NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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543754 |
2yka   |
17693 | cing | 1-original | 4 | XEASY | chemical shift |
1 174.403 0.000 C 42 2 16.999 0.023 CE 43 3 176.441 0.000 C 43 4 8.680 0.001 H 43 5 2.124 0.006 HE 43 6 122.790 0.010 N 43 7 61.825 0.091 CA 44 8 69.816 0.089 CB 44 9 21.630 0.058 CG2 44 10 175.096 0.000 C 44 11 8.244 0.003 H 44 12 4.417 0.001 HA 44 13 4.299 0.009 HB 44 14 1.234 0.002 HG2 44 15 114.602 0.008 N 44 16 8.464 0.001 H 45 17 4.033 0.000 HA2 45 18 111.228 0.017 N 45 19 174.291 0.000 C 46 20 4.002 0.000 HA2 46 21 56.109 0.037 CA 47 22 29.396 0.038 CB 47 23 33.622 0.094 CG 47 24 176.052 0.000 C 47 25 8.330 0.002 H 47 26 4.354 0.013 HA 47 27 2.019 0.002 HB2 47 28 2.125 0.011 HB3 47 29 6.879 0.007 HE21 47 30 7.546 0.000 HE22 47 31 2.378 0.005 HG2 47 32 119.737 0.033 N 47 33 112.231 0.002 NE2 47 34 175.968 0.000 C 48 35 8.510 0.002 H 48 36 4.342 0.001 HA 48 37 6.877 0.000 HE21 48 38 7.518 0.000 HE22 48 39 2.395 0.000 HG2 48 40 121.344 0.000 N 48 41 112.319 0.040 NE2 48 42 55.724 0.088 CA 49 43 176.653 0.000 C 49 44 8.434 0.003 H 49 45 4.490 0.004 HA 49 46 2.041 0.003 HB2 49 47 2.117 0.004 HB3 49 48 121.487 0.008 N 49 49 173.770 0.000 C 50 50 8.440 0.001 H 50 51 3.984 0.000 HA2 50 1469 3.985 0.000 HA3 50 52 109.906 0.003 N 50 53 55.714 0.000 CA 51 54 31.244 0.016 CB 51 55 27.247 0.013 CG 51 56 175.670 0.000 C 51 57 8.134 0.004 H 51 58 4.388 0.006 HA 51 59 1.838 0.007 HB2 51 60 1.746 0.004 HB3 51 61 3.145 0.000 HD2 51 1470 3.125 0.000 HD3 51 62 1.605 0.012 HG2 51 1471 1.599 0.000 HG3 51 63 120.024 0.019 N 51 64 52.392 0.111 CA 52 65 41.155 0.021 CB 52 66 8.458 0.002 H 52 67 4.888 0.007 HA 52 68 2.795 0.007 HB2 52 69 2.594 0.010 HB3 52 70 123.010 0.017 N 52 71 63.810 0.022 CA 53 72 32.189 0.065 CB 53 73 50.845 0.061 CD 53 74 27.333 0.114 CG 53 75 177.094 0.000 C 53 76 4.279 0.003 HA 53 77 2.254 0.006 HB2 53 78 1.953 0.012 HB3 53 79 3.827 0.020 HD2 53 80 3.885 0.018 HD3 53 81 2.002 0.013 HG2 53 1472 1.982 0.000 HG3 53 82 55.065 0.000 CA 54 83 41.130 0.024 CB 54 84 176.744 0.000 C 54 85 8.361 0.002 H 54 86 4.596 0.002 HA 54 87 2.652 0.008 HB2 54 1473 2.649 0.000 HB3 54 88 118.764 0.022 N 54 89 56.645 0.090 CA 55 90 32.863 0.032 CB 55 91 28.981 0.009 CD 55 92 42.277 0.147 CE 55 93 24.558 0.073 CG 55 94 176.502 0.000 C 55 95 7.906 