.969 25806 153 1 1 . 1 1 231 231 ALA N N 231 119.679 119.679 121.120 -1.441 25806 154 1 1 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.258 -0.516 25806 155 1 1 . 1 1 231 231 ALA C C 231 179.679 179.679 177.862 1.817 25806 156 1 1 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.605 0.954 25806 157 1 1 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.277 0.198 25806 158 1 1 . 1 1 231 231 ALA H H 231 8.728 8.728 8.561 0.167 25806 159 1 1 . 1 1 232 232 VAL N N 232 115.974 115.974 114.639 1.335 25806 160 1 1 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.228 -0.495 25806 161 1 1 . 1 1 232 232 VAL C C 232 178.103 178.103 175.369 2.734 25806 162 1 1 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.318 3.821 25806 163 1 1 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.943 -1.088 25806 164 1 1 . 1 1 232 232 VAL H H 232 8.453 8.453 7.251 1.202 25806 165 1 1 . 1 1 233 233 ALA N N 233 122.331 122.331 121.866 0.465 25806 166 1 1 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.731 -0.556 25806 167 1 1 . 1 1 233 233 ALA C C 233 179.434 179.434 177.721 1.713 25806 168 1 1 . 1 1 233 233 ALA CA C 233 54.989 54.989 52.918 2.071 25806 169 1 1 . 1 1 233 233 ALA CB C 233 18.603 18.603 20.301 -1.698 25806 170 1 1 . 1 1 233 233 ALA H H 233 8.472 8.472 7.905 0.567 25806 171 1 1 . 1 1 234 234 LEU N N 234 116.926 116.926 117.523 -0.597 25806 172 1 1 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.574 -0.396 25806 173 1 1 . 1 1 234 234 LEU C C 234 179.118 179.118 177.562 1.556 25806 174 1 1 . 1 1 234 234 LEU CA C 234 57.066 57.066 56.008 1.058 25806 175 1 1 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.683 -0.527 25806 176 1 1 . 1 1 234 234 LEU H H 234 8.208 8.208 8.156 0.052 25806 177 1 1 . 1 1 235 235 LYS N N 235 117.891 117.891 120.130 -2.239 25806 178 1 1 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.462 -0.274 25806 179 1 1 . 1 1 235 235 LYS C C 235 178.315 178.315 176.324 1.991 25806 180 1 1 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.307 1.778 25806 181 1 1 . 1 1 235 235 LYS CB C 235 32.014 32.014 33.122 -1.108 25806 182 1 1 . 1 1 235 235 LYS H H 235 7.857 7.857 7.927 -0.070 25806 183 1 1 . 1 1 236 236 GLY N N 236 107.369 107.369 107.384 -0.015 25806 184 1 1 . 1 1 236 236 GLY C C 236 174.493 174.493 174.336 0.157 25806 185 1 1 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.206 1.148 25806 186 1 1 . 1 1 236 236 GLY H H 236 8.243 8.243 8.034 0.209 25806 187 1 1 . 1 1 237 237 TYR N N 237 119.546 119.546 116.740 2.806 25806 188 1 1 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.430 0.071 25806 189 1 1 . 1 1 237 237 TYR C C 237 175.646 175.646 175.275 0.371 25806 190 1 1 . 1 1 237 237 TYR CA C 237 58.961 58.961 59.459 -0.498 25806 191 1 1 . 1 1 237 237 TYR CB C 237 39.006 39.006 38.690 0.316 25806 192 1 1 . 1 1 237 237 TYR H H 237 8.029 8.029 8.285 -0.256 25806 193 1 1 . 1 1 238 238 SER N N 238 115.132 115.132 112.635 2.497 25806 194 1 1 . 1 1 238 238 SER HA H 238 4.472 4.472 4.341 0.131 25806 195 1 1 . 1 1 238 238 SER C C 238 174.318 174.318 173.243 1.075 25806 196 1 1 . 1 1 238 238 SER CA C 238 58.619 58.619 58.078 0.541 25806 197 1 1 . 1 1 238 238 SER CB C 238 63.959 63.959 63.246 0.713 25806 198 1 1 . 1 1 238 238 SER H H 238 7.946 7.946 6.800 1.146 25806 199 1 1 . 1 1 239 239 MET N N 239 121.579 121.579 122.947 -1.368 25806 200 1 1 . 1 1 239 239 MET HA H 239 4.493 4.493 4.511 -0.018 25806 201 1 1 . 1 1 239 239 MET C C 239 175.102 175.102 175.180 -0.078 25806 202 1 1 . 1 1 239 239 MET CA C 239 56.084 56.084 54.173 1.911 25806 203 1 1 . 1 1 239 239 MET CB C 239 33.566 33.566 33.563 0.003 25806 204 1 1 . 1 1 239 239 MET H H 239 8.194 8.194 7.243 0.951 25806 205 1 2 . 1 1 205 205 SER CA C 205 58.498 58.498 58.080 0.418 25806 206 1 2 . 1 1 205 205 SER CB C 205 64.088 64.088 63.100 0.988 25806 207 1 2 . 1 1 206 206 PHE N N 206 121.596 121.596 119.734 1.862 25806 208 1 2 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.628 0.159 25806 209 1 2 . 1 1 206 206 PHE C C 206 175.282 175.282 176.177 -0.895 25806 210 1 2 . 1 1 206 206 PHE CA C 206 57.711 57.711 57.642 0.069 25806 211 1 2 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.458 0.681 25806 212 1 2 . 1 1 206 206 PHE H H 206 8.414 8.414 7.790 0.624 25806 213 1 2 . 1 1 207 207 THR N N 207 116.011 116.011 115.649 0.362 25806 214 1 2 . 1 1 207 207 THR HA H 207 4.442 4.442 4.085 0.357 25806 215 1 2 . 1 1 207 207 THR C C 207 174.188 174.188 174.565 -0.377 25806 216 1 2 . 1 1 207 207 THR CA C 207 61.309 61.309 62.872 -1.563 25806 217 1 2 . 1 1 207 207 THR CB C 207 70.503 70.503 68.974 1.529 25806 218 1 2 . 1 1 207 207 THR H H 207 8.233 8.233 8.587 -0.354 25806 219 1 2 . 1 1 208 208 MET N N 208 121.915 121.915 126.973 -5.058 25806 220 1 2 . 1 1 208 208 MET HA H 208 4.475 4.475 4.397 0.078 25806 221 1 2 . 1 1 208 208 MET C C 208 175.595 175.595 174.785 0.810 25806 222 1 2 . 1 1 208 208 MET CA C 208 55.865 55.865 54.789 1.076 25806 223 1 2 . 1 1 208 208 MET CB C 208 32.987 32.987 30.876 2.111 25806 224 1 2 . 1 1 208 208 MET H H 208 8.474 8.474 8.554 -0.080 25806 225 1 2 . 1 1 209 209 ASN N N 209 119.024 119.024 121.821 -2.797 25806 226 1 2 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.679 0.094 25806 227 1 2 . 1 1 209 209 ASN C C 209 175.125 175.125 175.589 -0.464 25806 228 1 2 . 1 1 209 209 ASN CA C 209 53.389 53.389 54.233 -0.844 25806 229 1 2 . 1 1 209 209 ASN CB C 209 39.165 39.165 39.283 -0.118 25806 230 1 2 . 1 1 209 209 ASN H H 209 8.274 8.274 8.240 0.034 25806 231 1 2 . 1 1 210 210 ASP N N 210 119.941 119.941 121.091 -1.150 25806 232 1 2 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.506 0.047 25806 233 1 2 . 1 1 210 210 ASP C C 210 177.325 177.325 177.741 -0.416 25806 234 1 2 . 1 1 210 210 ASP CA C 210 56.169 56.169 56.342 -0.173 25806 235 1 2 . 1 1 210 210 ASP CB C 210 41.255 41.255 40.657 0.598 25806 236 1 2 . 1 1 210 210 ASP H H 210 8.262 8.262 8.671 -0.409 25806 237 1 2 . 1 1 211 211 THR N N 211 115.882 115.882 116.809 -0.927 25806 238 1 2 . 1 1 211 211 THR HA H 211 4.107 4.107 4.140 -0.033 25806 239 1 2 . 1 1 211 211 THR C C 211 175.855 175.855 176.462 -0.607 25806 240 1 2 . 1 1 211 211 THR CA C 211 65.947 65.947 66.680 -0.733 25806 241 1 2 . 1 1 211 211 THR CB C 211 68.808 68.808 68.857 -0.049 25806 242 1 2 . 1 1 211 211 THR H H 211 8.320 8.320 7.884 0.436 25806 243 1 2 . 1 1 212 212 THR N N 212 115.754 115.754 118.008 -2.254 25806 244 1 2 . 1 1 212 212 THR HA H 212 4.004 4.004 4.022 -0.018 25806 245 1 2 . 1 1 212 212 THR C C 212 177.310 177.310 175.886 1.424 25806 246 1 2 . 1 1 212 212 THR CA C 212 66.199 66.199 66.758 -0.560 25806 247 1 2 . 1 1 212 212 THR CB C 212 68.580 68.580 68.234 0.346 25806 248 1 2 . 1 1 212 212 THR H H 212 8.216 8.216 7.852 0.364 25806 249 1 2 . 1 1 213 213 VAL N N 213 123.471 123.471 120.709 2.762 25806 250 1 2 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.602 0.052 25806 251 1 2 . 1 1 213 213 VAL C C 213 177.157 177.157 177.695 -0.538 25806 252 1 2 . 1 1 213 213 VAL CA C 213 66.937 66.937 65.876 1.061 25806 253 1 2 . 1 1 213 213 VAL CB C 213 31.552 31.552 30.857 0.695 25806 254 1 2 . 1 1 213 213 VAL H H 213 8.090 8.090 7.433 0.657 25806 255 1 2 . 1 1 214 214 TRP N N 214 119.814 119.814 119.133 0.681 25806 256 1 2 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.411 0.010 25806 257 1 2 . 1 1 214 214 TRP C C 214 178.622 178.622 178.799 -0.177 25806 258 1 2 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.521 0.336 25806 259 1 2 . 1 1 214 214 TRP CB C 214 29.477 29.477 28.901 0.575 25806 260 1 2 . 1 1 214 214 TRP H H 214 7.966 7.966 7.826 0.140 25806 261 1 2 . 1 1 215 215 ILE N N 215 118.030 118.030 120.365 -2.335 25806 262 1 2 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.611 0.124 25806 263 1 2 . 1 1 215 215 ILE C C 215 177.589 177.589 178.062 -0.473 25806 264 1 2 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.810 0.500 25806 265 1 2 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.498 0.313 25806 266 1 2 . 1 1 215 215 ILE H H 215 8.388 8.388 7.574 0.814 25806 267 1 2 . 1 1 216 216 SER N N 216 116.314 116.314 115.467 0.847 25806 268 1 2 . 1 1 216 216 SER HA H 216 4.083 4.083 4.203 -0.120 25806 269 1 2 . 1 1 216 216 SER C C 216 175.835 175.835 176.601 -0.766 25806 270 1 2 . 1 1 216 216 SER CA C 216 63.777 63.777 61.824 1.953 25806 271 1 2 . 1 1 216 216 SER CB C 216 62.965 62.965 62.745 0.221 25806 272 1 2 . 1 1 216 216 SER H H 216 8.010 8.010 8.121 -0.111 25806 273 1 2 . 1 1 217 217 VAL N N 217 120.711 120.711 120.937 -0.226 25806 274 1 2 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.816 -0.239 25806 275 1 2 . 1 1 217 217 VAL C C 217 178.640 178.640 177.222 1.418 25806 276 1 2 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.225 1.645 25806 277 1 2 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.611 -0.000 25806 278 1 2 . 1 1 217 217 VAL H H 217 8.381 8.381 7.152 1.229 25806 279 1 2 . 1 1 218 218 ALA N N 218 125.445 125.445 123.322 2.123 25806 280 1 2 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.109 -0.106 25806 281 1 2 . 1 1 218 218 ALA C C 218 178.882 178.882 179.741 -0.859 25806 282 1 2 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.172 0.880 25806 283 1 2 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.216 -0.004 25806 284 1 2 . 1 1 218 218 ALA H H 218 8.565 8.565 8.001 0.564 25806 285 1 2 . 1 1 219 219 VAL N N 219 116.767 116.767 118.150 -1.383 25806 286 1 2 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.579 -0.024 25806 287 1 2 . 1 1 219 219 VAL C C 219 177.632 177.632 177.933 -0.301 25806 288 1 2 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.189 1.119 25806 289 1 2 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.597 -0.186 25806 290 1 2 . 1 1 219 219 VAL H H 219 8.575 8.575 7.608 0.967 25806 291 1 2 . 1 1 220 220 LEU N N 220 118.644 118.644 120.181 -1.537 25806 292 1 2 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.846 0.127 25806 293 1 2 . 1 1 220 220 LEU C C 220 178.641 178.641 179.072 -0.431 25806 294 1 2 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.123 0.404 25806 295 1 2 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.881 1.033 25806 296 1 2 . 1 1 220 220 LEU H H 220 8.434 8.434 7.323 1.111 25806 297 1 2 . 1 1 221 221 SER N N 221 114.238 114.238 114.652 -0.414 25806 298 1 2 . 1 1 221 221 SER HA H 221 4.026 4.026 4.135 -0.109 25806 299 1 2 . 1 1 221 221 SER C C 221 175.620 175.620 176.472 -0.852 25806 300 1 2 . 1 1 221 221 SER CA C 221 63.606 63.606 61.755 1.851 25806 301 1 2 . 1 1 221 221 SER CB C 221 62.966 62.966 62.273 0.693 25806 302 1 2 . 1 1 221 221 SER H H 221 8.478 8.478 7.953 0.525 25806 303 1 2 . 1 1 222 222 ALA N N 222 124.323 124.323 123.725 0.598 25806 304 1 2 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.206 -0.239 25806 305 1 2 . 1 1 222 222 ALA C C 222 178.799 178.799 179.553 -0.754 25806 306 1 2 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.562 1.234 25806 307 1 2 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.282 -0.279 25806 308 1 2 . 1 1 222 222 ALA H H 222 8.160 8.160 7.348 0.812 25806 309 1 2 . 1 1 223 223 VAL N N 223 116.763 116.763 120.148 -3.385 25806 310 1 2 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.576 -0.042 25806 311 1 2 . 1 1 223 223 VAL C C 223 177.402 177.402 177.781 -0.379 25806 312 1 2 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.841 0.552 25806 313 1 2 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.858 -0.541 25806 314 1 2 . 1 1 223 223 VAL H H 223 8.274 8.274 8.052 0.222 25806 315 1 2 . 1 1 224 224 ILE N N 224 118.686 118.686 117.631 1.055 25806 316 1 2 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.823 -0.190 25806 317 1 2 . 1 1 224 224 ILE C C 224 177.422 177.422 177.512 -0.090 25806 318 1 2 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.983 0.844 25806 319 1 2 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.232 0.069 25806 320 1 2 . 1 1 224 224 ILE H H 224 8.375 8.375 8.256 0.119 25806 321 1 2 . 1 1 225 225 CYS N N 225 116.617 116.617 118.930 -2.313 25806 322 1 2 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.252 -0.234 25806 323 1 2 . 1 1 225 225 CYS C C 225 176.120 176.120 176.815 -0.695 25806 324 1 2 . 1 1 225 225 CYS CA C 225 65.013 65.013 61.996 3.017 25806 325 1 2 . 1 1 225 225 CYS CB C 225 26.856 26.856 26.452 0.404 25806 326 1 2 . 1 1 225 225 CYS H H 225 8.202 8.202 7.359 0.843 25806 327 1 2 . 1 1 226 226 LEU N N 226 118.552 118.552 121.741 -3.189 25806 328 1 2 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.956 0.060 25806 329 1 2 . 1 1 226 226 LEU C C 226 177.990 177.990 179.064 -1.074 25806 330 1 2 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.703 -0.144 25806 331 1 2 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.102 -0.353 25806 332 1 2 . 1 1 226 226 LEU H H 226 8.210 8.210 7.612 0.598 25806 333 1 2 . 1 1 227 227 ILE N N 227 118.243 118.243 117.346 0.897 25806 334 1 2 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.882 -0.058 25806 335 1 2 . 1 1 227 227 ILE C C 227 177.429 177.429 177.955 -0.526 25806 336 1 2 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.349 0.500 25806 337 1 2 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.550 -0.007 25806 338 1 2 . 1 1 227 227 ILE H H 227 8.233 8.233 8.122 0.111 25806 339 1 2 . 1 1 228 228 ILE N N 228 118.904 118.904 119.841 -0.937 25806 340 1 2 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.715 -0.019 25806 341 1 2 . 1 1 228 228 ILE C C 228 177.269 177.269 178.003 -0.734 25806 342 1 2 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.261 0.964 25806 343 1 2 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.497 -0.047 25806 344 1 2 . 1 1 228 228 ILE H H 228 8.161 8.161 7.662 0.499 25806 345 1 2 . 1 1 229 229 VAL N N 229 118.028 118.028 118.799 -0.771 25806 346 1 2 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.605 -0.032 25806 347 1 2 . 1 1 229 229 VAL C C 229 177.312 177.312 178.571 -1.259 25806 348 1 2 . 1 1 229 229 VAL CA C 229 67.509 67.509 66.024 1.485 25806 349 1 2 . 1 1 229 229 VAL CB C 229 31.319 31.319 30.820 0.499 25806 350 1 2 . 1 1 229 229 VAL H H 229 8.366 8.366 7.434 0.932 25806 351 1 2 . 1 1 230 230 TRP N N 230 120.511 120.511 120.591 -0.080 25806 352 1 2 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.424 -0.130 25806 353 1 2 . 1 1 230 230 TRP C C 230 177.236 177.236 177.896 -0.660 25806 354 1 2 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.434 0.359 25806 355 1 2 . 1 1 230 230 TRP CB C 230 29.170 29.170 28.983 0.187 25806 356 1 2 . 1 1 230 230 TRP H H 230 8.618 8.618 7.639 0.979 25806 357 1 2 . 1 1 231 231 ALA N N 231 119.679 119.679 119.342 0.337 25806 358 1 2 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.238 -0.496 25806 359 1 2 . 1 1 231 231 ALA C C 231 179.679 179.679 178.153 1.526 25806 360 1 2 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.589 0.970 25806 361 1 2 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.442 0.033 25806 362 1 2 . 1 1 231 231 ALA H H 231 8.728 8.728 8.436 0.292 25806 363 1 2 . 1 1 232 232 VAL N N 232 115.974 115.974 115.106 0.868 25806 364 1 2 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.254 -0.521 25806 365 1 2 . 1 1 232 232 VAL C C 232 178.103 178.103 175.124 2.979 25806 366 1 2 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.474 3.664 25806 367 1 2 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.904 -1.049 25806 368 1 2 . 1 1 232 232 VAL H H 232 8.453 8.453 7.260 1.193 25806 369 1 2 . 1 1 233 233 ALA N N 233 122.331 122.331 122.112 0.219 25806 370 1 2 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.815 -0.640 25806 371 1 2 . 1 1 233 233 ALA C C 233 179.434 179.434 177.761 1.673 25806 372 1 2 . 1 1 233 233 ALA CA C 233 54.989 54.989 53.135 1.854 25806 373 1 2 . 1 1 233 233 ALA CB C 233 18.603 18.603 19.865 -1.262 25806 374 1 2 . 1 1 233 233 ALA H H 233 8.472 8.472 7.787 0.685 25806 375 1 2 . 1 1 234 234 LEU N N 234 116.926 116.926 117.543 -0.617 25806 376 1 2 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.536 -0.358 25806 377 1 2 . 1 1 234 234 LEU C C 234 179.118 179.118 177.606 1.512 25806 378 1 2 . 1 1 234 234 LEU CA C 234 57.066 57.066 56.138 0.928 25806 379 1 2 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.540 -0.384 25806 380 1 2 . 1 1 234 234 LEU H H 234 8.208 8.208 8.204 0.004 25806 381 1 2 . 1 1 235 235 LYS N N 235 117.891 117.891 120.234 -2.343 25806 382 1 2 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.442 -0.254 25806 383 1 2 . 1 1 235 235 LYS C C 235 178.315 178.315 176.389 1.926 25806 384 1 2 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.536 1.549 25806 385 1 2 . 1 1 235 235 LYS CB C 235 32.014 32.014 33.388 -1.374 25806 386 1 2 . 1 1 235 235 LYS H H 235 7.857 7.857 7.940 -0.083 25806 387 1 2 . 1 1 236 236 GLY N N 236 107.369 107.369 107.547 -0.178 25806 388 1 2 . 1 1 236 236 GLY C C 236 174.493 174.493 174.319 0.174 25806 389 1 2 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.101 1.253 25806 390 1 2 . 1 1 236 236 GLY H H 236 8.243 8.243 7.933 0.310 25806 391 1 2 . 1 1 237 237 TYR N N 237 119.546 119.546 117.329 2.217 25806 392 1 2 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.382 0.119 25806 393 1 2 . 1 1 237 237 TYR C C 237 175.646 175.646 175.035 0.611 25806 394 1 2 . 1 1 237 237 TYR CA C 237 58.961 58.961 59.374 -0.413 25806 395 1 2 . 1 1 237 237 TYR CB C 237 39.006 39.006 38.727 0.279 25806 396 1 2 . 1 1 237 237 TYR H H 237 8.029 8.029 8.331 -0.302 25806 397 1 2 . 1 1 238 238 SER N N 238 115.132 115.132 113.541 1.591 25806 398 1 2 . 1 1 238 238 SER HA H 238 4.472 4.472 4.291 0.181 25806 399 1 2 . 1 1 238 238 SER C C 238 174.318 174.318 173.233 1.085 25806 400 1 2 . 1 1 238 238 SER CA C 238 58.619 58.619 58.113 0.506 25806 401 1 2 . 1 1 238 238 SER CB C 238 63.959 63.959 62.985 0.974 25806 402 1 2 . 1 1 238 238 SER H H 238 7.946 7.946 7.074 0.872 25806 403 1 2 . 1 1 239 239 MET N N 239 121.579 121.579 123.831 -2.252 25806 404 1 2 . 1 1 239 239 MET HA H 239 4.493 4.493 4.574 -0.081 25806 405 1 2 . 1 1 239 239 MET C C 239 175.102 175.102 175.338 -0.236 25806 406 1 2 . 1 1 239 239 MET CA C 239 56.084 56.084 54.749 1.335 25806 407 1 2 . 1 1 239 239 MET CB C 239 33.566 33.566 35.066 -1.500 25806 408 1 2 . 1 1 239 239 MET H H 239 8.194 8.194 7.540 0.654 25806 409 1 3 . 1 1 205 205 SER CA C 205 58.498 58.498 57.228 1.270 25806 410 1 3 . 1 1 205 205 SER CB C 205 64.088 64.088 64.755 -0.667 25806 411 1 3 . 1 1 206 206 PHE N N 206 121.596 121.596 119.349 2.247 25806 412 1 3 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.869 -0.082 25806 413 1 3 . 1 1 206 206 PHE C C 206 175.282 175.282 175.083 0.199 25806 414 1 3 . 1 1 206 206 PHE CA C 206 57.711 57.711 58.232 -0.521 25806 415 1 3 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.958 0.181 25806 416 1 3 . 1 1 206 206 PHE H H 206 8.414 8.414 8.718 -0.304 25806 417 1 3 . 1 1 207 207 THR N N 207 116.011 116.011 114.035 1.976 25806 418 1 3 . 1 1 207 207 THR HA H 207 4.442 4.442 4.471 -0.029 25806 419 1 3 . 1 1 207 207 THR C C 207 174.188 174.188 175.305 -1.117 25806 420 1 3 . 1 1 207 207 THR CA C 207 61.309 61.309 62.406 -1.097 25806 421 1 3 . 