NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
26145 | 2kfl | 16183 | cing | 1-original | 1 | STAR | chemical shift |
loop_ _Atom_shift_assign_ID _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 119 GLY C C 167.615 0.3 1 2 119 GLY CA C 43.303 0.3 1 3 119 GLY HA2 H 3.920 0.020 1 4 119 GLY HA3 H 3.920 0.020 1 5 120 SER C C 171.760 0.3 1 6 120 SER CA C 57.953 0.3 1 7 120 SER CB C 64.075 0.3 1 8 120 SER H H 8.696 0.020 1 9 120 SER HA H 4.622 0.020 1 10 120 SER HB2 H 3.851 0.020 1 11 120 SER HB3 H 3.851 0.020 1 12 120 SER N N 115.820 0.3 1 13 121 VAL C C 173.875 0.3 1 14 121 VAL CA C 62.308 0.3 1 15 121 VAL CB C 32.727 0.3 1 16 121 VAL CG1 C 20.593 0.3 1 17 121 VAL CG2 C 21.094 0.3 1 18 121 VAL H H 8.428 0.020 1 19 121 VAL HA H 4.200 0.020 1 20 121 VAL HB H 2.058 0.020 1 21 121 VAL HG1 H 0.933 0.020 2 22 121 VAL HG2 H 0.902 0.020 2 23 121 VAL N N 122.388 0.3 1 24 122 VAL C C 174.194 0.3 1 25 122 VAL CA C 62.468 0.3 1 26 122 VAL CB C 32.526 0.3 1 27 122 VAL CG1 C 20.880 0.3 1 28 122 VAL CG2 C 21.112 0.3 1 29 122 VAL H H 8.369 0.020 1 30 122 VAL HA H 4.096 0.020 1 31 122 VAL HB H 2.022 0.020 1 32 122 VAL HG1 H 0.936 0.020 2 33 122 VAL HG2 H 0.900 0.020 2 34 122 VAL N N 125.447 0.3 1 35 123 GLY C C 172.148 0.3 1 36 123 GLY CA C 45.182 0.3 1 37 123 GLY H H 8.610 0.020 1 38 123 GLY HA2 H 3.961 0.020 1 39 123 GLY HA3 H 3.961 0.020 1 40 123 GLY N N 113.578 0.3 1 41 124 GLY C C 171.895 0.3 1 42 124 GLY CA C 45.206 0.3 1 43 124 GLY H H 8.301 0.020 1 44 124 GLY HA2 H 3.970 0.020 1 45 124 GLY HA3 H 3.970 0.020 1 46 124 GLY N N 108.642 0.3 1 47 125 LEU C C 175.763 0.3 1 48 125 LEU CA C 55.103 0.3 1 49 125 LEU CB C 42.279 0.3 1 50 125 LEU CG C 26.997 0.3 1 51 125 LEU CD1 C 24.903 0.3 1 52 125 LEU CD2 C 23.531 0.3 1 53 125 LEU H H 8.292 0.020 1 54 125 LEU HA H 4.394 0.020 1 55 125 LEU HB2 H 1.628 0.020 1 56 125 LEU HB3 H 1.628 0.020 1 57 125 LEU HG H 1.607 0.020 1 58 125 LEU HD1 H 0.878 0.020 2 59 125 LEU HD2 H 0.814 0.020 2 60 125 LEU N N 121.732 0.3 1 61 126 GLY C C 172.241 0.3 1 62 126 GLY CA C 45.931 0.3 1 63 126 GLY H H 8.586 0.020 1 64 126 GLY HA2 H 3.894 0.020 1 65 126 GLY N N 109.878 0.3 1 66 127 GLY C C 171.416 0.3 1 67 127 GLY CA C 44.977 0.3 1 68 127 GLY H H 8.274 0.020 1 69 127 GLY HA2 H 3.886 0.020 1 70 127 GLY N N 108.423 0.3 1 71 128 TYR C C 172.932 0.3 1 72 128 TYR CA C 57.811 0.3 1 73 128 TYR CB C 39.875 0.3 1 74 128 TYR CD1 C 132.872 0.3 1 75 128 TYR CE1 C 118.145 0.3 1 76 128 TYR H H 7.671 0.020 1 77 128 TYR HA H 4.448 0.020 1 78 128 TYR HB2 H 2.802 0.020 2 79 128 TYR HB3 H 2.778 0.020 2 80 128 TYR HD1 H 6.879 0.020 1 81 128 TYR HD2 H 6.879 0.020 1 82 128 TYR HE1 H 6.686 0.020 1 83 128 TYR HE2 H 6.686 0.020 1 84 128 TYR N N 117.811 0.3 1 85 129 MET C C 171.071 0.3 1 86 129 MET CA C 53.653 0.3 1 87 129 MET CB C 34.100 0.3 1 88 129 MET CG C 31.815 0.3 1 89 129 MET CE C 17.057 0.3 1 90 129 MET H H 9.060 0.020 1 91 129 MET HA H 4.495 0.020 1 92 129 MET HB2 H 0.912 0.020 2 93 129 MET HB3 H 1.536 0.020 2 94 129 MET HG2 H 2.224 0.020 1 95 129 MET HG3 H 2.224 0.020 1 96 129 MET HE H 1.987 0.020 1 97 129 MET N N 120.669 0.3 1 98 130 LEU C C 175.736 0.3 1 99 130 LEU CA C 53.482 0.3 1 100 130 LEU CB C 44.133 0.3 1 101 130 LEU CG C 26.745 0.3 1 102 130 LEU CD1 C 25.576 0.3 1 103 130 LEU CD2 C 24.333 0.3 1 104 130 LEU H H 8.253 0.020 1 105 130 LEU HA H 4.965 0.020 1 106 130 LEU HB2 H 1.324 0.020 2 107 130 LEU HB3 H 1.758 0.020 2 108 130 LEU HG H 1.692 0.020 1 109 130 LEU HD1 H 0.862 0.020 2 110 130 LEU HD2 H 0.855 0.020 2 111 130 LEU N N 121.036 0.3 1 112 131 GLY C C 170.632 0.3 1 113 131 GLY CA C 44.912 0.3 1 114 131 GLY H H 9.462 0.020 1 115 131 GLY HA2 H 4.473 0.020 1 116 131 GLY N N 114.181 0.3 1 117 132 SER C C 172.214 0.3 1 118 132 SER CA C 58.585 0.3 1 119 132 SER CB C 63.919 0.3 1 120 132 SER H H 8.370 0.020 1 121 132 SER HA H 4.454 0.020 1 122 132 SER HB2 H 3.913 0.020 2 123 132 SER HB3 H 4.000 0.020 2 124 132 SER N N 114.134 0.3 1 125 133 ALA C C 175.125 0.3 1 126 133 ALA CA C 52.913 0.3 1 127 133 ALA CB C 18.256 0.3 1 128 133 ALA H H 8.727 0.020 1 129 133 ALA HA H 4.400 0.020 1 130 133 ALA HB H 1.302 0.020 1 131 133 ALA N N 125.401 0.3 1 132 134 MET C C 173.344 0.3 1 133 134 MET CA C 53.986 0.3 1 134 134 MET CB C 36.484 0.3 1 135 134 MET CG C 30.987 0.3 1 136 134 MET CE C 17.245 0.3 1 137 134 MET H H 8.843 0.020 1 138 134 MET HA H 4.771 0.020 1 139 134 MET HB2 H 2.116 0.020 2 140 134 MET HB3 H 1.979 0.020 2 141 134 MET HG2 H 2.560 0.020 2 142 134 MET HG3 H 2.461 0.020 2 143 134 MET HE H 2.215 0.020 1 144 134 MET N N 121.562 0.3 1 145 135 SER C C 172.028 0.3 1 146 135 SER CA C 58.593 0.3 1 147 135 SER CB C 63.165 0.3 1 148 135 SER H H 8.476 0.020 1 149 135 SER HA H 4.366 0.020 1 150 135 SER HB2 H 3.864 0.020 2 151 135 SER HB3 H 3.760 0.020 2 152 135 SER N N 116.462 0.3 1 153 136 ARG C C 172.871 0.3 1 154 136 ARG CA C 55.071 0.3 1 155 136 ARG CB C 28.316 0.3 1 156 136 ARG CG C 28.922 0.3 1 157 136 ARG CD C 43.614 0.3 1 158 136 ARG H H 8.770 0.020 1 159 136 ARG HA H 4.409 0.020 1 160 136 ARG HB2 H 1.895 0.020 2 161 136 ARG