0.004 H 55 96 4.228 0.005 HA 55 97 1.746 0.013 HB2 55 98 1.713 0.011 HB3 55 99 1.618 0.003 HD2 55 100 1.679 0.001 HD3 55 101 2.964 0.012 HE2 55 1474 2.954 0.000 HE3 55 102 1.277 0.014 HG2 55 103 1.254 0.001 HG3 55 104 120.220 0.032 N 55 105 57.323 0.045 CA 56 106 29.204 0.100 CB 56 107 126.938 0.000 CD1 56 108 121.535 0.013 CE3 56 109 124.659 0.085 CH2 56 110 176.279 0.000 C 56 111 114.980 0.032 CZ2 56 112 120.735 0.000 CZ3 56 113 7.949 0.004 H 56 114 4.672 0.006 HA 56 115 3.280 0.011 HB2 56 116 3.298 0.002 HB3 56 117 7.283 0.001 HD1 56 118 10.171 0.002 HE1 56 119 7.614 0.003 HE3 56 120 7.225 0.005 HH2 56 121 7.488 0.005 HZ2 56 122 7.137 0.007 HZ3 56 123 120.338 0.061 N 56 124 129.329 0.017 NE1 56 125 56.343 0.035 CA 57 126 28.931 0.050 CB 57 127 175.783 0.000 C 57 128 8.020 0.007 H 57 129 4.165 0.007 HA 57 130 1.842 0.007 HB2 57 131 1.968 0.008 HB3 57 132 6.818 0.000 HE21 57 133 7.437 0.001 HE22 57 134 2.111 0.007 HG2 57 1475 2.108 0.000 HG3 57 135 120.811 0.011 N 57 136 112.051 0.005 NE2 57 137 56.254 0.101 CA 58 138 174.485 0.000 C 58 139 8.209 0.002 H 58 140 4.559 0.005 HA 58 141 3.153 0.008 HB2 58 142 3.204 0.012 HB3 58 143 119.007 0.006 N 58 144 54.868 0.078 CA 59 145 41.224 0.076 CB 59 146 176.167 0.000 C 59 147 8.414 0.003 H 59 148 4.574 0.005 HA 59 149 2.667 0.008 HB2 59 1476 2.661 0.000 HB3 59 150 120.625 0.027 N 59 151 55.705 0.065 CA 60 152 42.266 0.020 CB 60 153 24.832 0.027 CD1 60 154 26.681 0.058 CG 60 155 177.236 0.000 C 60 156 8.069 0.004 H 60 157 4.236 0.007 HA 60 158 1.500 0.009 HB2 60 159 1.404 0.005 HB3 60 160 0.846 0.013 HD1 60 161 0.824 0.000 HD2 60 162 1.507 0.013 HG 60 163 121.498 0.013 N 60 164 57.817 0.034 CA 61 165 39.285 0.057 CB 61 166 132.060 0.000 CD1 61 167 131.521 0.000 CE1 61 168 175.525 0.000 C 61 169 8.123 0.004 H 61 170 4.617 0.004 HA 61 171 3.194 0.006 HB2 61 172 3.026 0.003 HB3 61 173 7.263 0.011 HD1 61 1455 7.275 0.000 HD2 61 174 7.346 0.013 HE1 61 1456 7.350 0.000 HE2 61 175 119.494 0.010 N 61 176 54.243 0.001 CA 62 177 41.562 0.082 CB 62 178 176.276 0.000 C 62 179 8.204 0.003 H 62 180 4.662 0.004 HA 62 181 2.678 0.018 HB2 62 182 2.743 0.006 HB3 62 183 121.761 0.020 N 62 184 58.977 0.021 CA 63 185 63.820 0.040 CB 63 186 175.365 0.000 C 63 187 8.338 0.005 H 63 188 4.409 0.002 HA 63 189 4.014 0.005 HB2 63 190 3.927 0.009 HB3 63 191 116.880 0.010 N 63 192 45.576 0.057 CA 64 