1 1 207 207 THR CB C 207 70.503 70.503 70.719 -0.215 25806 422 1 3 . 1 1 207 207 THR H H 207 8.233 8.233 8.034 0.199 25806 423 1 3 . 1 1 208 208 MET N N 208 121.915 121.915 118.516 3.399 25806 424 1 3 . 1 1 208 208 MET HA H 208 4.475 4.475 4.533 -0.058 25806 425 1 3 . 1 1 208 208 MET C C 208 175.595 175.595 175.112 0.483 25806 426 1 3 . 1 1 208 208 MET CA C 208 55.865 55.865 56.048 -0.183 25806 427 1 3 . 1 1 208 208 MET CB C 208 32.987 32.987 33.859 -0.872 25806 428 1 3 . 1 1 208 208 MET H H 208 8.474 8.474 7.962 0.512 25806 429 1 3 . 1 1 209 209 ASN N N 209 119.024 119.024 115.800 3.224 25806 430 1 3 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.663 0.110 25806 431 1 3 . 1 1 209 209 ASN C C 209 175.125 175.125 173.836 1.289 25806 432 1 3 . 1 1 209 209 ASN CA C 209 53.389 53.389 53.669 -0.280 25806 433 1 3 . 1 1 209 209 ASN CB C 209 39.165 39.165 39.452 -0.287 25806 434 1 3 . 1 1 209 209 ASN H H 209 8.274 8.274 8.171 0.103 25806 435 1 3 . 1 1 210 210 ASP N N 210 119.941 119.941 117.824 2.117 25806 436 1 3 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.922 -0.369 25806 437 1 3 . 1 1 210 210 ASP C C 210 177.325 177.325 176.451 0.874 25806 438 1 3 . 1 1 210 210 ASP CA C 210 56.169 56.169 54.114 2.055 25806 439 1 3 . 1 1 210 210 ASP CB C 210 41.255 41.255 41.948 -0.693 25806 440 1 3 . 1 1 210 210 ASP H H 210 8.262 8.262 8.481 -0.219 25806 441 1 3 . 1 1 211 211 THR N N 211 115.882 115.882 116.395 -0.513 25806 442 1 3 . 1 1 211 211 THR HA H 211 4.107 4.107 4.324 -0.217 25806 443 1 3 . 1 1 211 211 THR C C 211 175.855 175.855 176.661 -0.806 25806 444 1 3 . 1 1 211 211 THR CA C 211 65.947 65.947 65.805 0.143 25806 445 1 3 . 1 1 211 211 THR CB C 211 68.808 68.808 68.781 0.027 25806 446 1 3 . 1 1 211 211 THR H H 211 8.320 8.320 8.121 0.199 25806 447 1 3 . 1 1 212 212 THR N N 212 115.754 115.754 117.318 -1.564 25806 448 1 3 . 1 1 212 212 THR HA H 212 4.004 4.004 4.114 -0.110 25806 449 1 3 . 1 1 212 212 THR C C 212 177.310 177.310 176.215 1.095 25806 450 1 3 . 1 1 212 212 THR CA C 212 66.199 66.199 65.968 0.231 25806 451 1 3 . 1 1 212 212 THR CB C 212 68.580 68.580 67.906 0.674 25806 452 1 3 . 1 1 212 212 THR H H 212 8.216 8.216 8.386 -0.170 25806 453 1 3 . 1 1 213 213 VAL N N 213 123.471 123.471 120.673 2.798 25806 454 1 3 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.661 -0.007 25806 455 1 3 . 1 1 213 213 VAL C C 213 177.157 177.157 177.612 -0.455 25806 456 1 3 . 1 1 213 213 VAL CA C 213 66.937 66.937 66.237 0.700 25806 457 1 3 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.079 0.473 25806 458 1 3 . 1 1 213 213 VAL H H 213 8.090 8.090 7.313 0.777 25806 459 1 3 . 1 1 214 214 TRP N N 214 119.814 119.814 118.435 1.379 25806 460 1 3 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.528 -0.107 25806 461 1 3 . 1 1 214 214 TRP C C 214 178.622 178.622 178.568 0.054 25806 462 1 3 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.363 0.494 25806 463 1 3 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.326 0.151 25806 464 1 3 . 1 1 214 214 TRP H H 214 7.966 7.966 7.963 0.003 25806 465 1 3 . 1 1 215 215 ILE N N 215 118.030 118.030 120.682 -2.652 25806 466 1 3 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.625 0.110 25806 467 1 3 . 1 1 215 215 ILE C C 215 177.589 177.589 178.045 -0.456 25806 468 1 3 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.761 0.549 25806 469 1 3 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.555 0.256 25806 470 1 3 . 1 1 215 215 ILE H H 215 8.388 8.388 7.512 0.876 25806 471 1 3 . 1 1 216 216 SER N N 216 116.314 116.314 115.050 1.264 25806 472 1 3 . 1 1 216 216 SER HA H 216 4.083 4.083 4.218 -0.135 25806 473 1 3 . 1 1 216 216 SER C C 216 175.835 175.835 176.884 -1.049 25806 474 1 3 . 1 1 216 216 SER CA C 216 63.777 63.777 61.665 2.112 25806 475 1 3 . 1 1 216 216 SER CB C 216 62.965 62.965 62.737 0.228 25806 476 1 3 . 1 1 216 216 SER H H 216 8.010 8.010 8.109 -0.099 25806 477 1 3 . 1 1 217 217 VAL N N 217 120.711 120.711 120.984 -0.273 25806 478 1 3 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.757 -0.180 25806 479 1 3 . 1 1 217 217 VAL C C 217 178.640 178.640 177.133 1.507 25806 480 1 3 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.481 1.389 25806 481 1 3 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.579 0.032 25806 482 1 3 . 1 1 217 217 VAL H H 217 8.381 8.381 7.389 0.992 25806 483 1 3 . 1 1 218 218 ALA N N 218 125.445 125.445 123.158 2.287 25806 484 1 3 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.094 -0.091 25806 485 1 3 . 1 1 218 218 ALA C C 218 178.882 178.882 179.606 -0.724 25806 486 1 3 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.212 0.839 25806 487 1 3 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.360 -0.148 25806 488 1 3 . 1 1 218 218 ALA H H 218 8.565 8.565 7.943 0.622 25806 489 1 3 . 1 1 219 219 VAL N N 219 116.767 116.767 118.088 -1.321 25806 490 1 3 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.718 -0.163 25806 491 1 3 . 1 1 219 219 VAL C C 219 177.632 177.632 177.971 -0.339 25806 492 1 3 . 1 1 219 219 VAL CA C 219 67.308 67.308 65.835 1.473 25806 493 1 3 . 1 1 219 219 VAL CB C 219 31.411 31.411 30.943 0.468 25806 494 1 3 . 1 1 219 219 VAL H H 219 8.575 8.575 7.597 0.978 25806 495 1 3 . 1 1 220 220 LEU N N 220 118.644 118.644 120.332 -1.688 25806 496 1 3 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.833 0.140 25806 497 1 3 . 1 1 220 220 LEU C C 220 178.641 178.641 179.156 -0.515 25806 498 1 3 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.417 0.110 25806 499 1 3 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.781 1.133 25806 500 1 3 . 1 1 220 220 LEU H H 220 8.434 8.434 7.422 1.012 25806 501 1 3 . 1 1 221 221 SER N N 221 114.238 114.238 114.413 -0.175 25806 502 1 3 . 1 1 221 221 SER HA H 221 4.026 4.026 4.113 -0.087 25806 503 1 3 . 1 1 221 221 SER C C 221 175.620 175.620 176.660 -1.040 25806 504 1 3 . 1 1 221 221 SER CA C 221 63.606 63.606 62.047 1.560 25806 505 1 3 . 1 1 221 221 SER CB C 221 62.966 62.966 62.668 0.298 25806 506 1 3 . 1 1 221 221 SER H H 221 8.478 8.478 7.983 0.495 25806 507 1 3 . 1 1 222 222 ALA N N 222 124.323 124.323 123.830 0.493 25806 508 1 3 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.194 -0.227 25806 509 1 3 . 1 1 222 222 ALA C C 222 178.799 178.799 179.701 -0.902 25806 510 1 3 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.674 1.122 25806 511 1 3 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.254 -0.251 25806 512 1 3 . 1 1 222 222 ALA H H 222 8.160 8.160 7.478 0.682 25806 513 1 3 . 1 1 223 223 VAL N N 223 116.763 116.763 120.238 -3.475 25806 514 1 3 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.659 -0.125 25806 515 1 3 . 1 1 223 223 VAL C C 223 177.402 177.402 177.939 -0.537 25806 516 1 3 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.694 0.700 25806 517 1 3 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.583 -0.266 25806 518 1 3 . 1 1 223 223 VAL H H 223 8.274 8.274 8.092 0.182 25806 519 1 3 . 1 1 224 224 ILE N N 224 118.686 118.686 117.275 1.411 25806 520 1 3 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.823 -0.190 25806 521 1 3 . 1 1 224 224 ILE C C 224 177.422 177.422 177.670 -0.248 25806 522 1 3 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.955 0.872 25806 523 1 3 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.050 0.251 25806 524 1 3 . 1 1 224 224 ILE H H 224 8.375 8.375 8.278 0.097 25806 525 1 3 . 1 1 225 225 CYS N N 225 116.617 116.617 118.137 -1.520 25806 526 1 3 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.223 -0.205 25806 527 1 3 . 1 1 225 225 CYS C C 225 176.120 176.120 176.806 -0.686 25806 528 1 3 . 1 1 225 225 CYS CA C 225 65.013 65.013 62.582 2.431 25806 529 1 3 . 1 1 225 225 CYS CB C 225 26.856 26.856 26.046 0.810 25806 530 1 3 . 1 1 225 225 CYS H H 225 8.202 8.202 7.646 0.556 25806 531 1 3 . 1 1 226 226 LEU N N 226 118.552 118.552 121.445 -2.893 25806 532 1 3 . 1 1 226 226 LEU HA H 226 4.016 4.016 4.002 0.014 25806 533 1 3 . 1 1 226 226 LEU C C 226 177.990 177.990 178.682 -0.692 25806 534 1 3 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.213 0.346 25806 535 1 3 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.184 -0.435 25806 536 1 3 . 1 1 226 226 LEU H H 226 8.210 8.210 7.602 0.608 25806 537 1 3 . 1 1 227 227 ILE N N 227 118.243 118.243 117.682 0.561 25806 538 1 3 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.910 -0.086 25806 539 1 3 . 1 1 227 227 ILE C C 227 177.429 177.429 177.846 -0.417 25806 540 1 3 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.400 0.449 25806 541 1 3 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.556 -0.014 25806 542 1 3 . 1 1 227 227 ILE H H 227 8.233 8.233 7.982 0.251 25806 543 1 3 . 1 1 228 228 ILE N N 228 118.904 118.904 119.861 -0.957 25806 544 1 3 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.673 0.023 25806 545 1 3 . 1 1 228 228 ILE C C 228 177.269 177.269 178.058 -0.789 25806 546 1 3 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.196 1.029 25806 547 1 3 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.435 0.015 25806 548 1 3 . 1 1 228 228 ILE H H 228 8.161 8.161 7.578 0.583 25806 549 1 3 . 1 1 229 229 VAL N N 229 118.028 118.028 119.236 -1.208 25806 550 1 3 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.549 0.024 25806 551 1 3 . 1 1 229 229 VAL C C 229 177.312 177.312 178.435 -1.123 25806 552 1 3 . 1 1 229 229 VAL CA C 229 67.509 67.509 65.925 1.584 25806 553 1 3 . 1 1 229 229 VAL CB C 229 31.319 31.319 31.283 0.036 25806 554 1 3 . 1 1 229 229 VAL H H 229 8.366 8.366 7.355 1.011 25806 555 1 3 . 1 1 230 230 TRP N N 230 120.511 120.511 120.289 0.222 25806 556 1 3 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.426 -0.132 25806 557 1 3 . 1 1 230 230 TRP C C 230 177.236 177.236 177.965 -0.729 25806 558 1 3 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.318 0.475 25806 559 1 3 . 1 1 230 230 TRP CB C 230 29.170 29.170 29.185 -0.015 25806 560 1 3 . 1 1 230 230 TRP H H 230 8.618 8.618 7.557 1.061 25806 561 1 3 . 1 1 231 231 ALA N N 231 119.679 119.679 119.453 0.226 25806 562 1 3 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.229 -0.487 25806 563 1 3 . 1 1 231 231 ALA C C 231 179.679 179.679 178.282 1.397 25806 564 1 3 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.572 0.987 25806 565 1 3 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.600 -0.125 25806 566 1 3 . 1 1 231 231 ALA H H 231 8.728 8.728 8.517 0.211 25806 567 1 3 . 1 1 232 232 VAL N N 232 115.974 115.974 114.926 1.048 25806 568 1 3 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.294 -0.561 25806 569 1 3 . 1 1 232 232 VAL C C 232 178.103 178.103 175.770 2.333 25806 570 1 3 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.171 3.967 25806 571 1 3 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.655 -0.800 25806 572 1 3 . 1 1 232 232 VAL H H 232 8.453 8.453 7.296 1.157 25806 573 1 3 . 1 1 233 233 ALA N N 233 122.331 122.331 121.949 0.382 25806 574 1 3 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.705 -0.530 25806 575 1 3 . 1 1 233 233 ALA C C 233 179.434 179.434 177.736 1.698 25806 576 1 3 . 1 1 233 233 ALA CA C 233 54.989 54.989 52.938 2.051 25806 577 1 3 . 1 1 233 233 ALA CB C 233 18.603 18.603 20.409 -1.806 25806 578 1 3 . 1 1 233 233 ALA H H 233 8.472 8.472 7.804 0.668 25806 579 1 3 . 1 1 234 234 LEU N N 234 116.926 116.926 117.557 -0.631 25806 580 1 3 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.489 -0.311 25806 581 1 3 . 1 1 234 234 LEU C C 234 179.118 179.118 177.609 1.509 25806 582 1 3 . 1 1 234 234 LEU CA C 234 57.066 57.066 55.978 1.088 25806 583 1 3 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.722 -0.566 25806 584 1 3 . 1 1 234 234 LEU H H 234 8.208 8.208 8.039 0.169 25806 585 1 3 . 1 1 235 235 LYS N N 235 117.891 117.891 119.979 -2.088 25806 586 1 3 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.476 -0.287 25806 587 1 3 . 1 1 235 235 LYS C C 235 178.315 178.315 176.520 1.795 25806 588 1 3 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.605 1.480 25806 589 1 3 . 1 1 235 235 LYS CB C 235 32.014 32.014 33.068 -1.054 25806 590 1 3 . 1 1 235 235 LYS H H 235 7.857 7.857 7.950 -0.093 25806 591 1 3 . 1 1 236 236 GLY N N 236 107.369 107.369 107.843 -0.474 25806 592 1 3 . 1 1 236 236 GLY C C 236 174.493 174.493 174.820 -0.327 25806 593 1 3 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.732 0.622 25806 594 1 3 . 1 1 236 236 GLY H H 236 8.243 8.243 8.114 0.129 25806 595 1 3 . 1 1 237 237 TYR N N 237 119.546 119.546 120.369 -0.823 25806 596 1 3 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.339 0.162 25806 597 1 3 . 1 1 237 237 TYR C C 237 175.646 175.646 176.123 -0.477 25806 598 1 3 . 1 1 237 237 TYR CA C 237 58.961 58.961 56.454 2.507 25806 599 1 3 . 1 1 237 237 TYR CB C 237 39.006 39.006 38.193 0.813 25806 600 1 3 . 1 1 237 237 TYR H H 237 8.029 8.029 8.403 -0.374 25806 601 1 3 . 1 1 238 238 SER N N 238 115.132 115.132 116.112 -0.980 25806 602 1 3 . 1 1 238 238 SER HA H 238 4.472 4.472 4.017 0.455 25806 603 1 3 . 1 1 238 238 SER C C 238 174.318 174.318 174.665 -0.347 25806 604 1 3 . 1 1 238 238 SER CA C 238 58.619 58.619 59.494 -0.875 25806 605 1 3 . 1 1 238 238 SER CB C 238 63.959 63.959 62.607 1.352 25806 606 1 3 . 1 1 238 238 SER H H 238 7.946 7.946 8.050 -0.104 25806 607 1 3 . 1 1 239 239 MET N N 239 121.579 121.579 121.120 0.459 25806 608 1 3 . 1 1 239 239 MET HA H 239 4.493 4.493 4.588 -0.095 25806 609 1 3 . 1 1 239 239 MET C C 239 175.102 175.102 175.676 -0.574 25806 610 1 3 . 1 1 239 239 MET CA C 239 56.084 56.084 54.628 1.456 25806 611 1 3 . 1 1 239 239 MET CB C 239 33.566 33.566 33.240 0.326 25806 612 1 3 . 1 1 239 239 MET H H 239 8.194 8.194 7.599 0.595 25806 613 1 4 . 1 1 205 205 SER CA C 205 58.498 58.498 57.402 1.096 25806 614 1 4 . 1 1 205 205 SER CB C 205 64.088 64.088 63.374 0.714 25806 615 1 4 . 1 1 206 206 PHE N N 206 121.596 121.596 123.193 -1.597 25806 616 1 4 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.484 0.303 25806 617 1 4 . 1 1 206 206 PHE C C 206 175.282 175.282 175.562 -0.280 25806 618 1 4 . 1 1 206 206 PHE CA C 206 57.711 57.711 57.721 -0.010 25806 619 1 4 . 1 1 206 206 PHE CB C 206 40.139 40.139 38.988 1.151 25806 620 1 4 . 1 1 206 206 PHE H H 206 8.414 8.414 8.536 -0.122 25806 621 1 4 . 1 1 207 207 THR N N 207 116.011 116.011 110.267 5.744 25806 622 1 4 . 1 1 207 207 THR HA H 207 4.442 4.442 3.938 0.504 25806 623 1 4 . 1 1 207 207 THR C C 207 174.188 174.188 173.986 0.202 25806 624 1 4 . 1 1 207 207 THR CA C 207 61.309 61.309 62.302 -0.993 25806 625 1 4 . 1 1 207 207 THR CB C 207 70.503 70.503 67.939 2.563 25806 626 1 4 . 1 1 207 207 THR H H 207 8.233 8.233 7.718 0.515 25806 627 1 4 . 1 1 208 208 MET N N 208 121.915 121.915 120.744 1.171 25806 628 1 4 . 1 1 208 208 MET HA H 208 4.475 4.475 4.541 -0.066 25806 629 1 4 . 1 1 208 208 MET C C 208 175.595 175.595 175.113 0.482 25806 630 1 4 . 1 1 208 208 MET CA C 208 55.865 55.865 56.268 -0.403 25806 631 1 4 . 1 1 208 208 MET CB C 208 32.987 32.987 33.652 -0.665 25806 632 1 4 . 1 1 208 208 MET H H 208 8.474 8.474 7.933 0.541 25806 633 1 4 . 1 1 209 209 ASN N N 209 119.024 119.024 121.229 -2.205 25806 634 1 4 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.999 -0.226 25806 635 1 4 . 1 1 209 209 ASN C C 209 175.125 175.125 174.217 0.908 25806 636 1 4 . 1 1 209 209 ASN CA C 209 53.389 53.389 52.457 0.932 25806 637 1 4 . 1 1 209 209 ASN CB C 209 39.165 39.165 40.834 -1.669 25806 638 1 4 . 1 1 209 209 ASN H H 209 8.274 8.274 8.512 -0.238 25806 639 1 4 . 1 1 210 210 ASP N N 210 119.941 119.941 123.481 -3.540 25806 640 1 4 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.628 -0.075 25806 641 1 4 . 1 1 210 210 ASP C C 210 177.325 177.325 175.959 1.366 25806 642 1 4 . 1 1 210 210 ASP CA C 210 56.169 56.169 55.420 0.749 25806 643 1 4 . 1 1 210 210 ASP CB C 210 41.255 41.255 40.215 1.040 25806 644 1 4 . 1 1 210 210 ASP H H 210 8.262 8.262 8.736 -0.474 25806 645 1 4 . 1 1 211 211 THR N N 211 115.882 115.882 118.358 -2.476 25806 646 1 4 . 1 1 211 211 THR HA H 211 4.107 4.107 4.592 -0.485 25806 647 1 4 . 1 1 211 211 THR C C 211 175.855 175.855 176.495 -0.640 25806 648 1 4 . 1 1 211 211 THR CA C 211 65.947 65.947 64.869 1.078 25806 649 1 4 . 1 1 211 211 THR CB C 211 68.808 68.808 69.585 -0.778 25806 650 1 4 . 1 1 211 211 THR H H 211 8.320 8.320 8.008 0.312 25806 651 1 4 . 1 1 212 212 THR N N 212 115.754 115.754 118.910 -3.156 25806 652 1 4 . 1 1 212 212 THR HA H 212 4.004 4.004 4.093 -0.089 25806 653 1 4 . 1 1 212 212 THR C C 212 177.310 177.310 175.982 1.328 25806 654 1 4 . 1 1 212 212 THR CA C 212 66.199 66.199 66.500 -0.301 25806 655 1 4 . 1 1 212 212 THR CB C 212 68.580 68.580 68.399 0.181 25806 656 1 4 . 1 1 212 212 THR H H 212 8.216 8.216 8.650 -0.434 25806 657 1 4 . 1 1 213 213 VAL N N 213 123.471 123.471 120.261 3.210 25806 658 1 4 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.652 0.002 25806 659 1 4 . 1 1 213 213 VAL C C 213 177.157 177.157 177.499 -0.342 25806 660 1 4 . 1 1 213 213 VAL CA C 213 66.937 66.937 66.156 0.781 25806 661 1 4 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.230 0.322 25806 662 1 4 . 1 1 213 213 VAL H H 213 8.090 8.090 8.019 0.071 25806 663 1 4 . 1 1 214 214 TRP N N 214 119.814 119.814 118.571 1.243 25806 664 1 4 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.517 -0.096 25806 665 1 4 . 1 1 214 214 TRP C C 214 178.622 178.622 178.557 0.065 25806 666 1 4 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.020 0.837 25806 667 1 4 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.534 -0.057 25806 668 1 4 . 1 1 214 214 TRP H H 214 7.966 7.966 7.845 0.121 25806 669 1 4 . 1 1 215 215 ILE N N 215 118.030 118.030 121.001 -2.971 25806 670 1 4 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.584 0.151 25806 671 1 4 . 1 1 215 215 ILE C C 215 177.589 177.589 177.808 -0.219 25806 672 1 4 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.701 0.609 25806 673 1 4 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.617 0.195 25806 674 1 4 . 1 1 215 215 ILE H H 215 8.388 8.388 7.820 0.568 25806 675 1 4 . 1 1 216 216 SER N N 216 116.314 116.314 115.034 1.280 25806 676 1 4 . 1 1 216 216 SER HA H 216 4.083 4.083 4.173 -0.090 25806 677 1 4 . 1 1 216 216 SER C C 216 175.835 175.835 176.912 -1.077 25806 678 1 4 . 1 1 216 216 SER CA C 216 63.777 63.777 61.918 1.859 25806 679 1 4 . 1 1 216 216 SER CB C 216 62.965 62.965 63.027 -0.062 25806 680 1 4 . 1 1 216 216 SER H H 216 8.010 8.010 7.867 0.143 25806 681 1 4 . 1 1 217 217 VAL N N 217 120.711 120.711 120.785 -0.074 25806 682 1 4 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.870 -0.293 25806 683 1 4 . 1 1 217 217 VAL C C 217 178.640 178.640 177.486 1.154 25806 684 1 4 . 1 1 217 217 VAL CA C 217 66.870 66.870 64.546 2.324 25806 685 1 4 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.211 0.400 25806 686 1 4 . 1 1 217 217 VAL H H 217 8.381 8.381 7.243 1.138 25806 687 1 4 . 1 1 218 218 ALA N N 218 125.445 125.445 123.547 1.898 25806 688 1 4 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.088 -0.085 25806 689 1 4 . 