HB3 H 1.683 0.020 2 162 136 ARG HG2 H 1.880 0.020 2 163 136 ARG HG3 H 1.741 0.020 2 164 136 ARG HD2 H 3.175 0.020 2 165 136 ARG HD3 H 3.105 0.020 2 166 136 ARG HE H 6.845 0.020 1 167 136 ARG N N 125.858 0.3 1 168 136 ARG NE N 85.600 0.3 1 169 137 PRO C C 174.434 0.3 1 170 137 PRO CA C 62.461 0.3 1 171 137 PRO CB C 32.090 0.3 1 172 137 PRO CG C 27.664 0.3 1 173 137 PRO CD C 50.506 0.3 1 174 137 PRO HA H 4.393 0.020 1 175 137 PRO HB2 H 1.761 0.020 2 176 137 PRO HB3 H 2.232 0.020 2 177 137 PRO HG2 H 2.009 0.020 2 178 137 PRO HG3 H 1.995 0.020 2 179 137 PRO HD2 H 3.605 0.020 2 180 137 PRO HD3 H 3.843 0.020 2 181 138 VAL C C 173.317 0.3 1 182 138 VAL CA C 63.203 0.3 1 183 138 VAL CB C 31.157 0.3 1 184 138 VAL CG1 C 21.205 0.3 1 185 138 VAL CG2 C 20.890 0.3 1 186 138 VAL H H 8.605 0.020 1 187 138 VAL HA H 3.999 0.020 1 188 138 VAL HB H 1.935 0.020 1 189 138 VAL HG1 H 1.026 0.020 2 190 138 VAL HG2 H 0.810 0.020 2 191 138 VAL N N 124.080 0.3 1 192 139 MET C C 172.148 0.3 1 193 139 MET CA C 52.512 0.3 1 194 139 MET CB C 34.309 0.3 1 195 139 MET CG C 34.258 0.3 1 196 139 MET CE C 15.773 0.3 1 197 139 MET H H 8.084 0.020 1 198 139 MET HA H 4.530 0.020 1 199 139 MET HB2 H 1.292 0.020 2 200 139 MET HB3 H 1.273 0.020 2 201 139 MET HG2 H 0.887 0.020 2 202 139 MET HG3 H 0.869 0.020 2 203 139 MET HE H 1.458 0.020 1 204 139 MET N N 125.295 0.3 1 205 140 HIS C C 172.214 0.3 1 206 140 HIS CA C 54.205 0.3 1 207 140 HIS CB C 29.285 0.3 1 208 140 HIS CD2 C 119.925 0.3 1 209 140 HIS CE1 C 136.018 0.3 1 210 140 HIS H H 8.307 0.020 1 211 140 HIS HA H 4.912 0.020 1 212 140 HIS HB2 H 3.241 0.020 2 213 140 HIS HB3 H 2.954 0.020 2 214 140 HIS HD2 H 7.220 0.020 1 215 140 HIS HE1 H 8.535 0.020 1 216 140 HIS N N 119.015 0.3 1 217 141 PHE C C 174.660 0.3 1 218 141 PHE CA C 59.602 0.3 1 219 141 PHE CB C 40.038 0.3 1 220 141 PHE CD1 C 131.997 0.3 1 221 141 PHE CE1 C 130.670 0.3 1 222 141 PHE CZ C 128.624 0.3 1 223 141 PHE H H 10.475 0.020 1 224 141 PHE HA H 4.337 0.020 1 225 141 PHE HB2 H 3.360 0.020 2 226 141 PHE HB3 H 2.842 0.020 2 227 141 PHE HD1 H 7.396 0.020 1 228 141 PHE HD2 H 7.396 0.020 1 229 141 PHE HE1 H 6.872 0.020 1 230 141 PHE HE2 H 6.872 0.020 1 231 141 PHE HZ H 6.566 0.020 1 232 141 PHE N N 124.031 0.3 1 233 142 GLY C C 170.832 0.3 1 234 142 GLY CA C 45.583 0.3 1 235 142 GLY H H 9.258 0.020 1 236 142 GLY HA2 H 4.170 0.020 1 237 142 GLY N N 109.341 0.3 1 238 143 ASN C C 171.616 0.3 1 239 143 ASN CA C 52.634 0.3 1 240 143 ASN CB C 41.578 0.3 1 241 143 ASN H H 7.219 0.020 1 242 143 ASN HA H 4.833 0.020 1 243 143 ASN HB2 H 2.834 0.020 2 244 143 ASN HB3 H 2.820 0.020 2 245 143 ASN HD21 H 7.612 0.020 1 246 143 ASN HD22 H 7.431 0.020 1 247 143 ASN N N 114.405 0.3 1 248 143 ASN ND2 N 115.986 0.3 1 249 144 GLU C C 175.489 0.3 1 250 144 GLU CA C 59.433 0.3 1 251 144 GLU CB C 29.350 0.3 1 252 144 GLU CG C 35.340 0.3 1 253 144 GLU H H 9.070 0.020 1 254 144 GLU HA H 4.191 0.020 1 255 144 GLU HB2 H 2.139 0.020 2 256 144 GLU HB3 H 2.088 0.020 2 257 144 GLU HG2 H 2.437 0.020 2 258 144 GLU HG3 H 2.392 0.020 2 259 144 GLU N N 124.188 0.3 1 260 145 TYR C C 175.723 0.3 1 261 145 TYR CA C 61.651 0.3 1 262 145 TYR CB C 37.565 0.3 1 263 145 TYR CD1 C 133.212 0.3 1 264 145 TYR CE1 C 117.970 0.3 1 265 145 TYR H H 8.384 0.020 1 266 145 TYR HA H 4.214 0.020 1 267 145 TYR HB2 H 3.238 0.020 2 268 145 TYR HB3 H 3.074 0.020 2 269 145 TYR HD1 H 7.080 0.020 1 270 145 TYR HD2 H 7.080 0.020 1 271 145 TYR HE1 H 6.725 0.020 1 272 145 TYR HE2 H 6.725 0.020 1 273 145 TYR N N 120.106 0.3 1 274 146 GLU C C 175.487 0.3 1 275 146 GLU CA C 59.561 0.3 1 276 146 GLU CB C 29.205 0.3 1 277 146 GLU CG C 36.613 0.3 1 278 146 GLU H H 8.416 0.020 1 279 146 GLU HA H 3.579 0.020 1 280 146 GLU HB2 H 1.915 0.020 2 281 146 GLU HB3 H 1.418 0.020 2 282 146 GLU HG2 H 2.497 0.020 2 283 146 GLU HG3 H 1.829 0.020 2 284 146 GLU N N 119.461 0.3 1 285 147 ASP C C 176.773 0.3 1 286 147 ASP CA C 58.427 0.3 1 287 147 ASP CB C 40.499 0.3 1 288 147 ASP H H 8.065 0.020 1 289 147 ASP HA H 4.666 0.020 1 290 147 ASP HB2 H 2.934 0.020 2 291 147 ASP HB3 H 2.813 0.020 2 292 147 ASP N N 118.616 0.3 1 293 148 ARG C C 175.009 0.3 1 294 148 ARG CA C 59.477 0.3 1 295 148 ARG CB C 29.834 0.3 1 296 148 ARG CG C 27.324 0.3 1 297 148 ARG CD C 43.523 0.3 1 298 148 ARG H H 8.227 0.020 1 299 148 ARG HA H 3.991 0.020 1 300 148 ARG HB2 H 1.950 0.020 2 301 148 ARG HB3 H 1.933 0.020 2 302 148 ARG HG2 H 1.703 0.020 2 303 148 ARG HG3 H 1.517 0.020 2 304 148 ARG HD2 H 3.220 0.020 2 305 148 ARG HD3 H 3.203 0.020 2 306 148 ARG HE H 7.551 0.020 1 307 148 ARG N N 120.683 0.3 1 308 148 ARG NE N 84.940 0.3 1 309 149 TYR C C 177.385 0.3 1 310 149 TYR CA C 61.988 0.3 1 311 149 TYR CB C 38.461 0.3 1 312 149 TYR CD1 C 133.067 0.3 1 313 149 TYR CE1 C 117.929 0.3 1 314 149 TYR H H 8.560 0.020 1 315 149 TYR HA H 3.870 0.020 1 316 149 TYR HB2 H 2.771 0.020 2 317 149 TYR HB3 H 2.618 0.020 2 318 149 TYR HD1 H 6.845 0.020 1 319 149 TYR HD2 H 6.845 0.020 1 320 149 TYR HE1 H 6.919 0.020 1 321 149 TYR HE2 H 6.919 0.020 1 322 149 TYR N N 121.381 0.3 1 323 150 TYR C