193 174.442 0.000 C 64 194 8.546 0.006 H 64 195 4.019 0.012 HA2 64 1457 4.037 0.000 HA3 64 196 110.607 0.015 N 64 197 58.607 0.055 CA 65 198 28.131 0.070 CB 65 199 175.151 0.000 C 65 200 8.215 0.003 H 65 201 4.585 0.008 HA 65 202 2.977 0.003 HB2 65 1458 2.978 0.000 HB3 65 203 118.164 0.007 N 65 204 174.648 0.000 C 66 205 8.581 0.001 H 66 206 4.017 0.000 HA2 66 1459 4.017 0.000 HA3 66 207 111.111 0.023 N 66 208 45.308 0.010 CA 67 209 174.695 0.000 C 67 210 8.359 0.002 H 67 211 4.018 0.008 HA2 67 1460 4.018 0.000 HA3 67 212 108.858 0.007 N 67 213 174.248 0.000 C 68 214 8.347 0.006 H 68 215 4.011 0.000 HA2 68 1461 4.003 0.000 HA3 68 216 108.684 0.102 N 68 217 56.828 0.058 CA 69 218 30.128 0.009 CB 69 219 36.174 0.065 CG 69 220 177.102 0.000 C 69 221 8.488 0.002 H 69 222 4.336 0.002 HA 69 223 1.997 0.003 HB2 69 224 2.122 0.013 HB3 69 225 2.311 0.008 HG2 69 1477 2.312 0.000 HG3 69 226 120.451 0.011 N 69 227 173.979 0.000 C 70 228 8.523 0.002 H 70 229 4.003 0.000 HA2 70 1462 4.003 0.000 HA3 70 230 109.875 0.022 N 70 231 61.921 0.074 CA 71 232 32.987 0.047 CB 71 233 20.530 0.099 CG1 71 234 21.239 0.042 CG2 71 235 175.965 0.000 C 71 236 7.895 0.003 H 71 237 4.201 0.004 HA 71 238 2.110 0.003 HB 71 239 0.931 0.005 HG1 71 240 0.947 0.002 HG2 71 241 118.622 0.009 N 71 242 56.416 0.068 CA 72 243 30.194 0.086 CB 72 244 36.687 0.024 CG 72 245 176.505 0.000 C 72 246 8.578 0.003 H 72 247 4.490 0.007 HA 72 248 2.116 0.011 HB2 72 249 2.171 0.000 HB3 72 250 2.384 0.005 HG2 72 1463 2.381 0.000 HG3 72 251 124.954 0.017 N 72 252 61.711 0.061 CA 73 253 70.229 0.041 CB 73 254 21.453 0.040 CG2 73 255 175.571 0.000 C 73 256 8.298 0.003 H 73 257 4.521 0.008 HA 73 258 4.440 0.006 HB 73 259 1.287 0.002 HG2 73 260 115.551 0.008 N 73 261 45.648 0.001 CA 74 262 173.189 0.000 C 74 263 8.888 0.003 H 74 264 3.864 0.015 HA2 74 265 4.231 0.005 HA3 74 266 112.166 0.007 N 74 267 51.826 0.032 CA 75 268 22.839 0.053 CB 75 269 174.301 0.000 C 75 270 8.092 0.008 H 75 271 4.607 0.007 HA 75 272 1.263 0.011 HB 75 273 118.510 0.009 N 75 274 55.435 0.100 CA 76 275 34.800 0.026 CB 76 276 29.616 0.054 CD 76 277 41.726 0.000 CE 76 278 24.540 0.044 CG 76 279 174.201 0.000 C 76 280 8.617 0.006 H 76 281 4.980 0.007 HA 76 282 1.368 0.007 HB2 76 283 1.542 0.008 HB3 76 284 1.378 0.009 HD2 76 1464 1.374 0.000 HD3 76 285 2.667 0.005 HE2 76 1465 2.666 0.000 HE3 76 286 