1 1 218 218 ALA C C 218 178.882 178.882 179.786 -0.904 25806 690 1 4 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.299 0.753 25806 691 1 4 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.327 -0.115 25806 692 1 4 . 1 1 218 218 ALA H H 218 8.565 8.565 8.221 0.344 25806 693 1 4 . 1 1 219 219 VAL N N 219 116.767 116.767 118.237 -1.470 25806 694 1 4 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.690 -0.135 25806 695 1 4 . 1 1 219 219 VAL C C 219 177.632 177.632 177.632 0.000 25806 696 1 4 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.433 0.875 25806 697 1 4 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.446 -0.035 25806 698 1 4 . 1 1 219 219 VAL H H 219 8.575 8.575 7.596 0.979 25806 699 1 4 . 1 1 220 220 LEU N N 220 118.644 118.644 120.640 -1.996 25806 700 1 4 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.853 0.120 25806 701 1 4 . 1 1 220 220 LEU C C 220 178.641 178.641 179.008 -0.367 25806 702 1 4 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.383 0.144 25806 703 1 4 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.792 1.122 25806 704 1 4 . 1 1 220 220 LEU H H 220 8.434 8.434 7.287 1.147 25806 705 1 4 . 1 1 221 221 SER N N 221 114.238 114.238 114.723 -0.485 25806 706 1 4 . 1 1 221 221 SER HA H 221 4.026 4.026 4.116 -0.090 25806 707 1 4 . 1 1 221 221 SER C C 221 175.620 175.620 176.703 -1.083 25806 708 1 4 . 1 1 221 221 SER CA C 221 63.606 63.606 61.806 1.800 25806 709 1 4 . 1 1 221 221 SER CB C 221 62.966 62.966 62.245 0.721 25806 710 1 4 . 1 1 221 221 SER H H 221 8.478 8.478 8.034 0.444 25806 711 1 4 . 1 1 222 222 ALA N N 222 124.323 124.323 123.810 0.513 25806 712 1 4 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.163 -0.196 25806 713 1 4 . 1 1 222 222 ALA C C 222 178.799 178.799 179.580 -0.781 25806 714 1 4 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.834 0.962 25806 715 1 4 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.309 -0.306 25806 716 1 4 . 1 1 222 222 ALA H H 222 8.160 8.160 7.276 0.884 25806 717 1 4 . 1 1 223 223 VAL N N 223 116.763 116.763 120.064 -3.301 25806 718 1 4 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.658 -0.124 25806 719 1 4 . 1 1 223 223 VAL C C 223 177.402 177.402 178.032 -0.630 25806 720 1 4 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.801 0.592 25806 721 1 4 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.645 -0.328 25806 722 1 4 . 1 1 223 223 VAL H H 223 8.274 8.274 8.156 0.118 25806 723 1 4 . 1 1 224 224 ILE N N 224 118.686 118.686 117.086 1.600 25806 724 1 4 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.822 -0.189 25806 725 1 4 . 1 1 224 224 ILE C C 224 177.422 177.422 177.511 -0.089 25806 726 1 4 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.775 1.052 25806 727 1 4 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.181 0.120 25806 728 1 4 . 1 1 224 224 ILE H H 224 8.375 8.375 8.378 -0.003 25806 729 1 4 . 1 1 225 225 CYS N N 225 116.617 116.617 119.172 -2.555 25806 730 1 4 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.131 -0.113 25806 731 1 4 . 1 1 225 225 CYS C C 225 176.120 176.120 176.624 -0.504 25806 732 1 4 . 1 1 225 225 CYS CA C 225 65.013 65.013 63.513 1.500 25806 733 1 4 . 1 1 225 225 CYS CB C 225 26.856 26.856 27.330 -0.474 25806 734 1 4 . 1 1 225 225 CYS H H 225 8.202 8.202 7.424 0.778 25806 735 1 4 . 1 1 226 226 LEU N N 226 118.552 118.552 121.454 -2.902 25806 736 1 4 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.899 0.117 25806 737 1 4 . 1 1 226 226 LEU C C 226 177.990 177.990 178.858 -0.868 25806 738 1 4 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.740 -0.181 25806 739 1 4 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.062 -0.313 25806 740 1 4 . 1 1 226 226 LEU H H 226 8.210 8.210 7.830 0.380 25806 741 1 4 . 1 1 227 227 ILE N N 227 118.243 118.243 117.045 1.198 25806 742 1 4 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.943 -0.119 25806 743 1 4 . 1 1 227 227 ILE C C 227 177.429 177.429 177.875 -0.446 25806 744 1 4 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.323 0.526 25806 745 1 4 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.584 -0.042 25806 746 1 4 . 1 1 227 227 ILE H H 227 8.233 8.233 7.663 0.570 25806 747 1 4 . 1 1 228 228 ILE N N 228 118.904 118.904 120.143 -1.239 25806 748 1 4 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.731 -0.035 25806 749 1 4 . 1 1 228 228 ILE C C 228 177.269 177.269 178.126 -0.857 25806 750 1 4 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.233 0.992 25806 751 1 4 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.362 0.088 25806 752 1 4 . 1 1 228 228 ILE H H 228 8.161 8.161 7.598 0.563 25806 753 1 4 . 1 1 229 229 VAL N N 229 118.028 118.028 118.762 -0.734 25806 754 1 4 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.601 -0.028 25806 755 1 4 . 1 1 229 229 VAL C C 229 177.312 177.312 178.302 -0.990 25806 756 1 4 . 1 1 229 229 VAL CA C 229 67.509 67.509 66.167 1.342 25806 757 1 4 . 1 1 229 229 VAL CB C 229 31.319 31.319 30.823 0.496 25806 758 1 4 . 1 1 229 229 VAL H H 229 8.366 8.366 7.215 1.151 25806 759 1 4 . 1 1 230 230 TRP N N 230 120.511 120.511 120.300 0.211 25806 760 1 4 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.446 -0.152 25806 761 1 4 . 1 1 230 230 TRP C C 230 177.236 177.236 177.888 -0.652 25806 762 1 4 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.322 0.471 25806 763 1 4 . 1 1 230 230 TRP CB C 230 29.170 29.170 29.113 0.057 25806 764 1 4 . 1 1 230 230 TRP H H 230 8.618 8.618 7.527 1.091 25806 765 1 4 . 1 1 231 231 ALA N N 231 119.679 119.679 119.750 -0.071 25806 766 1 4 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.261 -0.519 25806 767 1 4 . 1 1 231 231 ALA C C 231 179.679 179.679 178.541 1.138 25806 768 1 4 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.535 1.024 25806 769 1 4 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.564 -0.090 25806 770 1 4 . 1 1 231 231 ALA H H 231 8.728 8.728 8.486 0.242 25806 771 1 4 . 1 1 232 232 VAL N N 232 115.974 115.974 114.170 1.804 25806 772 1 4 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.247 -0.514 25806 773 1 4 . 1 1 232 232 VAL C C 232 178.103 178.103 175.123 2.980 25806 774 1 4 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.119 4.019 25806 775 1 4 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.731 -0.876 25806 776 1 4 . 1 1 232 232 VAL H H 232 8.453 8.453 7.497 0.956 25806 777 1 4 . 1 1 233 233 ALA N N 233 122.331 122.331 121.931 0.400 25806 778 1 4 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.623 -0.448 25806 779 1 4 . 1 1 233 233 ALA C C 233 179.434 179.434 177.636 1.798 25806 780 1 4 . 1 1 233 233 ALA CA C 233 54.989 54.989 53.579 1.410 25806 781 1 4 . 1 1 233 233 ALA CB C 233 18.603 18.603 19.913 -1.310 25806 782 1 4 . 1 1 233 233 ALA H H 233 8.472 8.472 7.740 0.732 25806 783 1 4 . 1 1 234 234 LEU N N 234 116.926 116.926 118.036 -1.110 25806 784 1 4 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.465 -0.287 25806 785 1 4 . 1 1 234 234 LEU C C 234 179.118 179.118 177.529 1.589 25806 786 1 4 . 1 1 234 234 LEU CA C 234 57.066 57.066 55.745 1.321 25806 787 1 4 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.584 -0.428 25806 788 1 4 . 1 1 234 234 LEU H H 234 8.208 8.208 8.116 0.092 25806 789 1 4 . 1 1 235 235 LYS N N 235 117.891 117.891 120.113 -2.222 25806 790 1 4 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.522 -0.334 25806 791 1 4 . 1 1 235 235 LYS C C 235 178.315 178.315 177.355 0.960 25806 792 1 4 . 1 1 235 235 LYS CA C 235 57.085 57.085 56.830 0.255 25806 793 1 4 . 1 1 235 235 LYS CB C 235 32.014 32.014 33.352 -1.338 25806 794 1 4 . 1 1 235 235 LYS H H 235 7.857 7.857 8.052 -0.195 25806 795 1 4 . 1 1 236 236 GLY N N 236 107.369 107.369 108.743 -1.374 25806 796 1 4 . 1 1 236 236 GLY C C 236 174.493 174.493 174.473 0.020 25806 797 1 4 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.060 1.294 25806 798 1 4 . 1 1 236 236 GLY H H 236 8.243 8.243 8.147 0.096 25806 799 1 4 . 1 1 237 237 TYR N N 237 119.546 119.546 120.836 -1.290 25806 800 1 4 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.157 0.344 25806 801 1 4 . 1 1 237 237 TYR C C 237 175.646 175.646 176.326 -0.680 25806 802 1 4 . 1 1 237 237 TYR CA C 237 58.961 58.961 58.244 0.717 25806 803 1 4 . 1 1 237 237 TYR CB C 237 39.006 39.006 37.401 1.605 25806 804 1 4 . 1 1 237 237 TYR H H 237 8.029 8.029 8.258 -0.229 25806 805 1 4 . 1 1 238 238 SER N N 238 115.132 115.132 114.929 0.203 25806 806 1 4 . 1 1 238 238 SER HA H 238 4.472 4.472 4.190 0.282 25806 807 1 4 . 1 1 238 238 SER C C 238 174.318 174.318 174.882 -0.564 25806 808 1 4 . 1 1 238 238 SER CA C 238 58.619 58.619 59.712 -1.093 25806 809 1 4 . 1 1 238 238 SER CB C 238 63.959 63.959 62.778 1.181 25806 810 1 4 . 1 1 238 238 SER H H 238 7.946 7.946 7.833 0.113 25806 811 1 4 . 1 1 239 239 MET N N 239 121.579 121.579 121.864 -0.285 25806 812 1 4 . 1 1 239 239 MET HA H 239 4.493 4.493 4.557 -0.064 25806 813 1 4 . 1 1 239 239 MET C C 239 175.102 175.102 175.566 -0.464 25806 814 1 4 . 1 1 239 239 MET CA C 239 56.084 56.084 54.488 1.596 25806 815 1 4 . 1 1 239 239 MET CB C 239 33.566 33.566 32.770 0.796 25806 816 1 4 . 1 1 239 239 MET H H 239 8.194 8.194 7.434 0.759 25806 817 1 5 . 1 1 205 205 SER CA C 205 58.498 58.498 57.958 0.540 25806 818 1 5 . 1 1 205 205 SER CB C 205 64.088 64.088 63.802 0.286 25806 819 1 5 . 1 1 206 206 PHE N N 206 121.596 121.596 122.105 -0.509 25806 820 1 5 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.646 0.141 25806 821 1 5 . 1 1 206 206 PHE C C 206 175.282 175.282 176.111 -0.829 25806 822 1 5 . 1 1 206 206 PHE CA C 206 57.711 57.711 57.464 0.247 25806 823 1 5 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.584 0.555 25806 824 1 5 . 1 1 206 206 PHE H H 206 8.414 8.414 8.541 -0.127 25806 825 1 5 . 1 1 207 207 THR N N 207 116.011 116.011 119.515 -3.504 25806 826 1 5 . 1 1 207 207 THR HA H 207 4.442 4.442 3.806 0.636 25806 827 1 5 . 1 1 207 207 THR C C 207 174.188 174.188 174.785 -0.597 25806 828 1 5 . 1 1 207 207 THR CA C 207 61.309 61.309 64.060 -2.751 25806 829 1 5 . 1 1 207 207 THR CB C 207 70.503 70.503 68.699 1.804 25806 830 1 5 . 1 1 207 207 THR H H 207 8.233 8.233 8.851 -0.618 25806 831 1 5 . 1 1 208 208 MET N N 208 121.915 121.915 117.933 3.982 25806 832 1 5 . 1 1 208 208 MET HA H 208 4.475 4.475 4.130 0.345 25806 833 1 5 . 1 1 208 208 MET C C 208 175.595 175.595 174.640 0.955 25806 834 1 5 . 1 1 208 208 MET CA C 208 55.865 55.865 55.375 0.490 25806 835 1 5 . 1 1 208 208 MET CB C 208 32.987 32.987 30.276 2.712 25806 836 1 5 . 1 1 208 208 MET H H 208 8.474 8.474 8.374 0.100 25806 837 1 5 . 1 1 209 209 ASN N N 209 119.024 119.024 118.549 0.475 25806 838 1 5 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.600 0.173 25806 839 1 5 . 1 1 209 209 ASN C C 209 175.125 175.125 175.397 -0.272 25806 840 1 5 . 1 1 209 209 ASN CA C 209 53.389 53.389 53.547 -0.158 25806 841 1 5 . 1 1 209 209 ASN CB C 209 39.165 39.165 39.055 0.110 25806 842 1 5 . 1 1 209 209 ASN H H 209 8.274 8.274 8.173 0.101 25806 843 1 5 . 1 1 210 210 ASP N N 210 119.941 119.941 125.631 -5.690 25806 844 1 5 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.649 -0.096 25806 845 1 5 . 1 1 210 210 ASP C C 210 177.325 177.325 177.544 -0.219 25806 846 1 5 . 1 1 210 210 ASP CA C 210 56.169 56.169 56.377 -0.208 25806 847 1 5 . 1 1 210 210 ASP CB C 210 41.255 41.255 41.077 0.178 25806 848 1 5 . 1 1 210 210 ASP H H 210 8.262 8.262 8.809 -0.547 25806 849 1 5 . 1 1 211 211 THR N N 211 115.882 115.882 115.360 0.522 25806 850 1 5 . 1 1 211 211 THR HA H 211 4.107 4.107 4.208 -0.101 25806 851 1 5 . 1 1 211 211 THR C C 211 175.855 175.855 176.917 -1.062 25806 852 1 5 . 1 1 211 211 THR CA C 211 65.947 65.947 66.434 -0.487 25806 853 1 5 . 1 1 211 211 THR CB C 211 68.808 68.808 68.615 0.193 25806 854 1 5 . 1 1 211 211 THR H H 211 8.320 8.320 8.253 0.067 25806 855 1 5 . 1 1 212 212 THR N N 212 115.754 115.754 118.585 -2.831 25806 856 1 5 . 1 1 212 212 THR HA H 212 4.004 4.004 4.059 -0.055 25806 857 1 5 . 1 1 212 212 THR C C 212 177.310 177.310 176.145 1.165 25806 858 1 5 . 1 1 212 212 THR CA C 212 66.199 66.199 65.874 0.326 25806 859 1 5 . 1 1 212 212 THR CB C 212 68.580 68.580 68.485 0.095 25806 860 1 5 . 1 1 212 212 THR H H 212 8.216 8.216 8.220 -0.004 25806 861 1 5 . 1 1 213 213 VAL N N 213 123.471 123.471 120.876 2.595 25806 862 1 5 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.699 -0.045 25806 863 1 5 . 1 1 213 213 VAL C C 213 177.157 177.157 177.247 -0.090 25806 864 1 5 . 1 1 213 213 VAL CA C 213 66.937 66.937 66.588 0.348 25806 865 1 5 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.230 0.322 25806 866 1 5 . 1 1 213 213 VAL H H 213 8.090 8.090 7.545 0.545 25806 867 1 5 . 1 1 214 214 TRP N N 214 119.814 119.814 118.134 1.680 25806 868 1 5 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.516 -0.095 25806 869 1 5 . 1 1 214 214 TRP C C 214 178.622 178.622 178.857 -0.235 25806 870 1 5 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.498 0.359 25806 871 1 5 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.010 0.467 25806 872 1 5 . 1 1 214 214 TRP H H 214 7.966 7.966 7.923 0.043 25806 873 1 5 . 1 1 215 215 ILE N N 215 118.030 118.030 121.644 -3.614 25806 874 1 5 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.598 0.137 25806 875 1 5 . 1 1 215 215 ILE C C 215 177.589 177.589 177.818 -0.229 25806 876 1 5 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.796 0.514 25806 877 1 5 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.550 0.261 25806 878 1 5 . 1 1 215 215 ILE H H 215 8.388 8.388 7.521 0.867 25806 879 1 5 . 1 1 216 216 SER N N 216 116.314 116.314 116.037 0.277 25806 880 1 5 . 1 1 216 216 SER HA H 216 4.083 4.083 4.158 -0.075 25806 881 1 5 . 1 1 216 216 SER C C 216 175.835 175.835 177.047 -1.212 25806 882 1 5 . 1 1 216 216 SER CA C 216 63.777 63.777 61.930 1.847 25806 883 1 5 . 1 1 216 216 SER CB C 216 62.965 62.965 62.279 0.687 25806 884 1 5 . 1 1 216 216 SER H H 216 8.010 8.010 7.982 0.028 25806 885 1 5 . 1 1 217 217 VAL N N 217 120.711 120.711 122.177 -1.466 25806 886 1 5 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.818 -0.241 25806 887 1 5 . 1 1 217 217 VAL C C 217 178.640 178.640 177.410 1.230 25806 888 1 5 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.316 1.554 25806 889 1 5 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.396 0.215 25806 890 1 5 . 1 1 217 217 VAL H H 217 8.381 8.381 7.191 1.190 25806 891 1 5 . 1 1 218 218 ALA N N 218 125.445 125.445 123.300 2.145 25806 892 1 5 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.092 -0.089 25806 893 1 5 . 1 1 218 218 ALA C C 218 178.882 178.882 179.701 -0.819 25806 894 1 5 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.482 0.570 25806 895 1 5 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.221 -0.009 25806 896 1 5 . 1 1 218 218 ALA H H 218 8.565 8.565 8.107 0.458 25806 897 1 5 . 1 1 219 219 VAL N N 219 116.767 116.767 118.365 -1.598 25806 898 1 5 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.668 -0.113 25806 899 1 5 . 1 1 219 219 VAL C C 219 177.632 177.632 177.766 -0.134 25806 900 1 5 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.474 0.834 25806 901 1 5 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.394 0.017 25806 902 1 5 . 1 1 219 219 VAL H H 219 8.575 8.575 7.816 0.759 25806 903 1 5 . 1 1 220 220 LEU N N 220 118.644 118.644 119.828 -1.184 25806 904 1 5 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.877 0.096 25806 905 1 5 . 1 1 220 220 LEU C C 220 178.641 178.641 178.914 -0.273 25806 906 1 5 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.165 0.362 25806 907 1 5 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.737 1.177 25806 908 1 5 . 1 1 220 220 LEU H H 220 8.434 8.434 7.274 1.160 25806 909 1 5 . 1 1 221 221 SER N N 221 114.238 114.238 114.504 -0.266 25806 910 1 5 . 1 1 221 221 SER HA H 221 4.026 4.026 4.131 -0.105 25806 911 1 5 . 1 1 221 221 SER C C 221 175.620 175.620 176.263 -0.643 25806 912 1 5 . 1 1 221 221 SER CA C 221 63.606 63.606 61.583 2.023 25806 913 1 5 . 1 1 221 221 SER CB C 221 62.966 62.966 62.706 0.260 25806 914 1 5 . 1 1 221 221 SER H H 221 8.478 8.478 7.847 0.631 25806 915 1 5 . 1 1 222 222 ALA N N 222 124.323 124.323 123.607 0.716 25806 916 1 5 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.192 -0.225 25806 917 1 5 . 1 1 222 222 ALA C C 222 178.799 178.799 179.740 -0.941 25806 918 1 5 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.736 1.060 25806 919 1 5 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.255 -0.252 25806 920 1 5 . 1 1 222 222 ALA H H 222 8.160 8.160 7.325 0.835 25806 921 1 5 . 1 1 223 223 VAL N N 223 116.763 116.763 119.944 -3.181 25806 922 1 5 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.679 -0.145 25806 923 1 5 . 1 1 223 223 VAL C C 223 177.402 177.402 178.136 -0.734 25806 924 1 5 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.597 0.796 25806 925 1 5 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.273 0.044 25806 926 1 5 . 1 1 223 223 VAL H H 223 8.274 8.274 7.925 0.349 25806 927 1 5 . 1 1 224 224 ILE N N 224 118.686 118.686 117.380 1.306 25806 928 1 5 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.807 -0.174 25806 929 1 5 . 1 1 224 224 ILE C C 224 177.422 177.422 177.678 -0.256 25806 930 1 5 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.892 0.935 25806 931 1 5 . 1 1 224 224 ILE CB C 224 37.301 37.301 36.989 0.312 25806 932 1 5 . 1 1 224 224 ILE H H 224 8.375 8.375 8.358 0.017 25806 933 1 5 . 1 1 225 225 CYS N N 225 116.617 116.617 118.951 -2.334 25806 934 1 5 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.151 -0.133 25806 935 1 5 . 1 1 225 225 CYS C C 225 176.120 176.120 176.615 -0.495 25806 936 1 5 . 1 1 225 225 CYS CA C 225 65.013 65.013 63.001 2.012 25806 937 1 5 . 1 1 225 225 CYS CB C 225 26.856 26.856 27.213 -0.357 25806 938 1 5 . 1 1 225 225 CYS H H 225 8.202 8.202 7.407 0.795 25806 939 1 5 . 1 1 226 226 LEU N N 226 118.552 118.552 121.632 -3.080 25806 940 1 5 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.837 0.179 25806 941 1 5 . 1 1 226 226 LEU C C 226 177.990 177.990 178.732 -0.742 25806 942 1 5 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.511 0.048 25806 943 1 5 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.005 -0.256 25806 944 1 5 . 1 1 226 226 LEU H H 226 8.210 8.210 7.788 0.422 25806 945 1 5 . 1 1 227 227 ILE N N 227 118.243 118.243 117.566 0.677 25806 946 1 5 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.937 -0.113 25806 947 1 5 . 1 1 227 227 ILE C C 227 177.429 177.429 177.910 -0.481 25806 948 1 5 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.446 0.403 25806 949 1 5 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.528 0.014 25806 950 1 5 . 1 1 227 227 ILE H H 227 8.233 8.233 8.050 0.182 25806 951 1 5 . 1 1 228 228 ILE N N 228 118.904 118.904 119.754 -0.850 25806 952 1 5 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.766 -0.070 25806 953 1 5 . 1 1 228 228 ILE C C 228 177.269 177.269 178.087 -0.818 25806 954 1 5 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.169 1.056 25806 955 1 5 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.420 0.030 25806 956 1 5 . 1 1 228 228 ILE H H 228 8.161 8.161 7.518 0.643 25806 957 1 5 . 