C 174.341 0.3 1 324 150 TYR CA C 61.423 0.3 1 325 150 TYR CB C 38.665 0.3 1 326 150 TYR CD1 C 133.029 0.3 1 327 150 TYR CE1 C 118.679 0.3 1 328 150 TYR H H 8.839 0.020 1 329 150 TYR HA H 4.257 0.020 1 330 150 TYR HB2 H 3.270 0.020 2 331 150 TYR HB3 H 3.246 0.020 2 332 150 TYR HD1 H 7.287 0.020 1 333 150 TYR HD2 H 7.287 0.020 1 334 150 TYR HE1 H 6.910 0.020 1 335 150 TYR HE2 H 6.910 0.020 1 336 150 TYR N N 119.045 0.3 1 337 151 ARG C C 176.946 0.3 1 338 151 ARG CA C 60.042 0.3 1 339 151 ARG CB C 29.921 0.3 1 340 151 ARG CG C 28.122 0.3 1 341 151 ARG CD C 43.527 0.3 1 342 151 ARG H H 7.757 0.020 1 343 151 ARG HA H 3.651 0.020 1 344 151 ARG HB2 H 2.045 0.020 2 345 151 ARG HB3 H 2.026 0.020 2 346 151 ARG HG2 H 1.963 0.020 2 347 151 ARG HG3 H 1.650 0.020 2 348 151 ARG HD2 H 3.350 0.020 2 349 151 ARG HD3 H 3.249 0.020 2 350 151 ARG HE H 7.433 0.020 1 351 151 ARG N N 117.984 0.3 1 352 151 ARG NE N 84.502 0.3 1 353 152 GLU C C 175.058 0.3 1 354 152 GLU CA C 57.822 0.3 1 355 152 GLU CB C 29.852 0.3 1 356 152 GLU CG C 35.776 0.3 1 357 152 GLU H H 8.047 0.020 1 358 152 GLU HA H 4.133 0.020 1 359 152 GLU HB2 H 1.944 0.020 1 360 152 GLU HB3 H 1.944 0.020 1 361 152 GLU HG2 H 2.489 0.020 2 362 152 GLU HG3 H 2.283 0.020 2 363 152 GLU N N 115.217 0.3 1 364 153 ASN C C 172.992 0.3 1 365 153 ASN CA C 54.298 0.3 1 366 153 ASN CB C 40.534 0.3 1 367 153 ASN H H 7.641 0.020 1 368 153 ASN HA H 4.666 0.020 1 369 153 ASN HB2 H 2.295 0.020 2 370 153 ASN HB3 H 2.249 0.020 2 371 153 ASN HD21 H 6.689 0.020 1 372 153 ASN HD22 H 6.649 0.020 1 373 153 ASN N N 114.941 0.3 1 374 153 ASN ND2 N 116.568 0.3 1 375 154 GLN C C 173.514 0.3 1 376 154 GLN CA C 59.088 0.3 1 377 154 GLN CB C 28.014 0.3 1 378 154 GLN CG C 33.007 0.3 1 379 154 GLN H H 7.598 0.020 1 380 154 GLN HA H 3.654 0.020 1 381 154 GLN HB2 H 1.771 0.020 2 382 154 GLN HB3 H 1.590 0.020 2 383 154 GLN HG2 H 2.080 0.020 2 384 154 GLN HG3 H 1.681 0.020 2 385 154 GLN HE21 H 6.700 0.020 1 386 154 GLN HE22 H 6.671 0.020 1 387 154 GLN N N 118.038 0.3 1 388 154 GLN NE2 N 110.732 0.3 1 389 155 TYR C C 173.501 0.3 1 390 155 TYR CA C 58.890 0.3 1 391 155 TYR CB C 36.383 0.3 1 392 155 TYR CD1 C 133.215 0.3 1 393 155 TYR CE1 C 118.627 0.3 1 394 155 TYR H H 7.523 0.020 1 395 155 TYR HA H 4.248 0.020 1 396 155 TYR HB2 H 3.027 0.020 2 397 155 TYR HB3 H 3.008 0.020 2 398 155 TYR HD1 H 7.081 0.020 1 399 155 TYR HD2 H 7.081 0.020 1 400 155 TYR HE1 H 6.881 0.020 1 401 155 TYR HE2 H 6.881 0.020 1 402 155 TYR N N 115.736 0.3 1 403 156 ARG C C 174.100 0.3 1 404 156 ARG CA C 56.342 0.3 1 405 156 ARG CB C 30.674 0.3 1 406 156 ARG CG C 27.407 0.3 1 407 156 ARG CD C 44.054 0.3 1 408 156 ARG H H 7.407 0.020 1 409 156 ARG HA H 4.051 0.020 1 410 156 ARG HB2 H 1.828 0.020 2 411 156 ARG HB3 H 1.229 0.020 2 412 156 ARG HG2 H 1.213 0.020 2 413 156 ARG HG3 H 1.203 0.020 2 414 156 ARG HD2 H 3.137 0.020 2 415 156 ARG HD3 H 3.027 0.020 2 416 156 ARG HE H 7.262 0.020 1 417 156 ARG HH21 H 6.442 0.020 1 418 156 ARG N N 118.718 0.3 1 419 156 ARG NE N 84.533 0.3 1 420 157 TYR C C 170.605 0.3 1 421 157 TYR CA C 53.743 0.3 1 422 157 TYR CB C 35.766 0.3 1 423 157 TYR CD1 C 131.332 0.3 1 424 157 TYR CE1 C 118.027 0.3 1 425 157 TYR H H 7.499 0.020 1 426 157 TYR HA H 4.966 0.020 1 427 157 TYR HB2 H 3.214 0.020 2 428 157 TYR HB3 H 3.062 0.020 2 429 157 TYR HD1 H 7.002 0.020 1 430 157 TYR HD2 H 7.002 0.020 1 431 157 TYR HE1 H 6.690 0.020 1 432 157 TYR HE2 H 6.690 0.020 1 433 157 TYR N N 120.163 0.3 1 434 158 PRO C C 172.905 0.3 1 435 158 PRO CA C 63.345 0.3 1 436 158 PRO CB C 32.268 0.3 1 437 158 PRO CG C 27.156 0.3 1 438 158 PRO CD C 49.905 0.3 1 439 158 PRO HA H 4.423 0.020 1 440 158 PRO HB2 H 2.284 0.020 2 441 158 PRO HB3 H 1.766 0.020 2 442 158 PRO HG2 H 1.586 0.020 2 443 158 PRO HG3 H 1.291 0.020 2 444 158 PRO HD2 H 3.316 0.020 2 445 158 PRO HD3 H 3.281 0.020 2 446 159 ASN C C 170.497 0.3 1 447 159 ASN CA C 51.922 0.3 1 448 159 ASN CB C 38.319 0.3 1 449 159 ASN H H 8.632 0.020 1 450 159 ASN HA H 4.750 0.020 1 451 159 ASN HB2 H 3.611 0.020 2 452 159 ASN HB3 H 2.530 0.020 2 453 159 ASN HD21 H 7.558 0.020 1 454 159 ASN HD22 H 6.843 0.020 1 455 159 ASN N N 116.614 0.3 1 456 159 ASN ND2 N 109.600 0.3 1 457 160 GLN C C 172.732 0.3 1 458 160 GLN CA C 54.107 0.3 1 459 160 GLN CB C 33.681 0.3 1 460 160 GLN CG C 34.063 0.3 1 461 160 GLN H H 7.281 0.020 1 462 160 GLN HA H 4.640 0.020 1 463 160 GLN HB2 H 2.060 0.020 2 464 160 GLN HB3 H 1.828 0.020 2 465 160 GLN HG2 H 2.213 0.020 2 466 160 GLN HG3 H 2.149 0.020 2 467 160 GLN HE21 H 8.007 0.020 1 468 160 GLN HE22 H 7.072 0.020 1 469 160 GLN N N 114.546 0.3 1 470 160 GLN NE2 N 112.894 0.3 1 471 161 VAL C C 171.217 0.3 1 472 161 VAL CA C 58.885 0.3 1 473 161 VAL CB C 33.422 0.3 1 474 161 VAL CG1 C 23.865 0.3 1 475 161 VAL CG2 C 18.298 0.3 1 476 161 VAL H H 8.679 0.020 1 477 161 VAL HA H 4.882 0.020 1 478 161 VAL HB H 2.513 0.020 1 479 161 VAL HG1 H 0.970 0.020 2 480 161 VAL HG2 H 0.803 0.020 2 481 161 VAL N N 113.718 0.3 1 482 162 MET C C 171.297 0.3 1 483 162 MET CA C 54.302 0.3 1 484 162 MET CB C 36.527 0.3 1 485 162 