1 1 229 229 VAL N N 229 118.028 118.028 118.934 -0.906 25806 958 1 5 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.613 -0.040 25806 959 1 5 . 1 1 229 229 VAL C C 229 177.312 177.312 178.235 -0.923 25806 960 1 5 . 1 1 229 229 VAL CA C 229 67.509 67.509 66.023 1.486 25806 961 1 5 . 1 1 229 229 VAL CB C 229 31.319 31.319 30.802 0.516 25806 962 1 5 . 1 1 229 229 VAL H H 229 8.366 8.366 7.243 1.123 25806 963 1 5 . 1 1 230 230 TRP N N 230 120.511 120.511 120.352 0.159 25806 964 1 5 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.453 -0.159 25806 965 1 5 . 1 1 230 230 TRP C C 230 177.236 177.236 177.867 -0.631 25806 966 1 5 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.310 0.483 25806 967 1 5 . 1 1 230 230 TRP CB C 230 29.170 29.170 29.016 0.154 25806 968 1 5 . 1 1 230 230 TRP H H 230 8.618 8.618 7.742 0.876 25806 969 1 5 . 1 1 231 231 ALA N N 231 119.679 119.679 119.515 0.164 25806 970 1 5 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.242 -0.500 25806 971 1 5 . 1 1 231 231 ALA C C 231 179.679 179.679 178.273 1.406 25806 972 1 5 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.614 0.945 25806 973 1 5 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.479 -0.004 25806 974 1 5 . 1 1 231 231 ALA H H 231 8.728 8.728 8.244 0.484 25806 975 1 5 . 1 1 232 232 VAL N N 232 115.974 115.974 114.561 1.413 25806 976 1 5 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.233 -0.500 25806 977 1 5 . 1 1 232 232 VAL C C 232 178.103 178.103 175.373 2.730 25806 978 1 5 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.311 3.827 25806 979 1 5 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.774 -0.919 25806 980 1 5 . 1 1 232 232 VAL H H 232 8.453 8.453 7.184 1.269 25806 981 1 5 . 1 1 233 233 ALA N N 233 122.331 122.331 121.603 0.728 25806 982 1 5 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.608 -0.433 25806 983 1 5 . 1 1 233 233 ALA C C 233 179.434 179.434 177.629 1.805 25806 984 1 5 . 1 1 233 233 ALA CA C 233 54.989 54.989 53.474 1.515 25806 985 1 5 . 1 1 233 233 ALA CB C 233 18.603 18.603 20.087 -1.484 25806 986 1 5 . 1 1 233 233 ALA H H 233 8.472 8.472 7.749 0.723 25806 987 1 5 . 1 1 234 234 LEU N N 234 116.926 116.926 118.079 -1.153 25806 988 1 5 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.465 -0.287 25806 989 1 5 . 1 1 234 234 LEU C C 234 179.118 179.118 177.670 1.448 25806 990 1 5 . 1 1 234 234 LEU CA C 234 57.066 57.066 55.808 1.258 25806 991 1 5 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.819 -0.663 25806 992 1 5 . 1 1 234 234 LEU H H 234 8.208 8.208 8.167 0.041 25806 993 1 5 . 1 1 235 235 LYS N N 235 117.891 117.891 119.717 -1.826 25806 994 1 5 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.509 -0.321 25806 995 1 5 . 1 1 235 235 LYS C C 235 178.315 178.315 177.251 1.064 25806 996 1 5 . 1 1 235 235 LYS CA C 235 57.085 57.085 56.645 0.440 25806 997 1 5 . 1 1 235 235 LYS CB C 235 32.014 32.014 33.091 -1.077 25806 998 1 5 . 1 1 235 235 LYS H H 235 7.857 7.857 8.089 -0.232 25806 999 1 5 . 1 1 236 236 GLY N N 236 107.369 107.369 107.307 0.062 25806 1000 1 5 . 1 1 236 236 GLY C C 236 174.493 174.493 174.478 0.015 25806 1001 1 5 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.190 1.165 25806 1002 1 5 . 1 1 236 236 GLY H H 236 8.243 8.243 8.191 0.052 25806 1003 1 5 . 1 1 237 237 TYR N N 237 119.546 119.546 119.856 -0.310 25806 1004 1 5 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.273 0.228 25806 1005 1 5 . 1 1 237 237 TYR C C 237 175.646 175.646 175.738 -0.092 25806 1006 1 5 . 1 1 237 237 TYR CA C 237 58.961 58.961 57.739 1.222 25806 1007 1 5 . 1 1 237 237 TYR CB C 237 39.006 39.006 37.349 1.657 25806 1008 1 5 . 1 1 237 237 TYR H H 237 8.029 8.029 8.401 -0.372 25806 1009 1 5 . 1 1 238 238 SER N N 238 115.132 115.132 116.293 -1.161 25806 1010 1 5 . 1 1 238 238 SER HA H 238 4.472 4.472 4.139 0.333 25806 1011 1 5 . 1 1 238 238 SER C C 238 174.318 174.318 174.795 -0.477 25806 1012 1 5 . 1 1 238 238 SER CA C 238 58.619 58.619 60.380 -1.761 25806 1013 1 5 . 1 1 238 238 SER CB C 238 63.959 63.959 62.734 1.225 25806 1014 1 5 . 1 1 238 238 SER H H 238 7.946 7.946 8.085 -0.139 25806 1015 1 5 . 1 1 239 239 MET N N 239 121.579 121.579 121.571 0.008 25806 1016 1 5 . 1 1 239 239 MET HA H 239 4.493 4.493 4.463 0.030 25806 1017 1 5 . 1 1 239 239 MET C C 239 175.102 175.102 175.337 -0.235 25806 1018 1 5 . 1 1 239 239 MET CA C 239 56.084 56.084 54.737 1.347 25806 1019 1 5 . 1 1 239 239 MET CB C 239 33.566 33.566 32.353 1.213 25806 1020 1 5 . 1 1 239 239 MET H H 239 8.194 8.194 7.683 0.511 25806 1021 1 6 . 1 1 205 205 SER CA C 205 58.498 58.498 57.495 1.003 25806 1022 1 6 . 1 1 205 205 SER CB C 205 64.088 64.088 64.975 -0.887 25806 1023 1 6 . 1 1 206 206 PHE N N 206 121.596 121.596 122.533 -0.937 25806 1024 1 6 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.740 0.047 25806 1025 1 6 . 1 1 206 206 PHE C C 206 175.282 175.282 176.271 -0.989 25806 1026 1 6 . 1 1 206 206 PHE CA C 206 57.711 57.711 57.589 0.122 25806 1027 1 6 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.036 1.103 25806 1028 1 6 . 1 1 206 206 PHE H H 206 8.414 8.414 8.784 -0.370 25806 1029 1 6 . 1 1 207 207 THR N N 207 116.011 116.011 112.375 3.636 25806 1030 1 6 . 1 1 207 207 THR HA H 207 4.442 4.442 4.189 0.253 25806 1031 1 6 . 1 1 207 207 THR C C 207 174.188 174.188 174.541 -0.353 25806 1032 1 6 . 1 1 207 207 THR CA C 207 61.309 61.309 63.526 -2.217 25806 1033 1 6 . 1 1 207 207 THR CB C 207 70.503 70.503 69.020 1.483 25806 1034 1 6 . 1 1 207 207 THR H H 207 8.233 8.233 7.894 0.339 25806 1035 1 6 . 1 1 208 208 MET N N 208 121.915 121.915 122.021 -0.106 25806 1036 1 6 . 1 1 208 208 MET HA H 208 4.475 4.475 4.658 -0.183 25806 1037 1 6 . 1 1 208 208 MET C C 208 175.595 175.595 174.817 0.778 25806 1038 1 6 . 1 1 208 208 MET CA C 208 55.865 55.865 54.782 1.083 25806 1039 1 6 . 1 1 208 208 MET CB C 208 32.987 32.987 33.665 -0.678 25806 1040 1 6 . 1 1 208 208 MET H H 208 8.474 8.474 7.711 0.763 25806 1041 1 6 . 1 1 209 209 ASN N N 209 119.024 119.024 123.024 -4.000 25806 1042 1 6 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.773 -0.000 25806 1043 1 6 . 1 1 209 209 ASN C C 209 175.125 175.125 175.587 -0.462 25806 1044 1 6 . 1 1 209 209 ASN CA C 209 53.389 53.389 53.919 -0.530 25806 1045 1 6 . 1 1 209 209 ASN CB C 209 39.165 39.165 39.212 -0.047 25806 1046 1 6 . 1 1 209 209 ASN H H 209 8.274 8.274 8.639 -0.365 25806 1047 1 6 . 1 1 210 210 ASP N N 210 119.941 119.941 124.095 -4.154 25806 1048 1 6 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.644 -0.091 25806 1049 1 6 . 1 1 210 210 ASP C C 210 177.325 177.325 177.260 0.065 25806 1050 1 6 . 1 1 210 210 ASP CA C 210 56.169 56.169 54.793 1.376 25806 1051 1 6 . 1 1 210 210 ASP CB C 210 41.255 41.255 40.715 0.540 25806 1052 1 6 . 1 1 210 210 ASP H H 210 8.262 8.262 8.979 -0.717 25806 1053 1 6 . 1 1 211 211 THR N N 211 115.882 115.882 117.049 -1.167 25806 1054 1 6 . 1 1 211 211 THR HA H 211 4.107 4.107 4.324 -0.217 25806 1055 1 6 . 1 1 211 211 THR C C 211 175.855 175.855 176.983 -1.128 25806 1056 1 6 . 1 1 211 211 THR CA C 211 65.947 65.947 66.339 -0.392 25806 1057 1 6 . 1 1 211 211 THR CB C 211 68.808 68.808 68.731 0.076 25806 1058 1 6 . 1 1 211 211 THR H H 211 8.320 8.320 8.233 0.087 25806 1059 1 6 . 1 1 212 212 THR N N 212 115.754 115.754 118.190 -2.436 25806 1060 1 6 . 1 1 212 212 THR HA H 212 4.004 4.004 4.084 -0.080 25806 1061 1 6 . 1 1 212 212 THR C C 212 177.310 177.310 176.172 1.138 25806 1062 1 6 . 1 1 212 212 THR CA C 212 66.199 66.199 66.158 0.041 25806 1063 1 6 . 1 1 212 212 THR CB C 212 68.580 68.580 68.359 0.221 25806 1064 1 6 . 1 1 212 212 THR H H 212 8.216 8.216 8.435 -0.219 25806 1065 1 6 . 1 1 213 213 VAL N N 213 123.471 123.471 120.710 2.761 25806 1066 1 6 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.719 -0.065 25806 1067 1 6 . 1 1 213 213 VAL C C 213 177.157 177.157 177.768 -0.611 25806 1068 1 6 . 1 1 213 213 VAL CA C 213 66.937 66.937 66.171 0.766 25806 1069 1 6 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.023 0.529 25806 1070 1 6 . 1 1 213 213 VAL H H 213 8.090 8.090 7.335 0.755 25806 1071 1 6 . 1 1 214 214 TRP N N 214 119.814 119.814 118.375 1.439 25806 1072 1 6 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.508 -0.087 25806 1073 1 6 . 1 1 214 214 TRP C C 214 178.622 178.622 178.645 -0.023 25806 1074 1 6 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.291 0.566 25806 1075 1 6 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.124 0.353 25806 1076 1 6 . 1 1 214 214 TRP H H 214 7.966 7.966 7.775 0.191 25806 1077 1 6 . 1 1 215 215 ILE N N 215 118.030 118.030 121.710 -3.680 25806 1078 1 6 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.653 0.082 25806 1079 1 6 . 1 1 215 215 ILE C C 215 177.589 177.589 177.754 -0.165 25806 1080 1 6 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.462 0.848 25806 1081 1 6 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.669 0.142 25806 1082 1 6 . 1 1 215 215 ILE H H 215 8.388 8.388 7.612 0.776 25806 1083 1 6 . 1 1 216 216 SER N N 216 116.314 116.314 115.777 0.537 25806 1084 1 6 . 1 1 216 216 SER HA H 216 4.083 4.083 4.196 -0.113 25806 1085 1 6 . 1 1 216 216 SER C C 216 175.835 175.835 176.981 -1.146 25806 1086 1 6 . 1 1 216 216 SER CA C 216 63.777 63.777 61.840 1.937 25806 1087 1 6 . 1 1 216 216 SER CB C 216 62.965 62.965 62.624 0.341 25806 1088 1 6 . 1 1 216 216 SER H H 216 8.010 8.010 8.277 -0.267 25806 1089 1 6 . 1 1 217 217 VAL N N 217 120.711 120.711 121.495 -0.784 25806 1090 1 6 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.860 -0.283 25806 1091 1 6 . 1 1 217 217 VAL C C 217 178.640 178.640 177.551 1.089 25806 1092 1 6 . 1 1 217 217 VAL CA C 217 66.870 66.870 64.634 2.236 25806 1093 1 6 . 1 1 217 217 VAL CB C 217 31.611 31.611 30.874 0.737 25806 1094 1 6 . 1 1 217 217 VAL H H 217 8.381 8.381 7.287 1.094 25806 1095 1 6 . 1 1 218 218 ALA N N 218 125.445 125.445 123.679 1.766 25806 1096 1 6 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.139 -0.136 25806 1097 1 6 . 1 1 218 218 ALA C C 218 178.882 178.882 179.924 -1.042 25806 1098 1 6 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.232 0.820 25806 1099 1 6 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.424 -0.212 25806 1100 1 6 . 1 1 218 218 ALA H H 218 8.565 8.565 8.112 0.453 25806 1101 1 6 . 1 1 219 219 VAL N N 219 116.767 116.767 118.361 -1.594 25806 1102 1 6 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.708 -0.153 25806 1103 1 6 . 1 1 219 219 VAL C C 219 177.632 177.632 177.830 -0.198 25806 1104 1 6 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.624 0.684 25806 1105 1 6 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.391 0.020 25806 1106 1 6 . 1 1 219 219 VAL H H 219 8.575 8.575 7.747 0.828 25806 1107 1 6 . 1 1 220 220 LEU N N 220 118.644 118.644 119.774 -1.130 25806 1108 1 6 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.877 0.096 25806 1109 1 6 . 1 1 220 220 LEU C C 220 178.641 178.641 178.773 -0.132 25806 1110 1 6 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.403 0.124 25806 1111 1 6 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.708 1.206 25806 1112 1 6 . 1 1 220 220 LEU H H 220 8.434 8.434 7.344 1.090 25806 1113 1 6 . 1 1 221 221 SER N N 221 114.238 114.238 114.660 -0.422 25806 1114 1 6 . 1 1 221 221 SER HA H 221 4.026 4.026 4.090 -0.064 25806 1115 1 6 . 1 1 221 221 SER C C 221 175.620 175.620 176.790 -1.170 25806 1116 1 6 . 1 1 221 221 SER CA C 221 63.606 63.606 61.492 2.114 25806 1117 1 6 . 1 1 221 221 SER CB C 221 62.966 62.966 62.894 0.072 25806 1118 1 6 . 1 1 221 221 SER H H 221 8.478 8.478 7.873 0.605 25806 1119 1 6 . 1 1 222 222 ALA N N 222 124.323 124.323 124.550 -0.227 25806 1120 1 6 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.204 -0.237 25806 1121 1 6 . 1 1 222 222 ALA C C 222 178.799 178.799 179.655 -0.856 25806 1122 1 6 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.589 1.207 25806 1123 1 6 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.451 -0.448 25806 1124 1 6 . 1 1 222 222 ALA H H 222 8.160 8.160 7.321 0.839 25806 1125 1 6 . 1 1 223 223 VAL N N 223 116.763 116.763 120.387 -3.624 25806 1126 1 6 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.674 -0.140 25806 1127 1 6 . 1 1 223 223 VAL C C 223 177.402 177.402 177.887 -0.485 25806 1128 1 6 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.596 0.797 25806 1129 1 6 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.645 -0.328 25806 1130 1 6 . 1 1 223 223 VAL H H 223 8.274 8.274 8.098 0.176 25806 1131 1 6 . 1 1 224 224 ILE N N 224 118.686 118.686 117.473 1.213 25806 1132 1 6 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.778 -0.145 25806 1133 1 6 . 1 1 224 224 ILE C C 224 177.422 177.422 177.497 -0.075 25806 1134 1 6 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.886 0.941 25806 1135 1 6 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.131 0.170 25806 1136 1 6 . 1 1 224 224 ILE H H 224 8.375 8.375 8.065 0.310 25806 1137 1 6 . 1 1 225 225 CYS N N 225 116.617 116.617 117.994 -1.377 25806 1138 1 6 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.127 -0.109 25806 1139 1 6 . 1 1 225 225 CYS C C 225 176.120 176.120 176.536 -0.416 25806 1140 1 6 . 1 1 225 225 CYS CA C 225 65.013 65.013 63.476 1.537 25806 1141 1 6 . 1 1 225 225 CYS CB C 225 26.856 26.856 27.512 -0.656 25806 1142 1 6 . 1 1 225 225 CYS H H 225 8.202 8.202 7.559 0.643 25806 1143 1 6 . 1 1 226 226 LEU N N 226 118.552 118.552 121.270 -2.718 25806 1144 1 6 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.948 0.068 25806 1145 1 6 . 1 1 226 226 LEU C C 226 177.990 177.990 178.647 -0.657 25806 1146 1 6 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.361 0.198 25806 1147 1 6 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.227 -0.478 25806 1148 1 6 . 1 1 226 226 LEU H H 226 8.210 8.210 7.601 0.609 25806 1149 1 6 . 1 1 227 227 ILE N N 227 118.243 118.243 117.595 0.648 25806 1150 1 6 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.871 -0.047 25806 1151 1 6 . 1 1 227 227 ILE C C 227 177.429 177.429 177.943 -0.514 25806 1152 1 6 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.418 0.431 25806 1153 1 6 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.508 0.034 25806 1154 1 6 . 1 1 227 227 ILE H H 227 8.233 8.233 8.106 0.127 25806 1155 1 6 . 1 1 228 228 ILE N N 228 118.904 118.904 119.566 -0.662 25806 1156 1 6 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.707 -0.011 25806 1157 1 6 . 1 1 228 228 ILE C C 228 177.269 177.269 177.907 -0.638 25806 1158 1 6 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.170 1.055 25806 1159 1 6 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.533 -0.083 25806 1160 1 6 . 1 1 228 228 ILE H H 228 8.161 8.161 7.562 0.599 25806 1161 1 6 . 1 1 229 229 VAL N N 229 118.028 118.028 119.197 -1.169 25806 1162 1 6 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.559 0.014 25806 1163 1 6 . 1 1 229 229 VAL C C 229 177.312 177.312 178.423 -1.111 25806 1164 1 6 . 1 1 229 229 VAL CA C 229 67.509 67.509 65.861 1.648 25806 1165 1 6 . 1 1 229 229 VAL CB C 229 31.319 31.319 31.324 -0.005 25806 1166 1 6 . 1 1 229 229 VAL H H 229 8.366 8.366 7.424 0.942 25806 1167 1 6 . 1 1 230 230 TRP N N 230 120.511 120.511 120.408 0.103 25806 1168 1 6 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.401 -0.107 25806 1169 1 6 . 1 1 230 230 TRP C C 230 177.236 177.236 177.931 -0.695 25806 1170 1 6 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.493 0.300 25806 1171 1 6 . 1 1 230 230 TRP CB C 230 29.170 29.170 29.205 -0.035 25806 1172 1 6 . 1 1 230 230 TRP H H 230 8.618 8.618 7.751 0.867 25806 1173 1 6 . 1 1 231 231 ALA N N 231 119.679 119.679 119.187 0.492 25806 1174 1 6 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.224 -0.482 25806 1175 1 6 . 1 1 231 231 ALA C C 231 179.679 179.679 178.209 1.470 25806 1176 1 6 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.623 0.935 25806 1177 1 6 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.442 0.033 25806 1178 1 6 . 1 1 231 231 ALA H H 231 8.728 8.728 8.353 0.375 25806 1179 1 6 . 1 1 232 232 VAL N N 232 115.974 115.974 115.152 0.822 25806 1180 1 6 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.228 -0.495 25806 1181 1 6 . 1 1 232 232 VAL C C 232 178.103 178.103 175.559 2.544 25806 1182 1 6 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.182 3.956 25806 1183 1 6 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.958 -1.103 25806 1184 1 6 . 1 1 232 232 VAL H H 232 8.453 8.453 7.238 1.215 25806 1185 1 6 . 1 1 233 233 ALA N N 233 122.331 122.331 121.800 0.531 25806 1186 1 6 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.691 -0.516 25806 1187 1 6 . 1 1 233 233 ALA C C 233 179.434 179.434 177.761 1.673 25806 1188 1 6 . 1 1 233 233 ALA CA C 233 54.989 54.989 52.880 2.109 25806 1189 1 6 . 1 1 233 233 ALA CB C 233 18.603 18.603 20.117 -1.514 25806 1190 1 6 . 1 1 233 233 ALA H H 233 8.472 8.472 7.721 0.751 25806 1191 1 6 . 1 1 234 234 LEU N N 234 116.926 116.926 117.950 -1.024 25806 1192 1 6 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.594 -0.416 25806 1193 1 6 . 1 1 234 234 LEU C C 234 179.118 179.118 177.250 1.868 25806 1194 1 6 . 1 1 234 234 LEU CA C 234 57.066 57.066 56.030 1.036 25806 1195 1 6 . 1 1 234 234 LEU CB C 234 42.156 42.156 43.092 -0.936 25806 1196 1 6 . 1 1 234 234 LEU H H 234 8.208 8.208 8.062 0.146 25806 1197 1 6 . 1 1 235 235 LYS N N 235 117.891 117.891 120.376 -2.485 25806 1198 1 6 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.525 -0.337 25806 1199 1 6 . 1 1 235 235 LYS C C 235 178.315 178.315 176.554 1.761 25806 1200 1 6 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.660 1.425 25806 1201 1 6 . 1 1 235 235 LYS CB C 235 32.014 32.014 31.948 0.066 25806 1202 1 6 . 1 1 235 235 LYS H H 235 7.857 7.857 8.046 -0.189 25806 1203 1 6 . 1 1 236 236 GLY N N 236 107.369 107.369 105.806 1.563 25806 1204 1 6 . 1 1 236 236 GLY C C 236 174.493 174.493 173.682 0.811 25806 1205 1 6 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.625 0.729 25806 1206 1 6 . 1 1 236 236 GLY H H 236 8.243 8.243 8.133 0.110 25806 1207 1 6 . 1 1 237 237 TYR N N 237 119.546 119.546 120.276 -0.730 25806 1208 1 6 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.595 -0.094 25806 1209 1 6 . 1 1 237 237 TYR C C 237 175.646 175.646 176.529 -0.883 25806 1210 1 6 . 1 1 237 237 TYR CA C 237 58.961 58.961 57.803 1.158 25806 1211 1 6 . 1 1 237 237 TYR CB C 237 39.006 39.006 38.452 0.554 25806 1212 1 6 . 1 1 237 237 TYR H H 237 8.029 8.029 8.000 0.029 25806 1213 1 6 . 1 1 238 238 SER N N 238 115.132 115.132 116.090 -0.958 25806 1214 1 6 . 1 1 238 238 SER HA H 238 4.472 4.472 3.931 0.541 25806 1215 1 6 . 1 1 238 238 SER C C 238 174.318 174.318 174.699 -0.381 25806 1216 1 6 . 1 1 238 238 SER CA C 238 58.619 58.619 59.903 -1.284 25806 1217 1 6 . 1 1 238 238 SER CB C 238 63.959 63.959 62.646 1.313 25806 1218 1 6 . 1 1 238 238 SER H H 238 7.946 7.946 8.497 -0.551 25806 1219 1 6 . 1 1 239 239 MET N N 239 121.579 121.579 121.915 -0.336 25806 1220 1 6 . 1 1 239 239 MET HA H 239 4.493 4.493 4.520 -0.027 25806 1221 1 6 . 1 1 239 239 MET C C 239 175.102 175.102 175.383 -0.281 25806 1222 1 6 . 1 1 239 239 MET CA C 239 56.084 56.084 54.398 1.686 25806 1223 1 6 . 1 1 239 239 MET CB C 239 33.566 33.566 32.914 0.652 25806 1224 1 6 . 1 1 239 239 MET H H 239 8.194 8.194 7.623 0.571 25806 1225 1 7 . 1 1 205 205 SER CA C 205 58.498 58.498 57.656 0.842 25806 1226 1 7 . 1 1 205 205 SER CB C 205 64.088 64.088 65.304 -1.216 25806 1227 1 7 . 1 1 206 206 PHE N N 206 121.596 121.596 118.166 3.430 25806 1228 1 7 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.744 0.043 25806 1229 1 7 . 1 1 206 206 PHE C C 206 175.282 175.282 174.183 1.099 25806 1230 1 7 . 1 1 206 206 PHE CA C 206 57.711 57.711 57.726 -0.015 25806 1231 1 7 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.915 0.224 25806 1232 1 7 . 1 1 206 206 PHE H H 206 8.414 8.414 8.189 0.225 25806 1233 1 7 . 1 1 207 207 THR N N 207 116.011 116.011 118.441 -2.430 25806 1234 1 7 . 1 1 207 207 THR HA H 207 4.442 4.442 4.394 0.048 25806 1235 1 7 . 1 1 207 207 THR C C 207 174.188 174.188 174.082 0.106 25806 1236 1 7 . 1 1 207 207 THR CA C 207 61.309 61.309 61.714 -0.405 25806 1237 1 7 . 1 1 207 207 THR CB C 207 70.503 70.503 69.023 1.480 25806 1238 1 7 . 1 1 207 207 THR H H 207 8.233 8.233 7.620 0.613 25806 1239 1 7 . 1 1 208 208 MET N N 208 121.915 121.915 123.924 -2.009 25806 1240 1 7 . 1 1 208 208 MET HA H 208 4.475 4.475 4.491 -0.016 25806 1241 1 7 . 1 1 208 208 MET C C 208 175.595 175.595 177.232 -1.637 25806 1242 1 7 . 1 1 208 208 MET CA C 208 55.865 55.865 55.130 0.735 25806 1243 1 7 . 1 1 208 208 MET CB C 208 32.987 32.987 33.064 -0.077 25806 1244 1 7 . 1 1 208 208 MET H H 208 8.474 8.474 8.419 0.055 25806 1245 1 7 . 1 1 209 209 ASN N N 209 119.024 119.024 119.217 -0.193 25806 1246 1 7 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.516 0.257 25806 1247 1 7 . 1 1 209 209 ASN C C 209 175.125 175.125 175.513 -0.388 25806 1248 1 7 . 1 1 209 209 ASN CA C 209 53.389 53.389 55.566 -2.177 25806 1249 1 7 . 1 1 209 209 ASN CB C 209 39.165 39.165 38.660 0.505 25806 1250 1 7 . 1 1 209 209 ASN H H 209 8.274 8.274 8.692 -0.418 25806 1251 1 7 . 1 1 210 210 ASP N N 210 119.941 119.941 113.966 5.975 25806 1252 1 7 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.746 -0.193 25806 1253 1 7 . 1 1 210 210 ASP C C 210 177.325 177.325 175.972 1.353 25806 1254 1 7 . 1 1 210 210 ASP CA C 210 56.169 56.169 54.544 1.625 25806 1255 1 7 . 1 1 210 210 ASP CB C 210 41.255 41.255 41.082 0.173 25806 1256 1 7 . 1 1 210 210 ASP H H 210 8.262 8.262 8.274 -0.012 25806 1257 1 7 . 1 1 211 211 THR N N 211 115.882 115.882 116.227 -0.345 25806 1258 1 7 . 1 1 211 211 THR HA H 211 4.107 4.107 4.263 -0.156 25806 1259 1 7 . 1 1 211 211 THR C C 211 175.855 175.855 176.351 -0.496 25806 1260 1 7 . 1 1 211 211 THR CA C 211 65.947 65.947 66.010 -0.063 25806 1261 1 7 . 1 1 211 211 THR CB C 211 68.808 68.808 68.956 -0.148 25806 1262 1 7 . 1 1 211 211 THR H H 211 8.320 8.320 8.060 0.260 25806 1263 1 7 . 1 1 212 212 THR N N 212 115.754 115.754 117.905 -2.151 25806 1264 1 7 . 1 1 212 212 THR HA H 212 4.004 4.004 4.167 -0.163 25806 1265 1 7 . 1 1 212 212 THR C C 212 177.310 177.310 176.226 1.084 25806 1266 1 7 . 1 1 212 212 THR CA C 212 66.199 66.199 65.983 0.216 25806 1267 1 7 . 1 1 212 212 THR CB C 212 68.580 68.580 68.096 0.484 25806 1268 1 7 . 1 1 212 212 THR H H 212 8.216 8.216 8.434 -0.218 25806 1269 1 7 . 1 1 213 213 VAL N N 213 123.471 123.471 120.444 3.027 25806 1270 1 7 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.707 -0.053 25806 1271 1 7 . 1 1 213 213 VAL C C 213 177.157 177.157 178.079 -0.922 25806 1272 1 7 . 1 1 213 213 VAL CA C 213 66.937 66.937 66.056 0.881 25806 1273 1 7 . 1 1 213 213 VAL CB C 213 31.552 31.552 30.800 0.752 25806 1274 1 7 . 1 1 213 213 VAL H H 213 8.090 8.090 7.326 0.764 25806 1275 1 7 . 1 1 214 214 TRP N N 214 119.814 119.814 119.396 0.418 25806 1276 1 7 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.481 -0.060 25806 1277 1 7 . 1 1 214 214 TRP C C 214 178.622 178.622 178.686 -0.064 25806 1278 1 7 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.759 0.098 25806 1279 1 7 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.120 0.357 25806 1280 1 7 . 1 1 214 214 TRP H H 214 7.966 7.966 8.080 -0.114 25806 1281 1 7 . 1 1 215 215 ILE N N 215 118.030 118.030 120.654 -2.624 25806 1282 1 7 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.625 0.110 25806 1283 1 7 . 1 1 215 215 ILE C C 215 177.589 177.589 178.056 -0.467 25806 1284 1 7 . 1 1 215 215 ILE CA C 215 65.310 65.310 65.038 0.272 25806 1285 1 7 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.608 0.202 25806 1286 1 7 . 1 1 215 215 ILE H H 215 8.388 8.388 7.563 0.825 25806 1287 1 7 . 1 1 216 216 SER N N 216 116.314 116.314 115.072 1.242 25806 1288 1 7 . 1 1 216 216 SER HA H 216 4.083 4.083 4.216 -0.133 25806 1289 1 7 . 1 1 216 216 SER C C 216 175.835 175.835 176.971 -1.136 25806 1290 1 7 . 1 1 216 216 SER CA C 216 63.777 63.777 62.024 1.753 25806 1291 1 7 . 1 1 216 216 SER CB C 216 62.965 62.965 62.751 0.214 25806 1292 1 7 . 1 1 216 216 SER H H 216 8.010 8.010 8.007 0.003 25806 1293 1 7 . 1 1 217 217 VAL N N 217 120.711 120.711 121.465 -0.754 25806 1294 1 7 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.780 -0.203 25806 1295 1 7 . 1 1 217 217 VAL C C 217 178.640 178.640 177.153 1.487 25806 1296 1 7 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.362 1.508 25806 1297 1 7 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.374 0.237 25806 1298 1 7 . 1 1 217 217 VAL H H 217 8.381 8.381 7.297 1.084 25806 1299 1 7 . 1 1 218 218 ALA N N 218 125.445 125.445 123.416 2.029 25806 1300 1 7 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.096 -0.093 25806 1301 1 7 . 1 1 218 218 ALA C C 218 178.882 178.882 179.614 -0.732 25806 1302 1 7 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.251 0.801 25806 1303 1 7 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.235 -0.023 25806 1304 1 7 . 1 1 218 218 ALA H H 218 8.565 8.565 7.996 0.569 25806 1305 1 7 . 1 1 219 219 VAL N N 219 116.767 116.767 118.179 -1.412 25806 1306 1 7 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.679 -0.124 25806 1307 1 7 . 1 1 219 219 VAL C C 219 177.632 177.632 177.786 -0.154 25806 1308 1 7 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.453 0.855 25806 1309 1 7 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.491 -0.080 25806 1310 1 7 . 1 1 219 219 VAL H H 219 8.575 8.575 7.470 1.105 25806 1311 1 7 . 1 1 220 220 LEU N N 220 118.644 118.644 120.201 -1.557 25806 1312 1 7 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.842 0.131 25806 1313 1 7 . 1 1 220 220 LEU C C 220 178.641 178.641 179.045 -0.404 25806 1314 1 7 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.305 0.222 25806 1315 1 7 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.621 1.293 25806 1316 1 7 . 1 1 220 220 LEU H H 220 8.434 8.434 7.310 1.124 25806 1317 1 7 . 1 1 221 221 SER N N 221 114.238 114.238 114.662 -0.424 25806 1318 1 7 . 1 1 221 221 SER HA H 221 4.026 4.026 4.124 -0.098 25806 1319 1 7 . 1 1 221 221 SER C C 221 175.620 175.620 176.674 -1.054 25806 1320 1 7 . 1 1 221 221 SER CA C 221 63.606 63.606 62.041 1.565 25806 1321 1 7 . 1 1 221 221 SER CB C 221 62.966 62.966 62.475 0.491 25806 1322 1 7 . 1 1 221 221 SER H H 221 8.478 8.478 8.227 0.251 25806 1323 1 7 . 1 1 222 222 ALA N N 222 124.323 124.323 123.827 0.496 25806 1324 1 7 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.190 -0.223 25806 1325 1 7 . 1 1 222 222 ALA C C 222 178.799 178.799 179.723 -0.924 25806 1326 1 7 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.729 1.067 25806 1327 1 7 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.269 -0.266 25806 1328 1 7 . 1 1 222 222 ALA H H 222 8.160 8.160 7.479 0.681 25806 1329 1 7 . 1 1 223 223 VAL N N 223 116.763 116.763 120.151 -3.388 25806 1330 1 7 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.663 -0.129 25806 1331 1 7 . 1 1 223 223 VAL C C 223 177.402 177.402 177.955 -0.553 25806 1332 1 7 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.704 0.689 25806 1333 1 7 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.595 -0.278 25806 1334 1 7 . 1 1 223 223 VAL H H 223 8.274 8.274 8.064 0.210 25806 1335 1 7 . 1 1 224 224 ILE N N 224 118.686 118.686 117.324 1.362 25806 1336 1 7 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.807 -0.174 25806 1337 1 7 . 1 1 224 224 ILE C C 224 177.422 177.422 177.576 -0.154 25806 1338 1 7 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.823 1.004 25806 1339 1 7 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.080 0.221 25806 1340 1 7 . 1 1 224 224 ILE H H 224 8.375 8.375 8.465 -0.090 25806 1341 1 7 . 1 1 225 225 CYS N N 225 116.617 116.617 118.248 -1.631 25806 1342 1 7 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.112 -0.094 25806 1343 1 7 . 1 1 225 225 CYS C C 225 176.120 176.120 176.856 -0.736 25806 1344 1 7 . 1 1 225 225 CYS CA C 225 65.013 65.013 63.367 1.646 25806 1345 1 7 . 1 1 225 225 CYS CB C 225 26.856 26.856 27.189 -0.333 25806 1346 1 7 . 1 1 225 225 CYS H H 225 8.202 8.202 7.529 0.673 25806 1347 1 7 . 1 1 226 226 LEU N N 226 118.552 118.552 121.443 -2.891 25806 1348 1 7 . 1 1 226 226 LEU HA H 226 4.016 4.016 4.026 -0.010 25806 1349 1 7 . 1 1 226 226 LEU C C 226 177.990 177.990 178.585 -0.595 25806 1350 1 7 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.417 0.142 25806 1351 1 7 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.266 -0.517 25806 1352 1 7 . 1 1 226 226 LEU H H 226 8.210 8.210 7.611 0.599 25806 1353 1 7 . 1 1 227 227 ILE N N 227 118.243 118.243 117.543 0.700 25806 1354 1 7 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.863 -0.039 25806 1355 1 7 . 1 1 227 227 ILE C C 227 177.429 177.429 177.944 -0.515 25806 1356 1 7 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.359 0.490 25806 1357 1 7 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.556 -0.014 25806 1358 1 7 . 1 1 227 227 ILE H H 227 8.233 8.233 7.955 0.278 25806 1359 1 7 . 1 1 228 228 ILE N N 228 118.904 118.904 119.782 -0.878 25806 1360 1 7 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.698 -0.002 25806 1361 1 7 . 1 1 228 228 ILE C C 228 177.269 177.269 177.780 -0.511 25806 1362 1 7 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.147 1.078 25806 1363 1 7 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.479 -0.029 25806 1364 1 7 . 1 1 228 228 ILE H H 228 8.161 8.161 7.630 0.531 25806 1365 1 7 . 1 1 229 229 VAL N N 229 118.028 118.028 118.922 -0.894 25806 1366 1 7 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.611 -0.038 25806 1367 1 7 . 1 1 229 229 VAL C C 229 177.312 177.312 178.148 -0.836 25806 1368 1 7 . 1 1 229 229 VAL CA C 229 67.509 67.509 66.382 1.127 25806 1369 1 7 . 1 1 229 229 VAL CB C 229 31.319 31.319 31.198 0.121 25806 1370 1 7 . 1 1 229 229 VAL H H 229 8.366 8.366 7.442 0.924 25806 1371 1 7 . 1 1 230 230 TRP N N 230 120.511 120.511 120.179 0.332 25806 1372 1 7 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.404 -0.110 25806 1373 1 7 . 1 1 230 230 TRP C C 230 177.236 177.236 177.896 -0.660 25806 1374 1 7 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.306 0.486 25806 1375 1 7 . 1 1 230 230 TRP CB C 230 29.170 29.170 29.009 0.161 25806 1376 1 7 . 1 1 230 230 TRP H H 230 8.618 8.618 7.617 1.000 25806 1377 1 7 . 1 1 231 231 ALA N N 231 119.679 119.679 119.340 0.339 25806 1378 1 7 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.237 -0.494 25806 1379 1 7 . 1 1 231 231 ALA C C 231 179.679 179.679 178.160 1.519 25806 1380 1 7 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.563 0.996 25806 1381 1 7 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.439 0.036 25806 1382 1 7 . 1 1 231 231 ALA H H 231 8.728 8.728 8.348 0.380 25806 1383 1 7 . 1 1 232 232 VAL N N 232 115.974 115.974 114.861 1.113 25806 1384 1 7 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.199 -0.466 25806 1385 1 7 . 1 1 232 232 VAL C C 232 178.103 178.103 175.463 2.640 25806 1386 1 7 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.343 3.795 25806 1387 1 7 . 1 1 232 232 VAL CB C 232 31.855 31.855 33.026 -1.171 25806 1388 1 7 . 1 1 232 232 VAL H H 232 8.453 8.453 7.246 1.207 25806 1389 1 7 . 1 1 233 233 ALA N N 233 122.331 122.331 121.806 0.525 25806 1390 1 7 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.639 -0.464 25806 1391 1 7 . 1 1 233 233 ALA C C 233 179.434 179.434 177.735 1.699 25806 1392 1 7 . 1 1 233 233 ALA CA C 233 54.989 54.989 52.758 2.231 25806 1393 1 7 . 1 1 233 233 ALA CB C 233 18.603 18.603 20.156 -1.553 25806 1394 1 7 . 1 1 233 233 ALA H H 233 8.472 8.472 7.668 0.804 25806 1395 1 7 . 1 1 234 234 LEU N N 234 116.926 116.926 118.033 -1.107 25806 1396 1 7 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.629 -0.451 25806 1397 1 7 . 1 1 234 234 LEU C C 234 179.118 179.118 177.052 2.066 25806 1398 1 7 . 1 1 234 234 LEU CA C 234 57.066 57.066 55.936 1.130 25806 1399 1 7 . 1 1 234 234 LEU CB C 234 42.156 42.156 43.123 -0.967 25806 1400 1 7 . 1 1 234 234 LEU H H 234 8.208 8.208 7.951 0.257 25806 1401 1 7 . 1 1 235 235 LYS N N 235 117.891 117.891 120.619 -2.728 25806 1402 1 7 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.570 -0.382 25806 1403 1 7 . 1 1 235 235 LYS C C 235 178.315 178.315 176.819 1.496 25806 1404 1 7 . 1 1 235 235 LYS CA C 235 57.085 57.085 54.858 2.227 25806 1405 1 7 . 1 1 235 235 LYS CB C 235 32.014 32.014 31.912 0.102 25806 1406 1 7 . 1 1 235 235 LYS H H 235 7.857 7.857 8.039 -0.182 25806 1407 1 7 . 1 1 236 236 GLY N N 236 107.369 107.369 106.344 1.025 25806 1408 1 7 . 1 1 236 236 GLY C C 236 174.493 174.493 173.842 0.651 25806 1409 1 7 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.091 1.263 25806 1410 1 7 . 1 1 236 236 GLY H H 236 8.243 8.243 8.334 -0.091 25806 1411 1 7 . 1 1 237 237 TYR N N 237 119.546 119.546 119.656 -0.110 25806 1412 1 7 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.714 -0.213 25806 1413 1 7 . 1 1 237 237 TYR C C 237 175.646 175.646 176.257 -0.611 25806 1414 1 7 . 1 1 237 237 TYR CA C 237 58.961 58.961 57.246 1.715 25806 1415 1 7 . 1 1 237 237 TYR CB C 237 39.006 39.006 38.844 0.162 25806 1416 1 7 . 1 1 237 237 TYR H H 237 8.029 8.029 7.981 0.048 25806 1417 1 7 . 1 1 238 238 SER N N 238 115.132 115.132 115.790 -0.658 25806 1418 1 7 . 1 1 238 238 SER HA H 238 4.472 4.472 4.078 0.394 25806 1419 1 7 . 1 1 238 238 SER C C 238 174.318 174.318 174.894 -0.576 25806 1420 1 7 . 1 1 238 238 SER CA C 238 58.619 58.619 59.798 -1.179 25806 1421 1 7 . 1 1 238 238 SER CB C 238 63.959 63.959 62.849 1.110 25806 1422 1 7 . 1 1 238 238 SER H H 238 7.946 7.946 8.490 -0.544 25806 1423 1 7 . 1 1 239 239 MET N N 239 121.579 121.579 120.702 0.877 25806 1424 1 7 . 1 1 239 239 MET HA H 239 4.493 4.493 4.531 -0.038 25806 1425 1 7 . 1 1 239 239 MET C C 239 175.102 175.102 175.299 -0.197 25806 1426 1 7 . 1 1 239 239 MET CA C 239 56.084 56.084 54.435 1.649 25806 1427 1 7 . 1 1 239 239 MET CB C 239 33.566 33.566 33.315 0.251 25806 1428 1 7 . 1 1 239 239 MET H H 239 8.194 8.194 7.768 0.426 25806 1429 1 8 . 1 1 205 205 SER CA C 205 58.498 58.498 60.152 -1.654 25806 1430 1 8 . 1 1 205 205 SER CB C 205 64.088 64.088 62.678 1.410 25806 1431 1 8 . 1 1 206 206 PHE N N 206 121.596 121.596 124.836 -3.240 25806 1432 1 8 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.609 0.178 25806 1433 1 8 . 1 1 206 206 PHE C C 206 175.282 175.282 175.271 0.011 25806 1434 1 8 . 1 1 206 206 PHE CA C 206 57.711 57.711 58.565 -0.854 25806 1435 1 8 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.248 0.891 25806 1436 1 8 . 1 1 206 206 PHE H H 206 8.414 8.414 8.257 0.157 25806 1437 1 8 . 1 1 207 207 THR N N 207 116.011 116.011 121.313 -5.302 25806 1438 1 8 . 1 1 207 207 THR HA H 207 4.442 4.442 4.239 0.203 25806 1439 1 8 . 1 1 207 207 THR C C 207 174.188 174.188 173.848 0.340 25806 1440 1 8 . 1 1 207 207 THR CA C 207 61.309 61.309 61.724 -0.416 25806 1441 1 8 . 1 1 207 207 THR CB C 207 70.503 70.503 69.709 0.794 25806 1442 1 8 . 1 1 207 207 THR H H 207 8.233 8.233 8.030 0.203 25806 1443 1 8 . 1 1 208 208 MET N N 208 121.915 121.915 120.498 1.417 25806 1444 1 8 . 1 1 208 208 MET HA H 208 4.475 4.475 4.189 0.286 25806 1445 1 8 . 1 1 208 208 MET C C 208 175.595 175.595 174.479 1.116 25806 1446 1 8 . 1 1 208 208 MET CA C 208 55.865 55.865 55.595 0.270 25806 1447 1 8 . 1 1 208 208 MET CB C 208 32.987 32.987 32.102 0.885 25806 1448 1 8 . 1 1 208 208 MET H H 208 8.474 8.474 8.352 0.122 25806 1449 1 8 . 1 1 209 209 ASN N N 209 119.024 119.024 123.179 -4.155 25806 1450 1 8 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.893 -0.120 25806 1451 1 8 . 1 1 209 209 ASN C C 209 175.125 175.125 174.256 0.869 25806 1452 1 8 . 1 1 209 209 ASN CA C 209 53.389 53.389 53.222 0.167 25806 1453 1 8 . 1 1 209 209 ASN CB C 209 39.165 39.165 39.557 -0.392 25806 1454 1 8 . 1 1 209 209 ASN H H 209 8.274 8.274 8.710 -0.436 25806 1455 1 8 . 1 1 210 210 ASP N N 210 119.941 119.941 122.923 -2.982 25806 1456 1 8 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.733 -0.180 25806 1457 1 8 . 1 1 210 210 ASP C C 210 177.325 177.325 176.726 0.599 25806 1458 1 8 . 1 1 210 210 ASP CA C 210 56.169 56.169 55.085 1.084 25806 1459 1 8 . 1 1 210 210 ASP CB C 210 41.255 41.255 41.401 -0.145 25806 1460 1 8 . 1 1 210 210 ASP H H 210 8.262 8.262 8.743 -0.481 25806 1461 1 8 . 1 1 211 211 THR N N 211 115.882 115.882 116.943 -1.061 25806 1462 1 8 . 1 1 211 211 THR HA H 211 4.107 4.107 4.197 -0.090 25806 1463 1 8 . 1 1 211 211 THR C C 211 175.855 175.855 176.651 -0.796 25806 1464 1 8 . 1 1 211 211 THR CA C 211 65.947 65.947 67.005 -1.058 25806 1465 1 8 . 1 1 211 211 THR CB C 211 68.808 68.808 68.689 0.118 25806 1466 1 8 . 1 1 211 211 THR H H 211 8.320 8.320 8.489 -0.169 25806 1467 1 8 . 1 1 212 212 THR N N 212 115.754 115.754 117.585 -1.831 25806 1468 1 8 . 1 1 212 212 THR HA H 212 4.004 4.004 4.101 -0.097 25806 1469 1 8 . 1 1 212 212 THR C C 212 177.310 177.310 176.328 0.982 25806 1470 1 8 . 1 1 212 212 THR CA C 212 66.199 66.199 65.978 0.221 25806 1471 1 8 . 1 1 212 212 THR CB C 212 68.580 68.580 68.080 0.500 25806 1472 1 8 . 1 1 212 212 THR H H 212 8.216 8.216 8.508 -0.292 25806 1473 1 8 . 1 1 213 213 VAL N N 213 123.471 123.471 120.579 2.892 25806 1474 1 8 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.680 -0.026 25806 1475 1 8 . 1 1 213 213 VAL C C 213 177.157 177.157 177.825 -0.668 25806 1476 1 8 . 1 1 213 213 VAL CA C 213 66.937 66.937 66.000 0.937 25806 1477 1 8 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.248 0.304 25806 1478 1 8 . 1 1 213 213 VAL H H 213 8.090 8.090 7.493 0.597 25806 1479 1 8 . 1 1 214 214 TRP N N 214 119.814 119.814 118.933 0.881 25806 1480 1 8 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.479 -0.058 25806 1481 1 8 . 1 1 214 214 TRP C C 214 178.622 178.622 178.533 0.089 25806 1482 1 8 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.447 0.410 25806 1483 1 8 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.140 0.337 25806 1484 1 8 . 1 1 214 214 TRP H H 214 7.966 7.966 7.891 0.075 25806 1485 1 8 . 1 1 215 215 ILE N N 215 118.030 118.030 121.095 -3.065 25806 1486 1 8 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.626 0.109 25806 1487 1 8 . 