MET CG C 32.982 0.3 1 486 162 MET CE C 17.419 0.3 1 487 162 MET H H 8.512 0.020 1 488 162 MET HA H 5.531 0.020 1 489 162 MET HB2 H 1.748 0.020 2 490 162 MET HB3 H 1.698 0.020 2 491 162 MET HG2 H 2.475 0.020 2 492 162 MET HG3 H 2.355 0.020 2 493 162 MET HE H 1.874 0.020 1 494 162 MET N N 121.446 0.3 1 495 163 TYR C C 171.222 0.3 1 496 163 TYR CA C 55.887 0.3 1 497 163 TYR CB C 39.721 0.3 1 498 163 TYR CD1 C 134.143 0.3 1 499 163 TYR CE1 C 117.767 0.3 1 500 163 TYR H H 8.261 0.020 1 501 163 TYR HA H 4.843 0.020 1 502 163 TYR HB2 H 2.970 0.020 2 503 163 TYR HB3 H 2.655 0.020 2 504 163 TYR HD1 H 7.138 0.020 1 505 163 TYR HD2 H 7.138 0.020 1 506 163 TYR HE1 H 6.520 0.020 1 507 163 TYR HE2 H 6.520 0.020 1 508 163 TYR N N 112.737 0.3 1 509 164 ARG C C 170.022 0.3 1 510 164 ARG CA C 53.748 0.3 1 511 164 ARG CB C 29.658 0.3 1 512 164 ARG CG C 28.099 0.3 1 513 164 ARG CD C 43.497 0.3 1 514 164 ARG H H 8.057 0.020 1 515 164 ARG HA H 4.723 0.020 1 516 164 ARG HB2 H 1.966 0.020 2 517 164 ARG HB3 H 1.949 0.020 2 518 164 ARG HG2 H 1.268 0.020 2 519 164 ARG HG3 H 1.191 0.020 2 520 164 ARG HD2 H 2.919 0.020 2 521 164 ARG HD3 H 2.939 0.020 2 522 164 ARG HE H 6.702 0.020 1 523 164 ARG N N 119.929 0.3 1 524 164 ARG NE N 84.705 0.3 1 525 165 PRO C C 175.856 0.3 1 526 165 PRO CA C 63.587 0.3 1 527 165 PRO CB C 32.650 0.3 1 528 165 PRO CG C 28.297 0.3 1 529 165 PRO CD C 50.128 0.3 1 530 165 PRO HA H 4.610 0.020 1 531 165 PRO HB2 H 2.500 0.020 2 532 165 PRO HB3 H 2.026 0.020 2 533 165 PRO HG2 H 2.155 0.020 2 534 165 PRO HG3 H 2.031 0.020 2 535 165 PRO HD2 H 3.706 0.020 2 536 165 PRO HD3 H 3.476 0.020 2 537 166 ILE C C 174.728 0.3 1 538 166 ILE CA C 65.481 0.3 1 539 166 ILE CB C 38.395 0.3 1 540 166 ILE CG1 C 27.075 0.3 1 541 166 ILE CG2 C 18.197 0.3 1 542 166 ILE CD1 C 14.004 0.3 1 543 166 ILE H H 8.523 0.020 1 544 166 ILE HA H 4.391 0.020 1 545 166 ILE HB H 1.933 0.020 1 546 166 ILE HG12 H 1.217 0.020 1 547 166 ILE HG13 H 1.217 0.020 1 548 166 ILE HG2 H 0.805 0.020 1 549 166 ILE HD1 H 0.531 0.020 1 550 166 ILE N N 117.157 0.3 1 551 167 ASP C C 174.606 0.3 1 552 167 ASP CA C 54.501 0.3 1 553 167 ASP CB C 39.166 0.3 1 554 167 ASP H H 8.332 0.020 1 555 167 ASP HA H 4.656 0.020 1 556 167 ASP HB2 H 2.978 0.020 2 557 167 ASP HB3 H 2.755 0.020 2 558 167 ASP N N 118.409 0.3 1 559 168 GLN C C 172.406 0.3 1 560 168 GLN CA C 55.763 0.3 1 561 168 GLN CB C 27.426 0.3 1 562 168 GLN CG C 34.231 0.3 1 563 168 GLN H H 8.308 0.020 1 564 168 GLN HA H 4.117 0.020 1 565 168 GLN HB2 H 1.907 0.020 2 566 168 GLN HB3 H 1.725 0.020 2 567 168 GLN HG2 H 2.260 0.020 2 568 168 GLN HG3 H 2.217 0.020 2 569 168 GLN HE21 H 7.605 0.020 1 570 168 GLN HE22 H 6.840 0.020 1 571 168 GLN N N 117.786 0.3 1 572 168 GLN NE2 N 112.816 0.3 1 573 169 TYR C C 173.889 0.3 1 574 169 TYR CA C 57.243 0.3 1 575 169 TYR CB C 42.236 0.3 1 576 169 TYR CD1 C 134.138 0.3 1 577 169 TYR CE1 C 118.935 0.3 1 578 169 TYR H H 7.887 0.020 1 579 169 TYR HA H 4.861 0.020 1 580 169 TYR HB2 H 3.434 0.020 2 581 169 TYR HB3 H 3.064 0.020 2 582 169 TYR HD1 H 7.381 0.020 1 583 169 TYR HD2 H 7.381 0.020 1 584 169 TYR HE1 H 6.990 0.020 1 585 169 TYR HE2 H 6.990 0.020 1 586 169 TYR N N 116.921 0.3 1 587 170 GLY CA C 45.147 0.3 1 588 170 GLY H H 9.064 0.020 1 589 170 GLY HA2 H 4.354 0.020 1 590 170 GLY N N 107.433 0.3 1 591 171 SER C C 171.124 0.3 1 592 171 SER CA C 56.794 0.3 1 593 171 SER CB C 65.770 0.3 1 594 171 SER HA H 4.709 0.020 1 595 171 SER HB2 H 4.141 0.020 2 596 171 SER HB3 H 4.122 0.020 2 597 172 GLN C C 175.165 0.3 1 598 172 GLN CA C 59.024 0.3 1 599 172 GLN CB C 28.588 0.3 1 600 172 GLN CG C 33.341 0.3 1 601 172 GLN H H 8.912 0.020 1 602 172 GLN HA H 2.983 0.020 1 603 172 GLN HB2 H 1.586 0.020 2 604 172 GLN HB3 H 1.545 0.020 2 605 172 GLN HG2 H 1.721 0.020 2 606 172 GLN HG3 H 1.050 0.020 2 607 172 GLN HE21 H 7.093 0.020 1 608 172 GLN HE22 H 6.895 0.020 1 609 172 GLN N N 122.103 0.3 1 610 172 GLN NE2 N 111.346 0.3 1 611 173 ASN C C 175.359 0.3 1 612 173 ASN CA C 56.462 0.3 1 613 173 ASN CB C 37.827 0.3 1 614 173 ASN H H 8.647 0.020 1 615 173 ASN HA H 4.221 0.020 1 616 173 ASN HB2 H 2.759 0.020 2 617 173 ASN HB3 H 2.661 0.020 2 618 173 ASN HD21 H 7.644 0.020 1 619 173 ASN HD22 H 6.980 0.020 1 620 173 ASN N N 116.220 0.3 1 621 173 ASN ND2 N 112.420 0.3 1 622 174 SER C C 174.101 0.3 1 623 174 SER CA C 61.577 0.3 1 624 174 SER CB C 62.879 0.3 1 625 174 SER H H 8.022 0.020 1 626 174 SER HA H 4.301 0.020 1 627 174 SER HB2 H 4.194 0.020 2 628 174 SER HB3 H 4.143 0.020 2 629 174 SER N N 115.424 0.3 1 630 175 PHE C C 174.686 0.3 1 631 175 PHE CA C 60.954 0.3 1 632 175 PHE CB C 38.699 0.3 1 633 175 PHE CD1 C 132.687 0.3 1 634 175 PHE CE1 C 132.421 0.3 1 635 175 PHE CZ C 128.978 0.3 1 636 175 PHE H H 7.435 0.020 1 637 175 PHE HB2 H 3.210 0.020 2 638 175 PHE HB3 H 3.190 0.020 2 639 175 PHE HD1 H 7.219 0.020 1 640 175 PHE HD2 H 7.219 0.020 1 641 175 PHE HE1 H 7.879 0.020 1 642 175 PHE HE2 H 7.879 0.020 1 643 175 PHE HZ H 6.605 0.020 1 644 175 PHE N N 123.536 0.3 1 645 176 VAL C C 174.354 0.3 1 646 176 VAL CA C 67.484 0.3 1 647 