1 1 215 215 ILE C C 215 177.589 177.589 177.965 -0.376 25806 1488 1 8 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.772 0.538 25806 1489 1 8 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.551 0.260 25806 1490 1 8 . 1 1 215 215 ILE H H 215 8.388 8.388 7.699 0.689 25806 1491 1 8 . 1 1 216 216 SER N N 216 116.314 116.314 115.173 1.141 25806 1492 1 8 . 1 1 216 216 SER HA H 216 4.083 4.083 4.195 -0.112 25806 1493 1 8 . 1 1 216 216 SER C C 216 175.835 175.835 177.091 -1.256 25806 1494 1 8 . 1 1 216 216 SER CA C 216 63.777 63.777 62.083 1.694 25806 1495 1 8 . 1 1 216 216 SER CB C 216 62.965 62.965 62.698 0.267 25806 1496 1 8 . 1 1 216 216 SER H H 216 8.010 8.010 7.915 0.095 25806 1497 1 8 . 1 1 217 217 VAL N N 217 120.711 120.711 120.974 -0.263 25806 1498 1 8 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.771 -0.194 25806 1499 1 8 . 1 1 217 217 VAL C C 217 178.640 178.640 177.155 1.485 25806 1500 1 8 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.671 1.199 25806 1501 1 8 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.417 0.194 25806 1502 1 8 . 1 1 217 217 VAL H H 217 8.381 8.381 7.284 1.097 25806 1503 1 8 . 1 1 218 218 ALA N N 218 125.445 125.445 123.335 2.110 25806 1504 1 8 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.081 -0.078 25806 1505 1 8 . 1 1 218 218 ALA C C 218 178.882 178.882 179.518 -0.636 25806 1506 1 8 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.224 0.828 25806 1507 1 8 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.302 -0.090 25806 1508 1 8 . 1 1 218 218 ALA H H 218 8.565 8.565 8.014 0.551 25806 1509 1 8 . 1 1 219 219 VAL N N 219 116.767 116.767 118.339 -1.572 25806 1510 1 8 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.674 -0.119 25806 1511 1 8 . 1 1 219 219 VAL C C 219 177.632 177.632 177.718 -0.086 25806 1512 1 8 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.438 0.870 25806 1513 1 8 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.515 -0.104 25806 1514 1 8 . 1 1 219 219 VAL H H 219 8.575 8.575 7.481 1.094 25806 1515 1 8 . 1 1 220 220 LEU N N 220 118.644 118.644 120.145 -1.501 25806 1516 1 8 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.788 0.185 25806 1517 1 8 . 1 1 220 220 LEU C C 220 178.641 178.641 178.904 -0.263 25806 1518 1 8 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.356 0.171 25806 1519 1 8 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.777 1.137 25806 1520 1 8 . 1 1 220 220 LEU H H 220 8.434 8.434 7.322 1.112 25806 1521 1 8 . 1 1 221 221 SER N N 221 114.238 114.238 114.870 -0.632 25806 1522 1 8 . 1 1 221 221 SER HA H 221 4.026 4.026 4.089 -0.063 25806 1523 1 8 . 1 1 221 221 SER C C 221 175.620 175.620 176.463 -0.843 25806 1524 1 8 . 1 1 221 221 SER CA C 221 63.606 63.606 62.216 1.390 25806 1525 1 8 . 1 1 221 221 SER CB C 221 62.966 62.966 62.620 0.346 25806 1526 1 8 . 1 1 221 221 SER H H 221 8.478 8.478 8.061 0.417 25806 1527 1 8 . 1 1 222 222 ALA N N 222 124.323 124.323 123.896 0.427 25806 1528 1 8 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.182 -0.215 25806 1529 1 8 . 1 1 222 222 ALA C C 222 178.799 178.799 179.345 -0.546 25806 1530 1 8 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.576 1.220 25806 1531 1 8 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.277 -0.274 25806 1532 1 8 . 1 1 222 222 ALA H H 222 8.160 8.160 7.380 0.780 25806 1533 1 8 . 1 1 223 223 VAL N N 223 116.763 116.763 119.997 -3.234 25806 1534 1 8 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.590 -0.056 25806 1535 1 8 . 1 1 223 223 VAL C C 223 177.402 177.402 177.872 -0.470 25806 1536 1 8 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.918 0.475 25806 1537 1 8 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.947 -0.630 25806 1538 1 8 . 1 1 223 223 VAL H H 223 8.274 8.274 8.041 0.233 25806 1539 1 8 . 1 1 224 224 ILE N N 224 118.686 118.686 116.498 2.188 25806 1540 1 8 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.818 -0.185 25806 1541 1 8 . 1 1 224 224 ILE C C 224 177.422 177.422 177.566 -0.144 25806 1542 1 8 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.584 1.243 25806 1543 1 8 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.195 0.106 25806 1544 1 8 . 1 1 224 224 ILE H H 224 8.375 8.375 8.396 -0.021 25806 1545 1 8 . 1 1 225 225 CYS N N 225 116.617 116.617 119.109 -2.492 25806 1546 1 8 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.110 -0.092 25806 1547 1 8 . 1 1 225 225 CYS C C 225 176.120 176.120 177.161 -1.041 25806 1548 1 8 . 1 1 225 225 CYS CA C 225 65.013 65.013 64.099 0.914 25806 1549 1 8 . 1 1 225 225 CYS CB C 225 26.856 26.856 26.840 0.017 25806 1550 1 8 . 1 1 225 225 CYS H H 225 8.202 8.202 7.418 0.784 25806 1551 1 8 . 1 1 226 226 LEU N N 226 118.552 118.552 121.910 -3.358 25806 1552 1 8 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.951 0.065 25806 1553 1 8 . 1 1 226 226 LEU C C 226 177.990 177.990 178.901 -0.911 25806 1554 1 8 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.690 -0.131 25806 1555 1 8 . 1 1 226 226 LEU CB C 226 41.749 41.749 41.984 -0.235 25806 1556 1 8 . 1 1 226 226 LEU H H 226 8.210 8.210 7.838 0.372 25806 1557 1 8 . 1 1 227 227 ILE N N 227 118.243 118.243 117.066 1.177 25806 1558 1 8 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.901 -0.077 25806 1559 1 8 . 1 1 227 227 ILE C C 227 177.429 177.429 177.930 -0.501 25806 1560 1 8 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.299 0.550 25806 1561 1 8 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.562 -0.020 25806 1562 1 8 . 1 1 227 227 ILE H H 227 8.233 8.233 7.625 0.608 25806 1563 1 8 . 1 1 228 228 ILE N N 228 118.904 118.904 119.940 -1.036 25806 1564 1 8 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.717 -0.021 25806 1565 1 8 . 1 1 228 228 ILE C C 228 177.269 177.269 178.041 -0.772 25806 1566 1 8 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.287 0.938 25806 1567 1 8 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.446 0.004 25806 1568 1 8 . 1 1 228 228 ILE H H 228 8.161 8.161 7.606 0.555 25806 1569 1 8 . 1 1 229 229 VAL N N 229 118.028 118.028 118.691 -0.663 25806 1570 1 8 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.612 -0.039 25806 1571 1 8 . 1 1 229 229 VAL C C 229 177.312 177.312 178.364 -1.052 25806 1572 1 8 . 1 1 229 229 VAL CA C 229 67.509 67.509 65.990 1.519 25806 1573 1 8 . 1 1 229 229 VAL CB C 229 31.319 31.319 30.758 0.561 25806 1574 1 8 . 1 1 229 229 VAL H H 229 8.366 8.366 7.401 0.965 25806 1575 1 8 . 1 1 230 230 TRP N N 230 120.511 120.511 120.260 0.251 25806 1576 1 8 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.438 -0.144 25806 1577 1 8 . 1 1 230 230 TRP C C 230 177.236 177.236 177.874 -0.638 25806 1578 1 8 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.343 0.450 25806 1579 1 8 . 1 1 230 230 TRP CB C 230 29.170 29.170 29.133 0.037 25806 1580 1 8 . 1 1 230 230 TRP H H 230 8.618 8.618 7.576 1.042 25806 1581 1 8 . 1 1 231 231 ALA N N 231 119.679 119.679 119.829 -0.150 25806 1582 1 8 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.245 -0.503 25806 1583 1 8 . 1 1 231 231 ALA C C 231 179.679 179.679 178.588 1.091 25806 1584 1 8 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.584 0.975 25806 1585 1 8 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.527 -0.052 25806 1586 1 8 . 1 1 231 231 ALA H H 231 8.728 8.728 8.414 0.314 25806 1587 1 8 . 1 1 232 232 VAL N N 232 115.974 115.974 114.754 1.220 25806 1588 1 8 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.262 -0.529 25806 1589 1 8 . 1 1 232 232 VAL C C 232 178.103 178.103 175.001 3.102 25806 1590 1 8 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.278 3.860 25806 1591 1 8 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.624 -0.769 25806 1592 1 8 . 1 1 232 232 VAL H H 232 8.453 8.453 7.486 0.967 25806 1593 1 8 . 1 1 233 233 ALA N N 233 122.331 122.331 122.072 0.259 25806 1594 1 8 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.819 -0.644 25806 1595 1 8 . 1 1 233 233 ALA C C 233 179.434 179.434 177.724 1.710 25806 1596 1 8 . 1 1 233 233 ALA CA C 233 54.989 54.989 53.164 1.825 25806 1597 1 8 . 1 1 233 233 ALA CB C 233 18.603 18.603 19.822 -1.218 25806 1598 1 8 . 1 1 233 233 ALA H H 233 8.472 8.472 7.719 0.753 25806 1599 1 8 . 1 1 234 234 LEU N N 234 116.926 116.926 117.617 -0.691 25806 1600 1 8 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.519 -0.341 25806 1601 1 8 . 1 1 234 234 LEU C C 234 179.118 179.118 177.585 1.533 25806 1602 1 8 . 1 1 234 234 LEU CA C 234 57.066 57.066 56.135 0.931 25806 1603 1 8 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.623 -0.467 25806 1604 1 8 . 1 1 234 234 LEU H H 234 8.208 8.208 8.108 0.100 25806 1605 1 8 . 1 1 235 235 LYS N N 235 117.891 117.891 120.232 -2.341 25806 1606 1 8 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.453 -0.265 25806 1607 1 8 . 1 1 235 235 LYS C C 235 178.315 178.315 176.438 1.877 25806 1608 1 8 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.393 1.692 25806 1609 1 8 . 1 1 235 235 LYS CB C 235 32.014 32.014 33.133 -1.119 25806 1610 1 8 . 1 1 235 235 LYS H H 235 7.857 7.857 7.925 -0.068 25806 1611 1 8 . 1 1 236 236 GLY N N 236 107.369 107.369 108.067 -0.698 25806 1612 1 8 . 1 1 236 236 GLY C C 236 174.493 174.493 174.900 -0.407 25806 1613 1 8 . 1 1 236 236 GLY CA C 236 46.354 46.354 44.956 1.398 25806 1614 1 8 . 1 1 236 236 GLY H H 236 8.243 8.243 8.027 0.216 25806 1615 1 8 . 1 1 237 237 TYR N N 237 119.546 119.546 120.463 -0.917 25806 1616 1 8 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.478 0.023 25806 1617 1 8 . 1 1 237 237 TYR C C 237 175.646 175.646 176.381 -0.735 25806 1618 1 8 . 1 1 237 237 TYR CA C 237 58.961 58.961 57.844 1.117 25806 1619 1 8 . 1 1 237 237 TYR CB C 237 39.006 39.006 37.636 1.370 25806 1620 1 8 . 1 1 237 237 TYR H H 237 8.029 8.029 8.777 -0.748 25806 1621 1 8 . 1 1 238 238 SER N N 238 115.132 115.132 116.823 -1.691 25806 1622 1 8 . 1 1 238 238 SER HA H 238 4.472 4.472 4.105 0.367 25806 1623 1 8 . 1 1 238 238 SER C C 238 174.318 174.318 174.684 -0.366 25806 1624 1 8 . 1 1 238 238 SER CA C 238 58.619 58.619 60.598 -1.979 25806 1625 1 8 . 1 1 238 238 SER CB C 238 63.959 63.959 63.038 0.921 25806 1626 1 8 . 1 1 238 238 SER H H 238 7.946 7.946 8.031 -0.085 25806 1627 1 8 . 1 1 239 239 MET N N 239 121.579 121.579 120.497 1.082 25806 1628 1 8 . 1 1 239 239 MET HA H 239 4.493 4.493 4.605 -0.112 25806 1629 1 8 . 1 1 239 239 MET C C 239 175.102 175.102 175.426 -0.324 25806 1630 1 8 . 1 1 239 239 MET CA C 239 56.084 56.084 54.727 1.357 25806 1631 1 8 . 1 1 239 239 MET CB C 239 33.566 33.566 33.474 0.092 25806 1632 1 8 . 1 1 239 239 MET H H 239 8.194 8.194 7.507 0.687 25806 1633 1 9 . 1 1 205 205 SER CA C 205 58.498 58.498 57.827 0.671 25806 1634 1 9 . 1 1 205 205 SER CB C 205 64.088 64.088 64.903 -0.815 25806 1635 1 9 . 1 1 206 206 PHE N N 206 121.596 121.596 122.850 -1.254 25806 1636 1 9 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.696 0.091 25806 1637 1 9 . 1 1 206 206 PHE C C 206 175.282 175.282 175.256 0.026 25806 1638 1 9 . 1 1 206 206 PHE CA C 206 57.711 57.711 58.030 -0.319 25806 1639 1 9 . 1 1 206 206 PHE CB C 206 40.139 40.139 41.664 -1.525 25806 1640 1 9 . 1 1 206 206 PHE H H 206 8.414 8.414 8.367 0.047 25806 1641 1 9 . 1 1 207 207 THR N N 207 116.011 116.011 120.435 -4.424 25806 1642 1 9 . 1 1 207 207 THR HA H 207 4.442 4.442 4.682 -0.240 25806 1643 1 9 . 1 1 207 207 THR C C 207 174.188 174.188 175.039 -0.851 25806 1644 1 9 . 1 1 207 207 THR CA C 207 61.309 61.309 61.549 -0.240 25806 1645 1 9 . 1 1 207 207 THR CB C 207 70.503 70.503 70.152 0.351 25806 1646 1 9 . 1 1 207 207 THR H H 207 8.233 8.233 8.488 -0.255 25806 1647 1 9 . 1 1 208 208 MET N N 208 121.915 121.915 120.146 1.769 25806 1648 1 9 . 1 1 208 208 MET HA H 208 4.475 4.475 4.045 0.430 25806 1649 1 9 . 1 1 208 208 MET C C 208 175.595 175.595 176.464 -0.869 25806 1650 1 9 . 1 1 208 208 MET CA C 208 55.865 55.865 57.248 -1.383 25806 1651 1 9 . 1 1 208 208 MET CB C 208 32.987 32.987 30.526 2.461 25806 1652 1 9 . 1 1 208 208 MET H H 208 8.474 8.474 8.821 -0.347 25806 1653 1 9 . 1 1 209 209 ASN N N 209 119.024 119.024 121.979 -2.955 25806 1654 1 9 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.643 0.130 25806 1655 1 9 . 1 1 209 209 ASN C C 209 175.125 175.125 174.472 0.653 25806 1656 1 9 . 1 1 209 209 ASN CA C 209 53.389 53.389 53.714 -0.325 25806 1657 1 9 . 1 1 209 209 ASN CB C 209 39.165 39.165 38.881 0.284 25806 1658 1 9 . 1 1 209 209 ASN H H 209 8.274 8.274 8.170 0.104 25806 1659 1 9 . 1 1 210 210 ASP N N 210 119.941 119.941 119.453 0.488 25806 1660 1 9 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.577 -0.024 25806 1661 1 9 . 1 1 210 210 ASP C C 210 177.325 177.325 176.290 1.035 25806 1662 1 9 . 1 1 210 210 ASP CA C 210 56.169 56.169 54.476 1.693 25806 1663 1 9 . 1 1 210 210 ASP CB C 210 41.255 41.255 41.000 0.255 25806 1664 1 9 . 1 1 210 210 ASP H H 210 8.262 8.262 8.536 -0.274 25806 1665 1 9 . 1 1 211 211 THR N N 211 115.882 115.882 116.097 -0.215 25806 1666 1 9 . 1 1 211 211 THR HA H 211 4.107 4.107 4.298 -0.191 25806 1667 1 9 . 1 1 211 211 THR C C 211 175.855 175.855 176.511 -0.656 25806 1668 1 9 . 1 1 211 211 THR CA C 211 65.947 65.947 66.106 -0.159 25806 1669 1 9 . 1 1 211 211 THR CB C 211 68.808 68.808 68.674 0.134 25806 1670 1 9 . 1 1 211 211 THR H H 211 8.320 8.320 8.034 0.286 25806 1671 1 9 . 1 1 212 212 THR N N 212 115.754 115.754 117.829 -2.075 25806 1672 1 9 . 1 1 212 212 THR HA H 212 4.004 4.004 4.061 -0.057 25806 1673 1 9 . 1 1 212 212 THR C C 212 177.310 177.310 176.209 1.101 25806 1674 1 9 . 1 1 212 212 THR CA C 212 66.199 66.199 65.933 0.265 25806 1675 1 9 . 1 1 212 212 THR CB C 212 68.580 68.580 67.987 0.593 25806 1676 1 9 . 1 1 212 212 THR H H 212 8.216 8.216 8.469 -0.253 25806 1677 1 9 . 1 1 213 213 VAL N N 213 123.471 123.471 120.557 2.914 25806 1678 1 9 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.591 0.063 25806 1679 1 9 . 1 1 213 213 VAL C C 213 177.157 177.157 177.958 -0.801 25806 1680 1 9 . 1 1 213 213 VAL CA C 213 66.937 66.937 65.677 1.260 25806 1681 1 9 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.198 0.354 25806 1682 1 9 . 1 1 213 213 VAL H H 213 8.090 8.090 7.179 0.911 25806 1683 1 9 . 1 1 214 214 TRP N N 214 119.814 119.814 118.906 0.908 25806 1684 1 9 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.489 -0.068 25806 1685 1 9 . 1 1 214 214 TRP C C 214 178.622 178.622 178.625 -0.003 25806 1686 1 9 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.625 0.232 25806 1687 1 9 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.200 0.278 25806 1688 1 9 . 1 1 214 214 TRP H H 214 7.966 7.966 7.933 0.033 25806 1689 1 9 . 1 1 215 215 ILE N N 215 118.030 118.030 121.238 -3.208 25806 1690 1 9 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.602 0.133 25806 1691 1 9 . 1 1 215 215 ILE C C 215 177.589 177.589 177.900 -0.311 25806 1692 1 9 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.692 0.618 25806 1693 1 9 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.576 0.235 25806 1694 1 9 . 1 1 215 215 ILE H H 215 8.388 8.388 7.612 0.776 25806 1695 1 9 . 1 1 216 216 SER N N 216 116.314 116.314 115.754 0.560 25806 1696 1 9 . 1 1 216 216 SER HA H 216 4.083 4.083 4.152 -0.069 25806 1697 1 9 . 1 1 216 216 SER C C 216 175.835 175.835 177.091 -1.256 25806 1698 1 9 . 1 1 216 216 SER CA C 216 63.777 63.777 62.165 1.612 25806 1699 1 9 . 1 1 216 216 SER CB C 216 62.965 62.965 62.761 0.204 25806 1700 1 9 . 1 1 216 216 SER H H 216 8.010 8.010 8.255 -0.245 25806 1701 1 9 . 1 1 217 217 VAL N N 217 120.711 120.711 122.365 -1.654 25806 1702 1 9 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.869 -0.292 25806 1703 1 9 . 1 1 217 217 VAL C C 217 178.640 178.640 177.586 1.054 25806 1704 1 9 . 1 1 217 217 VAL CA C 217 66.870 66.870 64.515 2.355 25806 1705 1 9 . 1 1 217 217 VAL CB C 217 31.611 31.611 30.869 0.742 25806 1706 1 9 . 1 1 217 217 VAL H H 217 8.381 8.381 7.299 1.082 25806 1707 1 9 . 1 1 218 218 ALA N N 218 125.445 125.445 123.714 1.731 25806 1708 1 9 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.090 -0.087 25806 1709 1 9 . 1 1 218 218 ALA C C 218 178.882 178.882 179.981 -1.099 25806 1710 1 9 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.240 0.812 25806 1711 1 9 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.278 -0.066 25806 1712 1 9 . 1 1 218 218 ALA H H 218 8.565 8.565 7.941 0.624 25806 1713 1 9 . 1 1 219 219 VAL N N 219 116.767 116.767 118.135 -1.368 25806 1714 1 9 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.572 -0.017 25806 1715 1 9 . 1 1 219 219 VAL C C 219 177.632 177.632 177.929 -0.297 25806 1716 1 9 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.198 1.110 25806 1717 1 9 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.571 -0.160 25806 1718 1 9 . 1 1 219 219 VAL H H 219 8.575 8.575 7.578 0.997 25806 1719 1 9 . 1 1 220 220 LEU N N 220 118.644 118.644 119.873 -1.229 25806 1720 1 9 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.832 0.141 25806 1721 1 9 . 1 1 220 220 LEU C C 220 178.641 178.641 178.974 -0.333 25806 1722 1 9 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.287 0.240 25806 1723 1 9 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.840 1.074 25806 1724 1 9 . 1 1 220 220 LEU H H 220 8.434 8.434 7.452 0.982 25806 1725 1 9 . 1 1 221 221 SER N N 221 114.238 114.238 114.718 -0.480 25806 1726 1 9 . 1 1 221 221 SER HA H 221 4.026 4.026 4.088 -0.062 25806 1727 1 9 . 1 1 221 221 SER C C 221 175.620 175.620 176.631 -1.011 25806 1728 1 9 . 1 1 221 221 SER CA C 221 63.606 63.606 61.863 1.743 25806 1729 1 9 . 1 1 221 221 SER CB C 221 62.966 62.966 62.868 0.098 25806 1730 1 9 . 1 1 221 221 SER H H 221 8.478 8.478 7.946 0.532 25806 1731 1 9 . 1 1 222 222 ALA N N 222 124.323 124.323 124.216 0.107 25806 1732 1 9 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.190 -0.223 25806 1733 1 9 . 1 1 222 222 ALA C C 222 178.799 178.799 179.481 -0.682 25806 1734 1 9 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.599 1.197 25806 1735 1 9 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.320 -0.317 25806 1736 1 9 . 1 1 222 222 ALA H H 222 8.160 8.160 7.478 0.682 25806 1737 1 9 . 1 1 223 223 VAL N N 223 116.763 116.763 120.020 -3.257 25806 1738 1 9 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.594 -0.060 25806 1739 1 9 . 1 1 223 223 VAL C C 223 177.402 177.402 177.870 -0.468 25806 1740 1 9 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.891 0.502 25806 1741 1 9 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.924 -0.607 25806 1742 1 9 . 1 1 223 223 VAL H H 223 8.274 8.274 8.081 0.193 25806 1743 1 9 . 1 1 224 224 ILE N N 224 118.686 118.686 117.229 1.457 25806 1744 1 9 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.783 -0.150 25806 1745 1 9 . 1 1 224 224 ILE C C 224 177.422 177.422 177.539 -0.117 25806 1746 1 9 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.727 1.100 25806 1747 1 9 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.115 0.186 25806 1748 1 9 . 1 1 224 224 ILE H H 224 8.375 8.375 8.633 -0.258 25806 1749 1 9 . 1 1 225 225 CYS N N 225 116.617 116.617 118.451 -1.834 25806 1750 1 9 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.196 -0.178 25806 1751 1 9 . 1 1 225 225 CYS C C 225 176.120 176.120 176.639 -0.519 25806 1752 1 9 . 1 1 225 225 CYS CA C 225 65.013 65.013 61.979 3.034 25806 1753 1 9 . 1 1 225 225 CYS CB C 225 26.856 26.856 26.375 0.481 25806 1754 1 9 . 1 1 225 225 CYS H H 225 8.202 8.202 7.618 0.584 25806 1755 1 9 . 1 1 226 226 LEU N N 226 118.552 118.552 121.373 -2.821 25806 1756 1 9 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.927 0.089 25806 1757 1 9 . 1 1 226 226 LEU C C 226 177.990 177.990 178.791 -0.801 25806 1758 1 9 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.300 0.259 25806 1759 1 9 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.229 -0.480 25806 1760 1 9 . 1 1 226 226 LEU H H 226 8.210 8.210 7.578 0.632 25806 1761 1 9 . 1 1 227 227 ILE N N 227 118.243 118.243 117.785 0.458 25806 1762 1 9 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.942 -0.118 25806 1763 1 9 . 1 1 227 227 ILE C C 227 177.429 177.429 177.879 -0.450 25806 1764 1 9 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.458 0.391 25806 1765 1 9 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.593 -0.051 25806 1766 1 9 . 1 1 227 227 ILE H H 227 8.233 8.233 8.224 0.009 25806 1767 1 9 . 1 1 228 228 ILE N N 228 118.904 118.904 120.073 -1.169 25806 1768 1 9 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.709 -0.013 25806 1769 1 9 . 1 1 228 228 ILE C C 228 177.269 177.269 177.932 -0.663 25806 1770 1 9 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.191 1.034 25806 1771 1 9 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.462 -0.012 25806 1772 1 9 . 1 1 228 228 ILE H H 228 8.161 8.161 7.651 0.510 25806 1773 1 9 . 1 1 229 229 VAL N N 229 118.028 118.028 118.966 -0.938 25806 1774 1 9 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.644 -0.071 25806 1775 1 9 . 1 1 229 229 VAL C C 229 177.312 177.312 178.046 -0.734 25806 1776 1 9 . 1 1 229 229 VAL CA C 229 67.509 67.509 66.370 1.139 25806 1777 1 9 . 1 1 229 229 VAL CB C 229 31.319 31.319 31.169 0.150 25806 1778 1 9 . 1 1 229 229 VAL H H 229 8.366 8.366 7.257 1.109 25806 1779 1 9 . 1 1 230 230 TRP N N 230 120.511 120.511 120.158 0.353 25806 1780 1 9 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.466 -0.172 25806 1781 1 9 . 1 1 230 230 TRP C C 230 177.236 177.236 177.948 -0.712 25806 1782 1 9 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.131 0.662 25806 1783 1 9 . 1 1 230 230 TRP CB C 230 29.170 29.170 28.992 0.177 25806 1784 1 9 . 1 1 230 230 TRP H H 230 8.618 8.618 7.626 0.992 25806 1785 1 9 . 1 1 231 231 ALA N N 231 119.679 119.679 119.438 0.241 25806 1786 1 9 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.234 -0.492 25806 1787 1 9 . 1 1 231 231 ALA C C 231 179.679 179.679 178.206 1.473 25806 1788 1 9 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.646 0.913 25806 1789 1 9 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.447 0.028 25806 1790 1 9 . 1 1 231 231 ALA H H 231 8.728 8.728 8.488 0.240 25806 1791 1 9 . 1 1 232 232 VAL N N 232 115.974 115.974 115.190 0.784 25806 1792 1 9 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.241 -0.508 25806 1793 1 9 . 1 1 232 232 VAL C C 232 178.103 178.103 175.270 2.833 25806 1794 1 9 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.579 3.559 25806 1795 1 9 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.871 -1.016 25806 1796 1 9 . 1 1 232 232 VAL H H 232 8.453 8.453 7.234 1.219 25806 1797 1 9 . 1 1 233 233 ALA N N 233 122.331 122.331 122.268 0.063 25806 1798 1 9 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.692 -0.517 25806 1799 1 9 . 1 1 233 233 ALA C C 233 179.434 179.434 177.639 1.795 25806 1800 1 9 . 1 1 233 233 ALA CA C 233 54.989 54.989 53.914 1.075 25806 1801 1 9 . 1 1 233 233 ALA CB C 233 18.603 18.603 19.729 -1.126 25806 1802 1 9 . 1 1 233 233 ALA H H 233 8.472 8.472 7.846 0.626 25806 1803 1 9 . 1 1 234 234 LEU N N 234 116.926 116.926 118.167 -1.241 25806 1804 1 9 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.542 -0.364 25806 1805 1 9 . 1 1 234 234 LEU C C 234 179.118 179.118 177.598 1.520 25806 1806 1 9 . 1 1 234 234 LEU CA C 234 57.066 57.066 55.776 1.290 25806 1807 1 9 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.845 -0.689 25806 1808 1 9 . 1 1 234 234 LEU H H 234 8.208 8.208 8.154 0.054 25806 1809 1 9 . 1 1 235 235 LYS N N 235 117.891 117.891 119.576 -1.685 25806 1810 1 9 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.431 -0.243 25806 1811 1 9 . 1 1 235 235 LYS C C 235 178.315 178.315 176.874 1.441 25806 1812 1 9 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.971 1.114 25806 1813 1 9 . 1 1 235 235 LYS CB C 235 32.014 32.014 32.995 -0.981 25806 1814 1 9 . 1 1 235 235 LYS H H 235 7.857 7.857 7.963 -0.106 25806 1815 1 9 . 1 1 236 236 GLY N N 236 107.369 107.369 106.142 1.227 25806 1816 1 9 . 1 1 236 236 GLY C C 236 174.493 174.493 173.313 1.180 25806 1817 1 9 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.305 1.049 25806 1818 1 9 . 1 1 236 236 GLY H H 236 8.243 8.243 7.881 0.362 25806 1819 1 9 . 1 1 237 237 TYR N N 237 119.546 119.546 115.903 3.643 25806 1820 1 9 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.146 0.355 25806 1821 1 9 . 1 1 237 237 TYR C C 237 175.646 175.646 175.689 -0.043 25806 1822 1 9 . 1 1 237 237 TYR CA C 237 58.961 58.961 57.484 1.477 25806 1823 1 9 . 1 1 237 237 TYR CB C 237 39.006 39.006 35.116 3.890 25806 1824 1 9 . 1 1 237 237 TYR H H 237 8.029 8.029 7.831 0.198 25806 1825 1 9 . 1 1 238 238 SER N N 238 115.132 115.132 114.616 0.516 25806 1826 1 9 . 1 1 238 238 SER HA H 238 4.472 4.472 4.395 0.077 25806 1827 1 9 . 1 1 238 238 SER C C 238 174.318 174.318 175.160 -0.842 25806 1828 1 9 . 1 1 238 238 SER CA C 238 58.619 58.619 60.029 -1.410 25806 1829 1 9 . 1 1 238 238 SER CB C 238 63.959 63.959 63.596 0.362 25806 1830 1 9 . 1 1 238 238 SER H H 238 7.946 7.946 8.452 -0.506 25806 1831 1 9 . 1 1 239 239 MET N N 239 121.579 121.579 121.067 0.512 25806 1832 1 9 . 1 1 239 239 MET HA H 239 4.493 4.493 4.646 -0.153 25806 1833 1 9 . 1 1 239 239 MET C C 239 175.102 175.102 175.412 -0.310 25806 1834 1 9 . 1 1 239 239 MET CA C 239 56.084 56.084 55.001 1.083 25806 1835 1 9 . 1 1 239 239 MET CB C 239 33.566 33.566 32.594 0.972 25806 1836 1 9 . 1 1 239 239 MET H H 239 8.194 8.194 8.256 -0.062 25806 1837 1 10 . 1 1 205 205 SER CA C 205 58.498 58.498 58.235 0.263 25806 1838 1 10 . 1 1 205 205 SER CB C 205 64.088 64.088 64.020 0.067 25806 1839 1 10 . 1 1 206 206 PHE N N 206 121.596 121.596 120.992 0.604 25806 1840 1 10 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.410 0.377 25806 1841 1 10 . 1 1 206 206 PHE C C 206 175.282 175.282 174.241 1.041 25806 1842 1 10 . 1 1 206 206 PHE CA C 206 57.711 57.711 58.222 -0.511 25806 1843 1 10 . 1 1 206 206 PHE CB C 206 40.139 40.139 38.659 1.480 25806 1844 1 10 . 1 1 206 206 PHE H H 206 8.414 8.414 7.762 0.652 25806 1845 1 10 . 1 1 207 207 THR N N 207 116.011 116.011 112.159 3.852 25806 1846 1 10 . 1 1 207 207 THR HA H 207 4.442 4.442 4.594 -0.152 25806 1847 1 10 . 1 1 207 207 THR C C 207 174.188 174.188 173.825 0.363 25806 1848 1 10 . 1 1 207 207 THR CA C 207 61.309 61.309 61.847 -0.538 25806 1849 1 10 . 1 1 207 207 THR CB C 207 70.503 70.503 69.776 0.727 25806 1850 1 10 . 1 1 207 207 THR H H 207 8.233 8.233 8.340 -0.107 25806 1851 1 10 . 1 1 208 208 MET N N 208 121.915 121.915 120.372 1.543 25806 1852 1 10 . 1 1 208 208 MET HA H 208 4.475 4.475 4.628 -0.153 25806 1853 1 10 . 1 1 208 208 MET C C 208 175.595 175.595 175.283 0.312 25806 1854 1 10 . 1 1 208 208 MET CA C 208 55.865 55.865 57.218 -1.353 25806 1855 1 10 . 1 1 208 208 MET CB C 208 32.987 32.987 33.144 -0.157 25806 1856 1 10 . 1 1 208 208 MET H H 208 8.474 8.474 7.866 0.608 25806 1857 1 10 . 1 1 209 209 ASN N N 209 119.024 119.024 119.230 -0.206 25806 1858 1 10 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.625 0.148 25806 1859 1 10 . 1 1 209 209 ASN C C 209 175.125 175.125 176.276 -1.151 25806 1860 1 10 . 1 1 209 209 ASN CA C 209 53.389 53.389 54.351 -0.962 25806 1861 1 10 . 1 1 209 209 ASN CB C 209 39.165 39.165 38.296 0.869 25806 1862 1 10 . 1 1 209 209 ASN H H 209 8.274 8.274 8.529 -0.255 25806 1863 1 10 . 1 1 210 210 ASP N N 210 119.941 119.941 118.241 1.700 25806 1864 1 10 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.403 0.150 25806 1865 1 10 . 1 1 210 210 ASP C C 210 177.325 177.325 177.518 -0.193 25806 1866 1 10 . 1 1 210 210 ASP CA C 210 56.169 56.169 56.384 -0.215 25806 1867 1 10 . 1 1 210 210 ASP CB C 210 41.255 41.255 40.150 1.105 25806 1868 1 10 . 1 1 210 210 ASP H H 210 8.262 8.262 8.634 -0.372 25806 1869 1 10 . 1 1 211 211 THR N N 211 115.882 115.882 117.028 -1.146 25806 1870 1 10 . 1 1 211 211 THR HA H 211 4.107 4.107 4.230 -0.123 25806 1871 1 10 . 1 1 211 211 THR C C 211 175.855 175.855 176.951 -1.096 25806 1872 1 10 . 1 1 211 211 THR CA C 211 65.947 65.947 65.983 -0.036 25806 1873 1 10 . 1 1 211 211 THR CB C 211 68.808 68.808 68.833 -0.025 25806 1874 1 10 . 1 1 211 211 THR H H 211 8.320 8.320 7.644 0.676 25806 1875 1 10 . 1 1 212 212 THR N N 212 115.754 115.754 118.349 -2.595 25806 1876 1 10 . 1 1 212 212 THR HA H 212 4.004 4.004 4.064 -0.060 25806 1877 1 10 . 1 1 212 212 THR C C 212 177.310 177.310 175.779 1.531 25806 1878 1 10 . 1 1 212 212 THR CA C 212 66.199 66.199 66.605 -0.406 25806 1879 1 10 . 1 1 212 212 THR CB C 212 68.580 68.580 68.243 0.338 25806 1880 1 10 . 1 1 212 212 THR H H 212 8.216 8.216 7.966 0.250 25806 1881 1 10 . 1 1 213 213 VAL N N 213 123.471 123.471 120.728 2.743 25806 1882 1 10 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.596 0.058 25806 1883 1 10 . 1 1 213 213 VAL C C 213 177.157 177.157 177.403 -0.246 25806 1884 1 10 . 1 1 213 213 VAL CA C 213 66.937 66.937 65.804 1.133 25806 1885 1 10 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.262 0.289 25806 1886 1 10 . 1 1 213 213 VAL H H 213 8.090 8.090 7.358 0.732 25806 1887 1 10 . 1 1 214 214 TRP N N 214 119.814 119.814 118.695 1.119 25806 1888 1 10 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.484 -0.063 25806 1889 1 10 . 1 1 214 214 TRP C C 214 178.622 178.622 178.472 0.150 25806 1890 1 10 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.220 0.637 25806 1891 1 10 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.354 0.123 25806 1892 1 10 . 1 1 214 214 TRP H H 214 7.966 7.966 7.790 0.176 25806 1893 1 10 . 1 1 215 215 ILE N N 215 118.030 118.030 120.973 -2.943 25806 1894 1 10 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.597 0.138 25806 1895 1 10 . 1 1 215 215 ILE C C 215 177.589 177.589 177.992 -0.403 25806 1896 1 10 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.926 0.384 25806 1897 1 10 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.493 0.318 25806 1898 1 10 . 1 1 215 215 ILE H H 215 8.388 8.388 7.598 0.790 25806 1899 1 10 . 1 1 216 216 SER N N 216 116.314 116.314 115.165 1.149 25806 1900 1 10 . 1 1 216 216 SER HA H 216 4.083 4.083 4.182 -0.099 25806 1901 1 10 . 1 1 216 216 SER C C 216 175.835 175.835 177.057 -1.222 25806 1902 1 10 . 1 1 216 216 SER CA C 216 63.777 63.777 62.198 1.579 25806 1903 1 10 . 1 1 216 216 SER CB C 216 62.965 62.965 62.729 0.236 25806 1904 1 10 . 1 1 216 216 SER H H 216 8.010 8.010 8.041 -0.031 25806 1905 1 10 . 1 1 217 217 VAL N N 217 120.711 120.711 121.110 -0.399 25806 1906 1 10 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.805 -0.228 25806 1907 1 10 . 1 1 217 217 VAL C C 217 178.640 178.640 177.132 1.508 25806 1908 1 10 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.374 1.496 25806 1909 1 10 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.515 0.097 25806 1910 1 10 . 1 1 217 217 VAL H H 217 8.381 8.381 7.433 0.948 25806 1911 1 10 . 1 1 218 218 ALA N N 218 125.445 125.445 123.123 2.322 25806 1912 1 10 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.093 -0.090 25806 1913 1 10 . 1 1 218 218 ALA C C 218 178.882 178.882 179.670 -0.788 25806 1914 1 10 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.401 0.651 25806 1915 1 10 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.166 0.046 25806 1916 1 10 . 1 1 218 218 ALA H H 218 8.565 8.565 7.893 0.672 25806 1917 1 10 . 1 1 219 219 VAL N N 219 116.767 116.767 118.155 -1.388 25806 1918 1 10 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.586 -0.031 25806 1919 1 10 . 1 1 219 219 VAL C C 219 177.632 177.632 177.867 -0.235 25806 1920 1 10 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.156 1.152 25806 1921 1 10 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.543 -0.132 25806 1922 1 10 . 1 1 219 219 VAL H H 219 8.575 8.575 7.714 0.861 25806 1923 1 10 . 1 1 220 220 LEU N N 220 118.644 118.644 119.729 -1.085 25806 1924 1 10 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.852 0.121 25806 1925 1 10 . 1 1 220 220 LEU C C 220 178.641 178.641 178.772 -0.131 25806 1926 1 10 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.279 0.248 25806 1927 1 10 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.906 1.008 25806 1928 1 10 . 1 1 220 220 LEU H H 220 8.434 8.434 7.422 1.012 25806 1929 1 10 . 1 1 221 221 SER N N 221 114.238 114.238 114.502 -0.264 25806 1930 1 10 . 1 1 221 221 SER HA H 221 4.026 4.026 4.087 -0.061 25806 1931 1 10 . 1 1 221 221 SER C C 221 175.620 175.620 176.474 -0.854 25806 1932 1 10 . 1 1 221 221 SER CA C 221 63.606 63.606 61.650 1.956 25806 1933 1 10 . 1 1 221 221 SER CB C 221 62.966 62.966 63.051 -0.085 25806 1934 1 10 . 1 1 221 221 SER H H 221 8.478 8.478 7.813 0.665 25806 1935 1 10 . 1 1 222 222 ALA N N 222 124.323 124.323 123.825 0.498 25806 1936 1 10 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.197 -0.230 25806 1937 1 10 . 1 1 222 222 ALA C C 222 178.799 178.799 179.729 -0.930 25806 1938 1 10 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.627 1.169 25806 1939 1 10 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.359 -0.356 25806 1940 1 10 . 1 1 222 222 ALA H H 222 8.160 8.160 7.276 0.884 25806 1941 1 10 . 1 1 223 223 VAL N N 223 116.763 116.763 120.247 -3.484 25806 1942 1 10 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.650 -0.116 25806 1943 1 10 . 1 1 223 223 VAL C C 223 177.402 177.402 177.905 -0.503 25806 1944 1 10 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.797 0.596 25806 1945 1 10 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.652 -0.335 25806 1946 1 10 . 1 1 223 223 VAL H H 223 8.274 8.274 8.113 0.161 25806 1947 1 10 . 1 1 224 224 ILE N N 224 118.686 118.686 117.327 1.359 25806 1948 1 10 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.823 -0.190 25806 1949 1 10 . 1 1 224 224 ILE C C 224 177.422 177.422 177.740 -0.318 25806 1950 1 10 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.997 0.830 25806 1951 1 10 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.168 0.133 25806 1952 1 10 . 1 1 224 224 ILE H H 224 8.375 8.375 8.312 0.063 25806 1953 1 10 . 1 1 225 225 CYS N N 225 116.617 116.617 117.905 -1.288 25806 1954 1 10 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.234 -0.216 25806 1955 1 10 . 1 1 225 225 CYS C C 225 176.120 176.120 176.775 -0.655 25806 1956 1 10 . 1 1 225 225 CYS CA C 225 65.013 65.013 62.807 2.206 25806 1957 1 10 . 1 1 225 225 CYS CB C 225 26.856 26.856 26.428 0.428 25806 1958 1 10 . 1 1 225 225 CYS H H 225 8.202 8.202 7.474 0.728 25806 1959 1 10 . 1 1 226 226 LEU N N 226 118.552 118.552 121.564 -3.012 25806 1960 1 10 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.925 0.091 25806 1961 1 10 . 1 1 226 226 LEU C C 226 177.990 177.990 178.909 -0.919 25806 1962 1 10 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.322 0.236 25806 1963 1 10 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.142 -0.393 25806 1964 1 10 . 1 1 226 226 LEU H H 226 8.210 8.210 7.576 0.634 25806 1965 1 10 . 1 1 227 227 ILE N N 227 118.243 118.243 117.417 0.826 25806 1966 1 10 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.942 -0.118 25806 1967 1 10 . 1 1 227 227 ILE C C 227 177.429 177.429 177.882 -0.453 25806 1968 1 10 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.376 0.473 25806 1969 1 10 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.562 -0.020 25806 1970 1 10 . 1 1 227 227 ILE H H 227 8.233 8.233 7.900 0.333 25806 1971 1 10 . 1 1 228 228 ILE N N 228 118.904 118.904 119.900 -0.996 25806 1972 1 10 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.696 -0.000 25806 1973 1 10 . 1 1 228 228 ILE C C 228 177.269 177.269 177.941 -0.672 25806 1974 1 10 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.134 1.091 25806 1975 1 10 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.373 0.077 25806 1976 1 10 . 1 1 228 228 ILE H H 228 8.161 8.161 7.562 0.599 25806 1977 1 10 . 1 1 229 229 VAL N N 229 118.028 118.028 119.151 -1.123 25806 1978 1 10 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.593 -0.020 25806 1979 1 10 . 1 1 229 229 VAL C C 229 177.312 177.312 178.156 -0.844 25806 1980 1 10 . 1 1 229 229 VAL CA C 229 67.509 67.509 66.517 0.992 25806 1981 1 10 . 1 1 229 229 VAL CB C 229 31.319 31.319 31.120 0.199 25806 1982 1 10 . 1 1 229 229 VAL H H 229 8.366 8.366 7.378 0.988 25806 1983 1 10 . 1 1 230 230 TRP N N 230 120.511 120.511 120.190 0.321 25806 1984 1 10 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.401 -0.107 25806 1985 1 10 . 1 1 230 230 TRP C C 230 177.236 177.236 177.897 -0.661 25806 1986 1 10 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.235 0.558 25806 1987 1 10 . 1 1 230 230 TRP CB C 230 29.170 29.170 28.948 0.222 25806 1988 1 10 . 1 1 230 230 TRP H H 230 8.618 8.618 7.588 1.030 25806 1989 1 10 . 1 1 231 231 ALA N N 231 119.679 119.679 119.261 0.418 25806 1990 1 10 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.261 -0.519 25806 1991 1 10 . 1 1 231 231 ALA C C 231 179.679 179.679 178.182 1.497 25806 1992 1 10 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.534 1.025 25806 1993 1 10 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.475 -0.000 25806 1994 1 10 . 1 1 231 231 ALA H H 231 8.728 8.728 8.332 0.396 25806 1995 1 10 . 1 1 232 232 VAL N N 232 115.974 115.974 114.817 1.157 25806 1996 1 10 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.261 -0.528 25806 1997 1 10 . 1 1 232 232 VAL C C 232 178.103 178.103 175.612 2.491 25806 1998 1 10 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.269 3.869 25806 1999 1 10 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.861 -1.006 25806 2000 1 10 . 1 1 232 232 VAL H H 232 8.453 8.453 7.233 1.220 25806 2001 1 10 . 1 1 233 233 ALA N N 233 122.331 122.331 121.733 0.598 25806 2002 1 10 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.041 0.134 25806 2003 1 10 . 1 1 233 233 ALA C C 233 179.434 179.434 177.532 1.902 25806 2004 1 10 . 1 1 233 233 ALA CA C 233 54.989 54.989 53.101 1.888 25806 2005 1 10 . 1 1 233 233 ALA CB C 233 18.603 18.603 20.152 -1.550 25806 2006 1 10 . 1 1 233 233 ALA H H 233 8.472 8.472 7.794 0.678 25806 2007 1 10 . 1 1 234 234 LEU N N 234 116.926 116.926 118.389 -1.463 25806 2008 1 10 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.585 -0.407 25806 2009 1 10 . 1 1 234 234 LEU C C 234 179.118 179.118 176.331 2.787 25806 2010 1 10 . 1 1 234 234 LEU CA C 234 57.066 57.066 55.163 1.903 25806 2011 1 10 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.755 -0.599 25806 2012 1 10 . 