176 VAL CB C 31.961 0.3 1 648 176 VAL CG1 C 24.564 0.3 1 649 176 VAL CG2 C 21.957 0.3 1 650 176 VAL H H 8.970 0.020 1 651 176 VAL HA H 3.326 0.020 1 652 176 VAL HB H 2.155 0.020 1 653 176 VAL HG1 H 1.064 0.020 2 654 176 VAL HG2 H 1.017 0.020 2 655 176 VAL N N 120.231 0.3 1 656 177 HIS C C 174.513 0.3 1 657 177 HIS CA C 59.087 0.3 1 658 177 HIS CB C 28.156 0.3 1 659 177 HIS CD2 C 120.284 0.3 1 660 177 HIS CE1 C 136.451 0.3 1 661 177 HIS H H 8.207 0.020 1 662 177 HIS HA H 4.277 0.020 1 663 177 HIS HB2 H 3.341 0.020 2 664 177 HIS HB3 H 3.319 0.020 2 665 177 HIS HD2 H 7.383 0.020 1 666 177 HIS HE1 H 8.627 0.020 1 667 177 HIS N N 116.180 0.3 1 668 178 ASP C C 173.477 0.3 1 669 178 ASP CA C 57.037 0.3 1 670 178 ASP CB C 41.158 0.3 1 671 178 ASP H H 7.428 0.020 1 672 178 ASP HA H 4.635 0.020 1 673 178 ASP HB2 H 2.983 0.020 2 674 178 ASP HB3 H 2.839 0.020 2 675 178 ASP N N 118.403 0.3 1 676 179 CYS C C 174.886 0.3 1 677 179 CYS CA C 58.698 0.3 1 678 179 CYS CB C 40.716 0.3 1 679 179 CYS H H 8.293 0.020 1 680 179 CYS HA H 4.603 0.020 1 681 179 CYS HB2 H 3.113 0.020 2 682 179 CYS HB3 H 2.655 0.020 2 683 179 CYS N N 119.416 0.3 1 684 180 VAL C C 174.540 0.3 1 685 180 VAL CA C 66.100 0.3 1 686 180 VAL CB C 31.785 0.3 1 687 180 VAL CG1 C 23.270 0.3 1 688 180 VAL CG2 C 21.285 0.3 1 689 180 VAL H H 9.026 0.020 1 690 180 VAL HA H 3.632 0.020 1 691 180 VAL HB H 2.120 0.020 1 692 180 VAL HG1 H 1.045 0.020 2 693 180 VAL HG2 H 0.934 0.020 2 694 180 VAL N N 123.812 0.3 1 695 181 ASN C C 175.895 0.3 1 696 181 ASN CA C 56.588 0.3 1 697 181 ASN CB C 38.649 0.3 1 698 181 ASN H H 7.541 0.020 1 699 181 ASN HA H 4.318 0.020 1 700 181 ASN HB2 H 2.891 0.020 2 701 181 ASN HB3 H 2.828 0.020 2 702 181 ASN HD21 H 7.710 0.020 1 703 181 ASN HD22 H 6.787 0.020 1 704 181 ASN N N 116.961 0.3 1 705 181 ASN ND2 N 111.963 0.3 1 706 182 ILE C C 175.582 0.3 1 707 182 ILE CA C 63.041 0.3 1 708 182 ILE CB C 37.453 0.3 1 709 182 ILE CG1 C 28.080 0.3 1 710 182 ILE CG2 C 18.251 0.3 1 711 182 ILE CD1 C 12.670 0.3 1 712 182 ILE H H 8.934 0.020 1 713 182 ILE HA H 3.749 0.020 1 714 182 ILE HB H 1.612 0.020 1 715 182 ILE HG12 H 0.841 0.020 1 716 182 ILE HG13 H 0.841 0.020 1 717 182 ILE HG2 H 0.394 0.020 1 718 182 ILE HD1 H 0.543 0.020 1 719 182 ILE N N 118.983 0.3 1 720 183 THR C C 175.298 0.3 1 721 183 THR CA C 68.231 0.3 1 722 183 THR CB C 68.333 0.3 1 723 183 THR CG2 C 21.867 0.3 1 724 183 THR H H 8.080 0.020 1 725 183 THR HA H 3.927 0.020 1 726 183 THR HB H 4.413 0.020 1 727 183 THR HG1 H 6.155 0.020 1 728 183 THR HG2 H 1.357 0.020 1 729 183 THR N N 117.879 0.3 1 730 184 VAL C C 176.361 0.3 1 731 184 VAL CA C 67.613 0.3 1 732 184 VAL CB C 31.331 0.3 1 733 184 VAL CG1 C 23.593 0.3 1 734 184 VAL CG2 C 21.118 0.3 1 735 184 VAL H H 8.797 0.020 1 736 184 VAL HA H 3.583 0.020 1 737 184 VAL HB H 2.287 0.020 1 738 184 VAL HG1 H 1.005 0.020 2 739 184 VAL HG2 H 0.927 0.020 2 740 184 VAL N N 120.689 0.3 1 741 185 LYS C C 176.906 0.3 1 742 185 LYS CA C 59.646 0.3 1 743 185 LYS CB C 32.077 0.3 1 744 185 LYS CG C 25.042 0.3 1 745 185 LYS CD C 29.100 0.3 1 746 185 LYS CE C 41.902 0.3 1 747 185 LYS H H 8.047 0.020 1 748 185 LYS HA H 4.067 0.020 1 749 185 LYS HB2 H 1.999 0.020 1 750 185 LYS HB3 H 1.999 0.020 1 751 185 LYS HG2 H 1.494 0.020 2 752 185 LYS HG3 H 1.417 0.020 2 753 185 LYS HD2 H 1.652 0.020 1 754 185 LYS HD3 H 1.652 0.020 1 755 185 LYS HE2 H 2.959 0.020 1 756 185 LYS HE3 H 2.959 0.020 1 757 185 LYS N N 121.468 0.3 1 758 186 GLN C C 175.382 0.3 1 759 186 GLN CA C 58.028 0.3 1 760 186 GLN CB C 27.870 0.3 1 761 186 GLN CG C 33.614 0.3 1 762 186 GLN H H 8.336 0.020 1 763 186 GLN HA H 4.065 0.020 1 764 186 GLN HB2 H 2.164 0.020 2 765 186 GLN HB3 H 2.133 0.020 2 766 186 GLN HG2 H 2.464 0.020 2 767 186 GLN HG3 H 2.342 0.020 2 768 186 GLN HE21 H 7.388 0.020 1 769 186 GLN HE22 H 6.815 0.020 1 770 186 GLN N N 117.891 0.3 1 771 186 GLN NE2 N 111.348 0.3 1 772 187 HIS C C 173.742 0.3 1 773 187 HIS CA C 58.261 0.3 1 774 187 HIS CB C 30.195 0.3 1 775 187 HIS CD2 C 118.943 0.3 1 776 187 HIS CE1 C 138.251 0.3 1 777 187 HIS H H 8.016 0.020 1 778 187 HIS HA H 4.590 0.020 1 779 187 HIS HB2 H 3.298 0.020 2 780 187 HIS HB3 H 3.248 0.020 2 781 187 HIS HD2 H 7.185 0.020 1 782 187 HIS HE1 H 8.417 0.020 1 783 187 HIS N N 116.591 0.3 1 784 188 THR C C 173.157 0.3 1 785 188 THR CA C 63.522 0.3 1 786 188 THR CB C 69.469 0.3 1 787 188 THR CG2 C 21.621 0.3 1 788 188 THR H H 8.116 0.020 1 789 188 THR HA H 4.337 0.020 1 790 188 THR HB H 4.410 0.020 1 791 188 THR HG2 H 1.104 0.020 1 792 188 THR N N 110.087 0.3 1 793 189 THR C C 172.931 0.3 1 794 189 THR CA C 63.685 0.3 1 795 189 THR CB C 69.667 0.3 1 796 189 THR CG2 C 21.386 0.3 1 797 189 THR H H 7.928 0.020 1 798 189 THR HA H 4.406 0.020 1 799 189 THR HB H 4.338 0.020 1 800 189 THR HG2 H 1.283 0.020 1 801 189 THR N N 116.083 0.3 1 802 190 THR C C 172.945 0.3 1 803 190 THR CA C 63.000 0.3 1 804 190 THR CB C 69.537 0.3 1 805 190 THR CG2 C 21.508 0.3 1 806 190 THR H H 8.095 0.020 1 807 190 THR HA H 4.407 0.020 1 808 190 THR HB H 4.314 0.020 1 809 190 THR HG2 H 1.270 0.020 1 810 190 THR N N 115.989 0.3 1 811 191 THR C C 173.304 0.3 1 812 191 THR CA C 63.066 0.3 1 813 191 THR CB C 69.321 0.3 1 814 191 THR CG2 C 21.576 0.3 1 815 191 THR H H 8.126 0.020 1 816 191 THR HA H 4.334 0.020 1 817 191 THR HB H 4.253 0.020 1 818 191 THR HG2 H 1.132 0.020 1 819 191 THR N N 115.328 0.3 1 820 192 THR C C 173.583 0.3 1 821 192 THR CA C 63.093 0.3 1 822 192 THR CB C 69.476 0.3 1 823 192 THR CG2 C 21.597 0.3 1 824 192 THR H H 8.191 0.020 1 825 192 THR HA H 4.431 0.020 1 826 192 THR HB H 4.376 0.020 1 827 192 THR HG2 H 1.264 0.020 1 828 192 THR N N 115.562 0.3 1 829 193 THR C C 172.440 0.3 1 830 193 THR CA C 62.994 0.3 1 831 193 THR CB C 69.400 0.3 1 832 193 THR CG2 C 21.690 0.3 1 833 193 THR H H 8.027 0.020 1 834 193 THR HA H 4.301 0.020 1 835 193 THR HB H 4.279 0.020 1 836 193 THR HG2 H 1.245 0.020 1 837 193 THR N N 115.801 0.3 1 838 194 LYS C C 174.527 0.3 1 839 194 LYS CA C 56.652 0.3 1 840 194 LYS CB C 32.307 0.3 1 841 194 LYS CG C 24.770 0.3 1 842 194 LYS CD C 29.030 0.3 1 843 194 LYS CE C 41.986 0.3 1 844 194 LYS H H 8.083 0.020 1 845 194 LYS HA H 4.317 0.020 1 846 194 LYS HB2 H 1.920 0.020 2 847 194 LYS HB3 H 1.813 0.020 2 848 194 LYS HG2 H 1.487 0.020 2 849 194 LYS HG3 H 1.427 0.020 2 850 194 LYS HD2 H 1.675 0.020 1 851 194 LYS HD3 H 1.675 0.020 1 852 194 LYS HE2 H 2.969 0.020 1 853 194 LYS HE3 H 2.969 0.020 1 854 194 LYS N N 122.160 0.3 1 855 195 GLY C C 171.656 0.3 1 856 195 GLY CA C 45.285 0.3 1 857 195 GLY H H 8.275 0.020 1 858 195 GLY HA2 H 4.042 0.020 1 859 195 GLY N N 109.570 0.3 1 860 196 GLU C C 172.865 0.3 1 861 196 GLU CA C 55.650 0.3 1 862 196 GLU CB C 30.074 0.3 1 863 196 GLU CG C 34.975 0.3 1 864 196 GLU H H 7.885 0.020 1 865 196 GLU HA H 4.256 0.020 1 866 196 GLU HB2 H 1.745 0.020 1 867 196 GLU HB3 H 1.745 0.020 1 868 196 GLU HG2 H 2.149 0.020 2 869 196 GLU HG3 H 2.168 0.020 2 870 196 GLU N N 120.112 0.3 1 871 197 ASN C C 171.855 0.3 1 872 197 ASN CA C 52.837 0.3 1 873 197 ASN CB C 39.659 0.3 1 874 197 ASN H H 8.450 0.020 1 875 197 ASN HA H 4.680 0.020 1 876 197 ASN HB2 H 2.714 0.020 2 877 197 ASN HB3 H 2.633 0.020 2 878 197 ASN HD21 H 7.555 0.020 1 879 197 ASN HD22 H 6.877 0.020 1 880 197 ASN N N 119.944 0.3 1 881 197 ASN ND2 N 113.131 0.3 1 882 198 PHE C C 174.141 0.3 1 883 198 PHE CA C 57.121 0.3 1 884 198 PHE CB C 39.966 0.3 1 885 198 PHE CD1 C 131.541 0.3 1 886 198 PHE CE1 C 131.452 0.3 1 887 198 PHE CZ C 129.909 0.3 1 888 198 PHE H H 8.581 0.020 1 889 198 PHE HA H 5.142 0.020 1 890 198 PHE HB2 H 2.997 0.020 2 891 198 PHE HB3 H 3.156 0.020 2 892 198 PHE HD1 H 7.366 0.020 1 893 198 PHE HD2 H 7.366 0.020 1 894 198 PHE HE1 H 7.342 0.020 1 895 198 PHE HE2 H 7.342 0.020 1 896 198 PHE HZ H 7.430 0.020 1 897 198 PHE N N 121.272 0.3 1 898 199 THR C C 172.918 0.3 1 899 199 THR CA C 60.423 0.3 1 900 199 THR CB C 71.867 0.3 1 901 199 THR CG2 C 21.643 0.3 1 902 199 THR H H 9.589 0.020 1 903 199 THR HA H 4.618 0.020 1 904 199 THR HB H 4.831 0.020 1 905 199 THR HG2 H 1.424 0.020 1 906 199 THR N N 115.992 0.3 1 907 200 GLU C C 176.441 0.3 1 908 200 GLU CA C 59.658 0.3 1 909 200 GLU CB C 28.610 0.3 1 910 200 GLU CG C 35.311 0.3 1 911 200 GLU H H 9.099 0.020 1 912 200 GLU HA H 4.082 0.020 1 913 200 GLU HB2 H 2.140 0.020 2 914 200 GLU HB3 H 2.073 0.020 2 915 200 GLU HG2 H 2.441 0.020 2 916 200 GLU HG3 H 2.382 0.020 2 917 200 GLU N N 119.824 0.3 1 918 201 THR C C 172.839 0.3 1 919 201 THR CA C 66.727 0.3 1 920 201 THR CB C 68.597 0.3 1 921 201 THR CG2 C 20.904 0.3 1 922 201 THR H H 7.981 0.020 1 923 201 THR HA H 3.780 0.020 1 924 201 THR HB H 3.739 0.020 1 925 201 THR HG2 H 0.639 0.020 1 926 201 THR N N 116.294 0.3 1 927 202 ASP C C 175.324 0.3 1 928 202 ASP CA C 58.028 0.3 1 929 202 ASP CB C 41.838 0.3 1 930 202 ASP H H 7.557 0.020 1 931 202 ASP HA H 4.538 0.020 1 932 202 ASP HB2 H 3.374 0.020 2 933 202 ASP HB3 H 2.599 0.020 2 934 202 ASP N N 119.423 0.3 1 935 203 ILE C C 174.912 0.3 1 936 203 ILE CA C 64.623 0.3 1 937 203 ILE CB C 36.943 0.3 1 938 203 ILE CG1 C 28.689 0.3 1 939 203 ILE CG2 C 17.061 0.3 1 940 203 ILE CD1 C 11.470 0.3 1 941 203 ILE H H 8.134 0.020 1 942 203 ILE HA H 3.456 0.020 1 943 203 ILE HB H 1.959 0.020 1 944 203 ILE HG12 H 1.251 0.020 1 945 203 ILE HG13 H 1.251 0.020 1 946 203 ILE HG2 H 0.844 0.020 1 947 203 ILE HD1 H 0.753 0.020 1 948 203 ILE N N 119.025 0.3 1 949 204 LYS C C 177.717 0.3 1 950 204 LYS CA C 59.375 0.3 1 951 204 LYS CB C 32.247 0.3 1 952 204 LYS CG C 25.044 0.3 1 953 204 LYS CD C 32.182 0.3 1 954 204 LYS CE C 41.945 0.3 1 955 204 LYS H H 7.859 0.020 1 956 204 LYS HA H 4.034 0.020 1 957 204 LYS HB2 H 1.934 0.020 1 958 204 LYS HB3 H 1.934 0.020 1 959 204 LYS HG2 H 1.585 0.020 2 960 204 LYS HG3 H 1.402 0.020 2 961 204 LYS HD2 H 1.832 0.020 1 962 204 LYS HD3 H 1.832 0.020 1 963 204 LYS HE2 H 2.916 0.020 1 964 204 LYS HE3 H 2.916 0.020 1 965 204 LYS N N 119.556 0.3 1 966 205 ILE C C 175.337 0.3 1 967 205 ILE CA C 64.865 0.3 1 968 205 ILE CB C 37.523 0.3 1 969 205 ILE CG1 C 28.561 0.3 1 970 205 ILE CG2 C 18.330 0.3 1 971 205 ILE CD1 C 13.494 0.3 1 972 205 ILE H H 7.995 0.020 