1 1 234 234 LEU H H 234 8.208 8.208 7.836 0.372 25806 2013 1 10 . 1 1 235 235 LYS N N 235 117.891 117.891 119.927 -2.036 25806 2014 1 10 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.527 -0.339 25806 2015 1 10 . 1 1 235 235 LYS C C 235 178.315 178.315 176.293 2.022 25806 2016 1 10 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.420 1.665 25806 2017 1 10 . 1 1 235 235 LYS CB C 235 32.014 32.014 32.320 -0.306 25806 2018 1 10 . 1 1 235 235 LYS H H 235 7.857 7.857 8.075 -0.218 25806 2019 1 10 . 1 1 236 236 GLY N N 236 107.369 107.369 107.215 0.154 25806 2020 1 10 . 1 1 236 236 GLY C C 236 174.493 174.493 173.209 1.284 25806 2021 1 10 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.195 1.159 25806 2022 1 10 . 1 1 236 236 GLY H H 236 8.243 8.243 8.266 -0.023 25806 2023 1 10 . 1 1 237 237 TYR N N 237 119.546 119.546 118.082 1.464 25806 2024 1 10 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.814 -0.313 25806 2025 1 10 . 1 1 237 237 TYR C C 237 175.646 175.646 176.175 -0.529 25806 2026 1 10 . 1 1 237 237 TYR CA C 237 58.961 58.961 57.696 1.265 25806 2027 1 10 . 1 1 237 237 TYR CB C 237 39.006 39.006 39.047 -0.041 25806 2028 1 10 . 1 1 237 237 TYR H H 237 8.029 8.029 7.901 0.128 25806 2029 1 10 . 1 1 238 238 SER N N 238 115.132 115.132 115.465 -0.333 25806 2030 1 10 . 1 1 238 238 SER HA H 238 4.472 4.472 4.420 0.052 25806 2031 1 10 . 1 1 238 238 SER C C 238 174.318 174.318 175.107 -0.789 25806 2032 1 10 . 1 1 238 238 SER CA C 238 58.619 58.619 59.829 -1.210 25806 2033 1 10 . 1 1 238 238 SER CB C 238 63.959 63.959 63.225 0.734 25806 2034 1 10 . 1 1 238 238 SER H H 238 7.946 7.946 8.152 -0.206 25806 2035 1 10 . 1 1 239 239 MET N N 239 121.579 121.579 121.924 -0.345 25806 2036 1 10 . 1 1 239 239 MET HA H 239 4.493 4.493 4.522 -0.029 25806 2037 1 10 . 1 1 239 239 MET C C 239 175.102 175.102 175.725 -0.623 25806 2038 1 10 . 1 1 239 239 MET CA C 239 56.084 56.084 55.778 0.306 25806 2039 1 10 . 1 1 239 239 MET CB C 239 33.566 33.566 32.652 0.914 25806 2040 1 10 . 1 1 239 239 MET H H 239 8.194 8.194 8.224 -0.030 25806 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 34 1.806 0.170 1.825 25806 2 1 1 "Average Difference" HA 35 0.226 0.066 0.219 25806 3 1 1 "Average Difference" C 34 1.038 -0.107 1.048 25806 4 1 1 "Average Difference" CA 35 1.298 -0.874 0.974 25806 5 1 1 "Average Difference" CB 34 0.623 0.006 0.632 25806 6 1 1 "Average Difference" HN 34 0.669 -0.475 0.478 25806 7 1 2 "Average Difference" N 34 1.860 0.521 1.812 25806 8 1 2 "Average Difference" HA 35 0.217 0.073 0.207 25806 9 1 2 "Average Difference" C 34 1.030 -0.046 1.045 25806 10 1 2 "Average Difference" CA 35 1.299 -0.797 1.040 25806 11 1 2 "Average Difference" CB 34 0.771 -0.149 0.768 25806 12 1 2 "Average Difference" HN 34 0.634 -0.449 0.454 25806 13 1 3 "Average Difference" N 34 1.734 -0.066 1.759 25806 14 1 3 "Average Difference" HA 35 0.227 0.115 0.198 25806 15 1 3 "Average Difference" C 34 0.983 0.003 0.997 25806 16 1 3 "Average Difference" CA 35 1.380 -0.947 1.018 25806 17 1 3 "Average Difference" CB 34 0.625 0.020 0.634 25806 18 1 3 "Average Difference" HN 34 0.585 -0.393 0.439 25806 19 1 4 "Average Difference" N 34 2.088 0.488 2.060 25806 20 1 4 "Average Difference" HA 35 0.261 0.108 0.241 25806 21 1 4 "Average Difference" C 34 0.973 -0.046 0.987 25806 22 1 4 "Average Difference" CA 35 1.254 -0.855 0.931 25806 23 1 4 "Average Difference" CB 34 0.863 -0.114 0.868 25806 24 1 4 "Average Difference" HN 34 0.601 -0.387 0.467 25806 25 1 5 "Average Difference" N 34 2.034 0.546 1.989 25806 26 1 5 "Average Difference" HA 35 0.249 0.070 0.242 25806 27 1 5 "Average Difference" C 34 0.931 0.048 0.944 25806 28 1 5 "Average Difference" CA 35 1.287 -0.704 1.092 25806 29 1 5 "Average Difference" CB 34 0.848 -0.279 0.813 25806 30 1 5 "Average Difference" HN 34 0.610 -0.360 0.501 25806 31 1 6 "Average Difference" N 34 1.914 0.594 1.846 25806 32 1 6 "Average Difference" HA 35 0.226 0.101 0.205 25806 33 1 6 "Average Difference" C 34 0.993 0.036 1.008 25806 34 1 6 "Average Difference" CA 35 1.367 -0.870 1.069 25806 35 1 6 "Average Difference" CB 34 0.674 -0.066 0.681 25806 36 1 6 "Average Difference" HN 34 0.618 -0.371 0.501 25806 37 1 7 "Average Difference" N 34 1.945 0.156 1.967 25806 38 1 7 "Average Difference" HA 35 0.217 0.106 0.191 25806 39 1 7 "Average Difference" C 34 1.047 -0.026 1.063 25806 40 1 7 "Average Difference" CA 35 1.336 -0.865 1.033 25806 41 1 7 "Average Difference" CB 34 0.634 -0.056 0.642 25806 42 1 7 "Average Difference" HN 34 0.604 -0.389 0.469 25806 43 1 8 "Average Difference" N 34 2.097 0.819 1.960 25806 44 1 8 "Average Difference" HA 35 0.224 0.083 0.211 25806 45 1 8 "Average Difference" C 34 1.015 -0.058 1.028 25806 46 1 8 "Average Difference" CA 35 1.251 -0.690 1.059 25806 47 1 8 "Average Difference" CB 34 0.632 -0.148 0.624 25806 48 1 8 "Average Difference" HN 34 0.604 -0.361 0.491 25806 49 1 9 "Average Difference" N 34 1.830 0.414 1.809 25806 50 1 9 "Average Difference" HA 35 0.233 0.065 0.227 25806 51 1 9 "Average Difference" C 34 0.997 -0.008 1.012 25806 52 1 9 "Average Difference" CA 35 1.308 -0.847 1.011 25806 53 1 9 "Average Difference" CB 34 0.981 -0.161 0.982 25806 54 1 9 "Average Difference" HN 34 0.591 -0.338 0.492 25806 55 1 10 "Average Difference" N 34 1.668 0.067 1.692 25806 56 1 10 "Average Difference" HA 35 0.213 0.072 0.203 25806 57 1 10 "Average Difference" C 34 1.122 -0.079 1.136 25806 58 1 10 "Average Difference" CA 35 1.268 -0.729 1.054 25806 59 1 10 "Average Difference" CB 34 0.596 -0.130 0.590 25806 60 1 10 "Average Difference" HN 34 0.616 -0.442 0.435 25806 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 25806 _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 1 205 205 SER CA C 205 58.498 58.498 58.032 0.466 25806 2 1 . 1 1 205 205 SER CB C 205 64.088 64.088 64.192 -0.104 25806 3 1 . 1 1 206 206 PHE N N 206 121.596 121.596 121.675 -0.079 25806 4 1 . 1 1 206 206 PHE HA H 206 4.787 4.787 4.607 0.180 25806 5 1 . 1 1 206 206 PHE C C 206 175.282 175.282 175.279 0.003 25806 6 1 . 1 1 206 206 PHE CA C 206 57.711 57.711 57.975 -0.264 25806 7 1 . 1 1 206 206 PHE CB C 206 40.139 40.139 39.555 0.584 25806 8 1 . 1 1 206 206 PHE H H 206 8.414 8.414 8.375 0.039 25806 9 1 . 1 1 207 207 THR N N 207 116.011 116.011 116.313 -0.302 25806 10 1 . 1 1 207 207 THR HA H 207 4.442 4.442 4.281 0.161 25806 11 1 . 1 1 207 207 THR C C 207 174.188 174.188 174.410 -0.222 25806 12 1 . 1 1 207 207 THR CA C 207 61.309 61.309 62.392 -1.083 25806 13 1 . 1 1 207 207 THR CB C 207 70.503 70.503 69.351 1.152 25806 14 1 . 1 1 207 207 THR H H 207 8.233 8.233 8.139 0.094 25806 15 1 . 1 1 208 208 MET N N 208 121.915 121.915 121.221 0.694 25806 16 1 . 1 1 208 208 MET HA H 208 4.475 4.475 4.419 0.056 25806 17 1 . 1 1 208 208 MET C C 208 175.595 175.595 175.241 0.353 25806 18 1 . 1 1 208 208 MET CA C 208 55.865 55.865 55.628 0.237 25806 19 1 . 1 1 208 208 MET CB C 208 32.987 32.987 32.511 0.476 25806 20 1 . 1 1 208 208 MET H H 208 8.474 8.474 8.154 0.320 25806 21 1 . 1 1 209 209 ASN N N 209 119.024 119.024 120.339 -1.315 25806 22 1 . 1 1 209 209 ASN HA H 209 4.773 4.773 4.688 0.085 25806 23 1 . 1 1 209 209 ASN C C 209 175.125 175.125 175.088 0.037 25806 24 1 . 1 1 209 209 ASN CA C 209 53.389 53.389 53.773 -0.384 25806 25 1 . 1 1 209 209 ASN CB C 209 39.165 39.165 39.237 -0.072 25806 26 1 . 1 1 209 209 ASN H H 209 8.274 8.274 8.418 -0.144 25806 27 1 . 1 1 210 210 ASP N N 210 119.941 119.941 120.429 -0.488 25806 28 1 . 1 1 210 210 ASP HA H 210 4.553 4.553 4.623 -0.070 25806 29 1 . 1 1 210 210 ASP C C 210 177.325 177.325 176.886 0.439 25806 30 1 . 1 1 210 210 ASP CA C 210 56.169 56.169 55.435 0.734 25806 31 1 . 1 1 210 210 ASP CB C 210 41.255 41.255 40.861 0.394 25806 32 1 . 1 1 210 210 ASP H H 210 8.262 8.262 8.662 -0.400 25806 33 1 . 1 1 211 211 THR N N 211 115.882 115.882 116.599 -0.717 25806 34 1 . 1 1 211 211 THR HA H 211 4.107 4.107 4.283 -0.176 25806 35 1 . 1 1 211 211 THR C C 211 175.855 175.855 176.681 -0.826 25806 36 1 . 1 1 211 211 THR CA C 211 65.947 65.947 66.191 -0.244 25806 37 1 . 1 1 211 211 THR CB C 211 68.808 68.808 68.830 -0.023 25806 38 1 . 1 1 211 211 THR H H 211 8.320 8.320 8.080 0.240 25806 39 1 . 1 1 212 212 THR N N 212 115.754 115.754 118.089 -2.335 25806 40 1 . 1 1 212 212 THR HA H 212 4.004 4.004 4.079 -0.075 25806 41 1 . 1 1 212 212 THR C C 212 177.310 177.310 176.119 1.191 25806 42 1 . 1 1 212 212 THR CA C 212 66.199 66.199 66.220 -0.021 25806 43 1 . 1 1 212 212 THR CB C 212 68.580 68.580 68.214 0.366 25806 44 1 . 1 1 212 212 THR H H 212 8.216 8.216 8.266 -0.050 25806 45 1 . 1 1 213 213 VAL N N 213 123.471 123.471 120.548 2.923 25806 46 1 . 1 1 213 213 VAL HA H 213 3.654 3.654 3.647 0.007 25806 47 1 . 1 1 213 213 VAL C C 213 177.157 177.157 177.692 -0.535 25806 48 1 . 1 1 213 213 VAL CA C 213 66.937 66.937 66.025 0.912 25806 49 1 . 1 1 213 213 VAL CB C 213 31.552 31.552 31.088 0.464 25806 50 1 . 1 1 213 213 VAL H H 213 8.090 8.090 7.419 0.671 25806 51 1 . 1 1 214 214 TRP N N 214 119.814 119.814 118.696 1.118 25806 52 1 . 1 1 214 214 TRP HA H 214 4.421 4.421 4.490 -0.069 25806 53 1 . 1 1 214 214 TRP C C 214 178.622 178.622 178.619 0.003 25806 54 1 . 1 1 214 214 TRP CA C 214 60.857 60.857 60.361 0.496 25806 55 1 . 1 1 214 214 TRP CB C 214 29.477 29.477 29.205 0.272 25806 56 1 . 1 1 214 214 TRP H H 214 7.966 7.966 7.875 0.091 25806 57 1 . 1 1 215 215 ILE N N 215 118.030 118.030 121.060 -3.030 25806 58 1 . 1 1 215 215 ILE HA H 215 3.735 3.735 3.611 0.124 25806 59 1 . 1 1 215 215 ILE C C 215 177.589 177.589 177.937 -0.348 25806 60 1 . 1 1 215 215 ILE CA C 215 65.310 65.310 64.789 0.522 25806 61 1 . 1 1 215 215 ILE CB C 215 37.811 37.811 37.562 0.249 25806 62 1 . 1 1 215 215 ILE H H 215 8.388 8.388 7.607 0.781 25806 63 1 . 1 1 216 216 SER N N 216 116.314 116.314 115.398 0.916 25806 64 1 . 1 1 216 216 SER HA H 216 4.083 4.083 4.186 -0.103 25806 65 1 . 1 1 216 216 SER C C 216 175.835 175.835 176.946 -1.111 25806 66 1 . 1 1 216 216 SER CA C 216 63.777 63.777 62.004 1.773 25806 67 1 . 1 1 216 216 SER CB C 216 62.965 62.965 62.728 0.237 25806 68 1 . 1 1 216 216 SER H H 216 8.010 8.010 8.082 -0.072 25806 69 1 . 1 1 217 217 VAL N N 217 120.711 120.711 121.348 -0.637 25806 70 1 . 1 1 217 217 VAL HA H 217 3.577 3.577 3.820 -0.243 25806 71 1 . 1 1 217 217 VAL C C 217 178.640 178.640 177.293 1.347 25806 72 1 . 1 1 217 217 VAL CA C 217 66.870 66.870 65.133 1.737 25806 73 1 . 1 1 217 217 VAL CB C 217 31.611 31.611 31.333 0.278 25806 74 1 . 1 1 217 217 VAL H H 217 8.381 8.381 7.273 1.108 25806 75 1 . 1 1 218 218 ALA N N 218 125.445 125.445 123.367 2.078 25806 76 1 . 1 1 218 218 ALA HA H 218 4.003 4.003 4.096 -0.093 25806 77 1 . 1 1 218 218 ALA C C 218 178.882 178.882 179.743 -0.861 25806 78 1 . 1 1 218 218 ALA CA C 218 56.052 56.052 55.293 0.759 25806 79 1 . 1 1 218 218 ALA CB C 218 18.212 18.212 18.260 -0.048 25806 80 1 . 1 1 218 218 ALA H H 218 8.565 8.565 8.026 0.539 25806 81 1 . 1 1 219 219 VAL N N 219 116.767 116.767 118.214 -1.447 25806 82 1 . 1 1 219 219 VAL HA H 219 3.555 3.555 3.646 -0.091 25806 83 1 . 1 1 219 219 VAL C C 219 177.632 177.632 177.835 -0.203 25806 84 1 . 1 1 219 219 VAL CA C 219 67.308 67.308 66.300 1.008 25806 85 1 . 1 1 219 219 VAL CB C 219 31.411 31.411 31.450 -0.039 25806 86 1 . 1 1 219 219 VAL H H 219 8.575 8.575 7.622 0.953 25806 87 1 . 1 1 220 220 LEU N N 220 118.644 118.644 120.055 -1.411 25806 88 1 . 1 1 220 220 LEU HA H 220 3.973 3.973 3.844 0.129 25806 89 1 . 1 1 220 220 LEU C C 220 178.641 178.641 178.959 -0.318 25806 90 1 . 1 1 220 220 LEU CA C 220 58.527 58.527 58.284 0.244 25806 91 1 . 1 1 220 220 LEU CB C 220 41.914 41.914 40.795 1.118 25806 92 1 . 1 1 220 220 LEU H H 220 8.434 8.434 7.351 1.083 25806 93 1 . 1 1 221 221 SER N N 221 114.238 114.238 114.587 -0.349 25806 94 1 . 1 1 221 221 SER HA H 221 4.026 4.026 4.106 -0.080 25806 95 1 . 1 1 221 221 SER C C 221 175.620 175.620 176.542 -0.922 25806 96 1 . 1 1 221 221 SER CA C 221 63.606 63.606 61.842 1.764 25806 97 1 . 1 1 221 221 SER CB C 221 62.966 62.966 62.674 0.292 25806 98 1 . 1 1 221 221 SER H H 221 8.478 8.478 7.972 0.506 25806 99 1 . 1 1 222 222 ALA N N 222 124.323 124.323 123.860 0.463 25806 100 1 . 1 1 222 222 ALA HA H 222 3.967 3.967 4.190 -0.223 25806 101 1 . 1 1 222 222 ALA C C 222 178.799 178.799 179.616 -0.817 25806 102 1 . 1 1 222 222 ALA CA C 222 55.796 55.796 54.663 1.133 25806 103 1 . 1 1 222 222 ALA CB C 222 18.003 18.003 18.298 -0.295 25806 104 1 . 1 1 222 222 ALA H H 222 8.160 8.160 7.382 0.778 25806 105 1 . 1 1 223 223 VAL N N 223 116.763 116.763 120.146 -3.383 25806 106 1 . 1 1 223 223 VAL HA H 223 3.534 3.534 3.641 -0.107 25806 107 1 . 1 1 223 223 VAL C C 223 177.402 177.402 177.931 -0.529 25806 108 1 . 1 1 223 223 VAL CA C 223 67.393 67.393 66.748 0.645 25806 109 1 . 1 1 223 223 VAL CB C 223 31.317 31.317 31.670 -0.353 25806 110 1 . 1 1 223 223 VAL H H 223 8.274 8.274 8.070 0.203 25806 111 1 . 1 1 224 224 ILE N N 224 118.686 118.686 117.238 1.448 25806 112 1 . 1 1 224 224 ILE HA H 224 3.633 3.633 3.810 -0.177 25806 113 1 . 1 1 224 224 ILE C C 224 177.422 177.422 177.592 -0.170 25806 114 1 . 1 1 224 224 ILE CA C 224 65.827 65.827 64.844 0.982 25806 115 1 . 1 1 224 224 ILE CB C 224 37.301 37.301 37.118 0.183 25806 116 1 . 1 1 224 224 ILE H H 224 8.375 8.375 8.345 0.030 25806 117 1 . 1 1 225 225 CYS N N 225 116.617 116.617 118.507 -1.890 25806 118 1 . 1 1 225 225 CYS HA H 225 4.018 4.018 4.165 -0.147 25806 119 1 . 1 1 225 225 CYS C C 225 176.120 176.120 176.773 -0.653 25806 120 1 . 1 1 225 225 CYS CA C 225 65.013 65.013 63.006 2.007 25806 121 1 . 1 1 225 225 CYS CB C 225 26.856 26.856 26.850 0.006 25806 122 1 . 1 1 225 225 CYS H H 225 8.202 8.202 7.494 0.708 25806 123 1 . 1 1 226 226 LEU N N 226 118.552 118.552 121.531 -2.979 25806 124 1 . 1 1 226 226 LEU HA H 226 4.016 4.016 3.941 0.075 25806 125 1 . 1 1 226 226 LEU C C 226 177.990 177.990 178.772 -0.782 25806 126 1 . 1 1 226 226 LEU CA C 226 58.559 58.559 58.454 0.105 25806 127 1 . 1 1 226 226 LEU CB C 226 41.749 41.749 42.139 -0.390 25806 128 1 . 1 1 226 226 LEU H H 226 8.210 8.210 7.665 0.545 25806 129 1 . 1 1 227 227 ILE N N 227 118.243 118.243 117.460 0.782 25806 130 1 . 1 1 227 227 ILE HA H 227 3.824 3.824 3.909 -0.085 25806 131 1 . 1 1 227 227 ILE C C 227 177.429 177.429 177.905 -0.476 25806 132 1 . 1 1 227 227 ILE CA C 227 65.849 65.849 65.379 0.470 25806 133 1 . 1 1 227 227 ILE CB C 227 37.542 37.542 37.553 -0.011 25806 134 1 . 1 1 227 227 ILE H H 227 8.233 8.233 7.958 0.275 25806 135 1 . 1 1 228 228 ILE N N 228 118.904 118.904 119.834 -0.930 25806 136 1 . 1 1 228 228 ILE HA H 228 3.696 3.696 3.711 -0.015 25806 137 1 . 1 1 228 228 ILE C C 228 177.269 177.269 177.952 -0.683 25806 138 1 . 1 1 228 228 ILE CA C 228 66.225 66.225 65.196 1.029 25806 139 1 . 1 1 228 228 ILE CB C 228 37.450 37.450 37.455 -0.005 25806 140 1 . 1 1 228 228 ILE H H 228 8.161 8.161 7.593 0.568 25806 141 1 . 1 1 229 229 VAL N N 229 118.028 118.028 118.924 -0.896 25806 142 1 . 1 1 229 229 VAL HA H 229 3.573 3.573 3.598 -0.025 25806 143 1 . 1 1 229 229 VAL C C 229 177.312 177.312 178.309 -0.997 25806 144 1 . 1 1 229 229 VAL CA C 229 67.509 67.509 66.091 1.418 25806 145 1 . 1 1 229 229 VAL CB C 229 31.319 31.319 31.070 0.249 25806 146 1 . 1 1 229 229 VAL H H 229 8.366 8.366 7.357 1.009 25806 147 1 . 1 1 230 230 TRP N N 230 120.511 120.511 120.279 0.232 25806 148 1 . 1 1 230 230 TRP HA H 230 4.294 4.294 4.431 -0.137 25806 149 1 . 1 1 230 230 TRP C C 230 177.236 177.236 177.981 -0.745 25806 150 1 . 1 1 230 230 TRP CA C 230 60.793 60.793 60.317 0.476 25806 151 1 . 1 1 230 230 TRP CB C 230 29.170 29.170 29.049 0.121 25806 152 1 . 1 1 230 230 TRP H H 230 8.618 8.618 7.627 0.991 25806 153 1 . 1 1 231 231 ALA N N 231 119.679 119.679 119.623 0.055 25806 154 1 . 1 1 231 231 ALA HA H 231 3.742 3.742 4.243 -0.501 25806 155 1 . 1 1 231 231 ALA C C 231 179.679 179.679 178.246 1.433 25806 156 1 . 1 1 231 231 ALA CA C 231 55.559 55.559 54.587 0.972 25806 157 1 . 1 1 231 231 ALA CB C 231 18.475 18.475 18.469 0.006 25806 158 1 . 1 1 231 231 ALA H H 231 8.728 8.728 8.418 0.310 25806 159 1 . 1 1 232 232 VAL N N 232 115.974 115.974 114.818 1.156 25806 160 1 . 1 1 232 232 VAL HA H 232 3.733 3.733 4.245 -0.512 25806 161 1 . 1 1 232 232 VAL C C 232 178.103 178.103 175.366 2.737 25806 162 1 . 1 1 232 232 VAL CA C 232 66.138 66.138 62.304 3.834 25806 163 1 . 1 1 232 232 VAL CB C 232 31.855 31.855 32.835 -0.980 25806 164 1 . 1 1 232 232 VAL H H 232 8.453 8.453 7.292 1.161 25806 165 1 . 1 1 233 233 ALA N N 233 122.331 122.331 121.914 0.417 25806 166 1 . 1 1 233 233 ALA HA H 233 4.175 4.175 4.636 -0.461 25806 167 1 . 1 1 233 233 ALA C C 233 179.434 179.434 177.687 1.747 25806 168 1 . 1 1 233 233 ALA CA C 233 54.989 54.989 53.186 1.803 25806 169 1 . 1 1 233 233 ALA CB C 233 18.603 18.603 20.055 -1.452 25806 170 1 . 1 1 233 233 ALA H H 233 8.472 8.472 7.773 0.699 25806 171 1 . 1 1 234 234 LEU N N 234 116.926 116.926 117.889 -0.963 25806 172 1 . 1 1 234 234 LEU HA H 234 4.178 4.178 4.540 -0.362 25806 173 1 . 1 1 234 234 LEU C C 234 179.118 179.118 177.379 1.739 25806 174 1 . 1 1 234 234 LEU CA C 234 57.066 57.066 55.872 1.194 25806 175 1 . 1 1 234 234 LEU CB C 234 42.156 42.156 42.779 -0.623 25806 176 1 . 1 1 234 234 LEU H H 234 8.208 8.208 8.079 0.129 25806 177 1 . 1 1 235 235 LYS N N 235 117.891 117.891 120.090 -2.199 25806 178 1 . 1 1 235 235 LYS HA H 235 4.188 4.188 4.492 -0.304 25806 179 1 . 1 1 235 235 LYS C C 235 178.315 178.315 176.682 1.633 25806 180 1 . 1 1 235 235 LYS CA C 235 57.085 57.085 55.722 1.363 25806 181 1 . 1 1 235 235 LYS CB C 235 32.014 32.014 32.833 -0.819 25806 182 1 . 1 1 235 235 LYS H H 235 7.857 7.857 8.001 -0.144 25806 183 1 . 1 1 236 236 GLY N N 236 107.369 107.369 107.240 0.129 25806 184 1 . 1 1 236 236 GLY C C 236 174.493 174.493 174.137 0.356 25806 185 1 . 1 1 236 236 GLY CA C 236 46.354 46.354 45.246 1.108 25806 186 1 . 1 1 236 236 GLY H H 236 8.243 8.243 8.106 0.137 25806 187 1 . 1 1 237 237 TYR N N 237 119.546 119.546 118.951 0.595 25806 188 1 . 1 1 237 237 TYR HA H 237 4.501 4.501 4.433 0.068 25806 189 1 . 1 1 237 237 TYR C C 237 175.646 175.646 175.953 -0.307 25806 190 1 . 1 1 237 237 TYR CA C 237 58.961 58.961 57.934 1.027 25806 191 1 . 1 1 237 237 TYR CB C 237 39.006 39.006 37.946 1.060 25806 192 1 . 1 1 237 237 TYR H H 237 8.029 8.029 8.217 -0.188 25806 193 1 . 1 1 238 238 SER N N 238 115.132 115.132 115.229 -0.097 25806 194 1 . 1 1 238 238 SER HA H 238 4.472 4.472 4.191 0.281 25806 195 1 . 1 1 238 238 SER C C 238 174.318 174.318 174.536 -0.218 25806 196 1 . 1 1 238 238 SER CA C 238 58.619 58.619 59.593 -0.974 25806 197 1 . 1 1 238 238 SER CB C 238 63.959 63.959 62.970 0.988 25806 198 1 . 1 1 238 238 SER H H 238 7.946 7.946 7.946 -0.000 25806 199 1 . 1 1 239 239 MET N N 239 121.579 121.579 121.744 -0.165 25806 200 1 . 1 1 239 239 MET HA H 239 4.493 4.493 4.552 -0.059 25806 201 1 . 1 1 239 239 MET C C 239 175.102 175.102 175.434 -0.332 25806 202 1 . 1 1 239 239 MET CA C 239 56.084 56.084 54.711 1.373 25806 203 1 . 1 1 239 239 MET CB C 239 33.566 33.566 33.194 0.372 25806 204 1 . 1 1 239 239 MET H H 239 8.194 8.194 7.688 0.506 25806 stop_ save_