1 973 205 ILE HA H 3.570 0.020 1 974 205 ILE HB H 1.955 0.020 1 975 205 ILE HG12 H 0.710 0.020 1 976 205 ILE HG13 H 0.710 0.020 1 977 205 ILE HG2 H 0.825 0.020 1 978 205 ILE HD1 H 0.618 0.020 1 979 205 ILE N N 119.420 0.3 1 980 206 MET C C 175.484 0.3 1 981 206 MET CA C 59.961 0.3 1 982 206 MET CB C 33.418 0.3 1 983 206 MET CG C 31.810 0.3 1 984 206 MET CE C 16.081 0.3 1 985 206 MET H H 8.888 0.020 1 986 206 MET HA H 3.495 0.020 1 987 206 MET HB2 H 1.995 0.020 2 988 206 MET HB3 H 1.865 0.020 2 989 206 MET HG2 H 2.016 0.020 2 990 206 MET HG3 H 2.008 0.020 2 991 206 MET HE H 1.510 0.020 1 992 206 MET N N 119.371 0.3 1 993 207 GLU C C 175.922 0.3 1 994 207 GLU CA C 60.338 0.3 1 995 207 GLU CB C 28.304 0.3 1 996 207 GLU CG C 35.159 0.3 1 997 207 GLU H H 8.603 0.020 1 998 207 GLU HA H 3.652 0.020 1 999 207 GLU HB2 H 2.222 0.020 2 1000 207 GLU HB3 H 2.025 0.020 2 1001 207 GLU HG2 H 2.627 0.020 2 1002 207 GLU HG3 H 2.264 0.020 2 1003 207 GLU N N 116.915 0.3 1 1004 208 ARG C C 176.876 0.3 1 1005 208 ARG CA C 58.510 0.3 1 1006 208 ARG CB C 30.217 0.3 1 1007 208 ARG CG C 26.970 0.3 1 1008 208 ARG CD C 42.894 0.3 1 1009 208 ARG H H 7.245 0.020 1 1010 208 ARG HA H 4.170 0.020 1 1011 208 ARG HB2 H 2.102 0.020 2 1012 208 ARG HB3 H 2.081 0.020 2 1013 208 ARG HG2 H 1.897 0.020 2 1014 208 ARG HG3 H 1.817 0.020 2 1015 208 ARG HD2 H 3.246 0.020 2 1016 208 ARG HD3 H 3.234 0.020 2 1017 208 ARG HE H 7.229 0.020 1 1018 208 ARG N N 117.654 0.3 1 1019 208 ARG NE N 83.709 0.3 1 1020 209 VAL C C 175.396 0.3 1 1021 209 VAL CA C 65.815 0.3 1 1022 209 VAL CB C 32.590 0.3 1 1023 209 VAL CG1 C 23.532 0.3 1 1024 209 VAL CG2 C 21.112 0.3 1 1025 209 VAL H H 8.398 0.020 1 1026 209 VAL HA H 3.740 0.020 1 1027 209 VAL HB H 2.083 0.020 1 1028 209 VAL HG1 H 1.044 0.020 2 1029 209 VAL HG2 H 1.115 0.020 2 1030 209 VAL N N 121.572 0.3 1 1031 210 VAL C C 175.058 0.3 1 1032 210 VAL CA C 65.988 0.3 1 1033 210 VAL CB C 30.988 0.3 1 1034 210 VAL CG1 C 24.618 0.3 1 1035 210 VAL CG2 C 24.166 0.3 1 1036 210 VAL H H 9.087 0.020 1 1037 210 VAL HA H 3.665 0.020 1 1038 210 VAL HB H 2.183 0.020 1 1039 210 VAL HG1 H 1.185 0.020 2 1040 210 VAL HG2 H 0.938 0.020 2 1041 210 VAL N N 119.802 0.3 1 1042 211 GLU C C 174.979 0.3 1 1043 211 GLU CA C 60.890 0.3 1 1044 211 GLU CB C 28.808 0.3 1 1045 211 GLU CG C 35.501 0.3 1 1046 211 GLU H H 8.025 0.020 1 1047 211 GLU HA H 3.550 0.020 1 1048 211 GLU HB2 H 2.200 0.020 2 1049 211 GLU HB3 H 2.174 0.020 2 1050 211 GLU HG2 H 2.095 0.020 2 1051 211 GLU HG3 H 2.080 0.020 2 1052 211 GLU N N 121.311 0.3 1 1053 212 GLN C C 176.427 0.3 1 1054 212 GLN CA C 58.551 0.3 1 1055 212 GLN CB C 27.784 0.3 1 1056 212 GLN CG C 33.542 0.3 1 1057 212 GLN H H 7.152 0.020 1 1058 212 GLN HA H 3.973 0.020 1 1059 212 GLN HB2 H 2.228 0.020 2 1060 212 GLN HB3 H 2.151 0.020 2 1061 212 GLN HG2 H 2.459 0.020 2 1062 212 GLN HG3 H 2.443 0.020 2 1063 212 GLN HE21 H 7.593 0.020 1 1064 212 GLN HE22 H 6.931 0.020 1 1065 212 GLN N N 115.376 0.3 1 1066 212 GLN NE2 N 114.223 0.3 1 1067 213 MET C C 175.997 0.3 1 1068 213 MET CA C 59.660 0.3 1 1069 213 MET CB C 34.801 0.3 1 1070 213 MET CG C 28.743 0.3 1 1071 213 MET CE C 16.322 0.3 1 1072 213 MET H H 8.024 0.020 1 1073 213 MET HA H 4.115 0.020 1 1074 213 MET HB2 H 2.260 0.020 2 1075 213 MET HB3 H 2.154 0.020 2 1076 213 MET HG2 H 2.153 0.020 2 1077 213 MET HG3 H 2.138 0.020 2 1078 213 MET HE H 1.907 0.020 1 1079 213 MET N N 119.252 0.3 1 1080 214 CYS C C 174.261 0.3 1 1081 214 CYS CA C 60.204 0.3 1 1082 214 CYS CB C 42.284 0.3 1 1083 214 CYS H H 9.284 0.020 1 1084 214 CYS HA H 4.360 0.020 1 1085 214 CYS HB2 H 3.546 0.020 2 1086 214 CYS HB3 H 2.827 0.020 2 1087 214 CYS N N 119.247 0.3 1 1088 215 ILE C C 175.404 0.3 1 1089 215 ILE CA C 66.721 0.3 1 1090 215 ILE CB C 38.243 0.3 1 1091 215 ILE CG1 C 30.850 0.3 1 1092 215 ILE CG2 C 16.915 0.3 1 1093 215 ILE CD1 C 14.009 0.3 1 1094 215 ILE H H 8.339 0.020 1 1095 215 ILE HA H 3.489 0.020 1 1096 215 ILE HB H 1.972 0.020 1 1097 215 ILE HG12 H 0.835 0.020 1 1098 215 ILE HG13 H 0.835 0.020 1 1099 215 ILE HG2 H 0.857 0.020 1 1100 215 ILE HD1 H 0.828 0.020 1 1101 215 ILE N N 123.772 0.3 1 1102 216 THR C C 173.596 0.3 1 1103 216 THR CA C 66.981 0.3 1 1104 216 THR CB C 68.418 0.3 1 1105 216 THR CG2 C 22.086 0.3 1 1106 216 THR H H 8.063 0.020 1 1107 216 THR HA H 3.862 0.020 1 1108 216 THR HB H 4.285 0.020 1 1109 216 THR HG2 H 1.260 0.020 1 1110 216 THR N N 118.233 0.3 1 1111 217 GLN C C 175.208 0.3 1 1112 217 GLN CA C 58.636 0.3 1 1113 217 GLN CB C 28.115 0.3 1 1114 217 GLN CG C 32.230 0.3 1 1115 217 GLN H H 8.719 0.020 1 1116 217 GLN HA H 3.759 0.020 1 1117 217 GLN HB2 H 2.314 0.020 2 1118 217 GLN HB3 H 2.070 0.020 2 1119 217 GLN HG2 H 1.756 0.020 2 1120 217 GLN HG3 H 1.670 0.020 2 1121 217 GLN HE21 H 7.382 0.020 1 1122 217 GLN HE22 H 6.647 0.020 1 1123 217 GLN N N 121.797 0.3 1 1124 217 GLN NE2 N 114.540 0.3 1 1125 218 TYR C C 174.393 0.3 1 1126 218 TYR CA C 62.286 0.3 1 1127 218 TYR CB C 36.939 0.3 1 1128 218 TYR CD1 C 132.990 0.3 1 1129 218 TYR CE1 C 117.269 0.3 1 1130 218 TYR H H 8.472 0.020 1 1131 218 TYR HA H 2.989 0.020 1 1132 218 TYR HB2 H 3.042 0.020 2 1133 218 TYR HB3 H 2.735 0.020 2 1134 218 TYR HD1 H 6.223 0.020 1 1135 218 TYR HD2 H 6.223 0.020 1 1136 218 TYR HE1 H 6.441 0.020 1 1137 218 TYR HE2 H 6.441 0.020 1 1138 218 TYR N N 119.862 0.3 1 1139 219 GLN C C 176.507 0.3 1 1140 219 GLN CA C 58.694 0.3 1 1141 219 GLN CB C 27.634 0.3 1 1142 219 GLN CG C 33.755 0.3 1 1143 219 GLN H H 8.231 0.020 1 1144 219 GLN HA H 3.850 0.020 1 1145 219 GLN HB2 H 2.299 0.020 2 1146 219 GLN HB3 H 2.121 0.020 2 1147 219 GLN HG2 H 2.698 0.020 2 1148 219 GLN HG3 H 2.500 0.020 2 1149 219 GLN HE21 H 7.466 0.020 1 1150 219 GLN HE22 H 6.803 0.020 1 1151 219 GLN N N 117.214 0.3 1 1152 219 GLN NE2 N 110.831 0.3 1 1153 220 ASN C C 176.002 0.3 1 1154 220 ASN CA C 55.721 0.3 1 1155 220 ASN CB C 37.771 0.3 1 1156 220 ASN H H 8.387 0.020 1 1157 220 ASN HA H 4.416 0.020 1 1158 220 ASN HB2 H 2.870 0.020 2 1159 220 ASN HB3 H 2.847 0.020 2 1160 220 ASN HD21 H 7.288 0.020 1 1161 220 ASN HD22 H 6.911 0.020 1 1162 220 ASN N N 118.662 0.3 1 1163 220 ASN ND2 N 110.637 0.3 1 1164 221 GLU C C 176.161 0.3 1 1165 221 GLU CA C 57.984 0.3 1 1166 221 GLU CB C 29.687 0.3 1 1167 221 GLU CG C 35.430 0.3 1 1168 221 GLU H H 8.251 0.020 1 1169 221 GLU HA H 4.021 0.020 1 1170 221 GLU HB2 H 2.039 0.020 2 1171 221 GLU HB3 H 1.804 0.020 2 1172 221 GLU HG2 H 2.419 0.020 2 1173 221 GLU HG3 H 2.409 0.020 2 1174 221 GLU N N 120.083 0.3 1 1175 222 TYR C C 175.337 0.3 1 1176 222 TYR CA C 61.304 0.3 1 1177 222 TYR CB C 38.300 0.3 1 1178 222 TYR CD1 C 133.041 0.3 1 1179 222 TYR CE1 C 118.176 0.3 1 1180 222 TYR H H 8.865 0.020 1 1181 222 TYR HA H 3.761 0.020 1 1182 222 TYR HB2 H 2.761 0.020 2 1183 222 TYR HB3 H 2.334 0.020 2 1184 222 TYR HD1 H 6.869 0.020 1 1185 222 TYR HD2 H 6.869 0.020 1 1186 222 TYR HE1 H 6.767 0.020 1 1187 222 TYR HE2 H 6.767 0.020 1 1188 222 TYR N N 122.456 0.3 1 1189 223 GLN C C 175.666 0.3 1 1190 223 GLN CA C 57.887 0.3 1 1191 223 GLN CB C 28.370 0.3 1 1192 223 GLN CG C 33.940 0.3 1 1193 223 GLN H H 8.134 0.020 1 1194 223 GLN HA H 3.993 0.020 1 1195 223 GLN HB2 H 2.132 0.020 1 1196 223 GLN HB3 H 2.132 0.020 1 1197 223 GLN HG2 H 2.537 0.020 2 1198 223 GLN HG3 H 2.466 0.020 2 1199 223 GLN HE21 H 7.520 0.020 1 1200 223 GLN HE22 H 6.921 0.020 1 1201 223 GLN N N 117.912 0.3 1 1202 223 GLN NE2 N 111.780 0.3 1 1203 224 ALA C C 176.392 0.3 1 1204 224 ALA CA C 53.974 0.3 1 1205 224 ALA CB C 18.329 0.3 1 1206 224 ALA H H 7.659 0.020 1 1207 224 ALA HA H 4.114 0.020 1 1208 224 ALA HB H 1.459 0.020 1 1209 224 ALA N N 121.464 0.3 1 1210 225 ALA C C 175.997 0.3 1 1211 225 ALA CA C 53.136 0.3 1 1212 225 ALA CB C 18.422 0.3 1 1213 225 ALA H H 7.643 0.020 1 1214 225 ALA HA H 4.171 0.020 1 1215 225 ALA HB H 1.366 0.020 1 1216 225 ALA N N 120.150 0.3 1 1217 226 GLN C C 173.820 0.3 1 1218 226 GLN CA C 55.968 0.3 1 1219 226 GLN CB C 28.605 0.3 1 1220 226 GLN CG C 33.444 0.3 1 1221 226 GLN H H 7.646 0.020 1 1222 226 GLN HA H 4.043 0.020 1 1223 226 GLN HB2 H 2.009 0.020 2 1224 226 GLN HB3 H 1.896 0.020 2 1225 226 GLN HG2 H 2.190 0.020 2 1226 226 GLN HG3 H 2.167 0.020 2 1227 226 GLN HE21 H 7.031 0.020 1 1228 226 GLN HE22 H 6.733 0.020 1 1229 226 GLN N N 116.758 0.3 1 1230 226 GLN NE2 N 112.999 0.3 1 1231 227 ARG C C 173.336 0.3 1 1232 227 ARG CA C 56.205 0.3 1 1233 227 ARG CB C 30.454 0.3 1 1234 227 ARG CG C 26.853 0.3 1 1235 227 ARG CD C 43.230 0.3 1 1236 227 ARG H H 7.734 0.020 1 1237 227 ARG HA H 4.178 0.020 1 1238 227 ARG HB2 H 1.625 0.020 2 1239 227 ARG HB3 H 1.644 0.020 2 1240 227 ARG HG2 H 1.460 0.020 2 1241 227 ARG HG3 H 1.422 0.020 2 1242 227 ARG HD2 H 3.106 0.020 2 1243 227 ARG HD3 H 3.093 0.020 2 1244 227 ARG HE H 7.116 0.020 1 1245 227 ARG N N 119.759 0.3 1 1246 227 ARG NE N 84.699 0.3 1 1247 228 TYR C C 172.918 0.3 1 1248 228 TYR CA C 57.778 0.3 1 1249 228 TYR CB C 38.709 0.3 1 1250 228 TYR CD1 C 133.103 0.3 1 1251 228 TYR CE1 C 118.072 0.3 1 1252 228 TYR H H 7.902 0.020 1 1253 228 TYR HA H 4.488 0.020 1 1254 228 TYR HB2 H 2.957 0.020 2 1255 228 TYR HB3 H 2.798 0.020 2 1256 228 TYR HD1 H 7.002 0.020 1 1257 228 TYR HD2 H 7.002 0.020 1 1258 228 TYR HE1 H 6.774 0.020 1 1259 228 TYR HE2 H 6.774 0.020 1 1260 228 TYR N N 119.857 0.3 1 1261 229 TYR C C 172.174 0.3 1 1262 229 TYR CA C 57.472 0.3 1 1263 229 TYR CB C 38.804 0.3 1 1264 229 TYR CD1 C 133.299 0.3 1 1265 229 TYR CE1 C 118.080 0.3 1 1266 229 TYR H H 7.995 0.020 1 1267 229 TYR HA H 4.580 0.020 1 1268 229 TYR HB2 H 3.119 0.020 2 1269 229 TYR HB3 H 2.863 0.020 2 1270 229 TYR HD1 H 7.105 0.020 1 1271 229 TYR HD2 H 7.105 0.020 1 1272 229 TYR HE1 H 6.804 0.020 1 1273 229 TYR HE2 H 6.804 0.020 1 1274 229 TYR N N 120.660 0.3 1 1275 230 ASN C C 176.652 0.3 1 1276 230 ASN CA C 54.431 0.3 1 1277 230 ASN CB C 40.317 0.3 1 1278 230 ASN H H 7.910 0.020 1 1279 230 ASN HA H 4.475 0.020 1 1280 230 ASN HB2 H 2.767 0.020 2 1281 230 ASN HB3 H 2.672 0.020 2 1282 230 ASN HD21 H 7.518 0.020 1 1283 230 ASN HD22 H 6.832 0.020 1 1284 230 ASN N N 124.529 0.3 1 1285 230 ASN ND2 N 112.570 0.3 1 stop_
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