0.962 0.018 HG2 76 287 0.616 0.003 HG3 76 288 121.580 0.016 N 76 289 52.561 0.054 CA 77 290 43.883 0.000 CB 77 291 22.971 0.000 CD1 77 292 26.085 0.049 CD2 77 293 176.013 0.000 C 77 294 9.381 0.008 H 77 295 5.325 0.008 HA 77 296 1.728 0.017 HB2 77 297 1.103 0.009 HB3 77 298 0.788 0.004 HD1 77 299 0.818 0.006 HD2 77 1394 0.885 0.000 HG 77 300 120.966 0.024 N 77 301 53.917 0.049 CA 78 302 43.329 0.053 CB 78 1392 24.148 0.000 CD1 78 303 24.369 0.079 CD2 78 304 27.682 0.000 CG 78 305 176.523 0.000 C 78 306 9.102 0.004 H 78 307 5.072 0.006 HA 78 308 1.460 0.003 HB2 78 309 1.668 0.016 HB3 78 310 0.851 0.009 HD1 78 311 0.891 0.006 HD2 78 312 1.468 0.006 HG 78 313 124.094 0.012 N 78 314 60.772 0.023 CA 79 315 33.581 0.000 CB 79 316 21.463 0.072 CG1 79 317 22.486 0.017 CG2 79 318 174.830 0.000 C 79 319 9.123 0.011 H 79 320 5.050 0.010 HA 79 321 1.973 0.004 HB 79 322 0.867 0.011 HG1 79 323 1.216 0.009 HG2 79 324 130.557 0.021 N 79 325 57.407 0.061 CA 80 326 66.129 0.000 CB 80 327 172.832 0.000 C 80 328 9.367 0.005 H 80 329 5.346 0.003 HA 80 330 3.787 0.017 HB2 80 331 3.963 0.008 HB3 80 332 120.328 0.010 N 80 333 53.499 0.000 CA 81 334 38.053 0.018 CB 81 335 175.543 0.000 C 81 336 8.554 0.006 H 81 337 4.493 0.010 HA 81 338 2.828 0.006 HB2 81 339 3.658 0.006 HB3 81 340 7.902 0.002 HD21 81 341 7.129 0.006 HD22 81 342 116.325 0.014 N 81 343 110.857 0.019 ND2 81 344 53.984 0.008 CA 82 345 43.659 0.100 CB 82 346 25.778 0.012 CD1 82 347 23.364 0.024 CD2 82 348 26.655 0.010 CG 82 349 8.251 0.008 H 82 350 4.226 0.007 HA 82 351 1.095 0.008 HB2 82 352 1.204 0.011 HB3 82 353 0.441 0.014 HD1 82 354 0.909 0.007 HD2 82 355 1.325 0.015 HG 82 356 116.837 0.020 N 82 357 54.905 0.111 CA 83 358 43.017 0.067 CB 83 359 177.477 0.000 C 83 360 8.214 0.004 H 83 361 4.246 0.004 HA 83 362 2.567 0.008 HB2 83 363 2.772 0.006 HB3 83 364 120.050 0.000 N 83 365 59.605 0.062 CA 84 366 38.196 0.054 CB 84 367 131.252 0.000 CD1 84 368 175.569 0.000 C 84 369 129.913 0.000 CZ 84 370 8.185 0.006 H 84 371 4.315 0.008 HA 84 372 3.044 0.007 HB2 84 373 3.399 0.017 HB3 84 374 7.257 0.006 HD1 84 1478 7.258 0.000 HD2 84 375 7.326 0.000 HE1 84 1466 7.292 0.000 HE2 84 376 7.361 0.006 HZ 84 377 123.195 0.026 N 84 378 44.846 0.013 CA 85 379 174.475 0.000 C 85 380 8.857 0.008 H 85 381 3.671 0.006 HA2 85 382 4.186 0.004 HA3 85 383 107.369 0.011 N 85 384 63.586 0.097 CA 86 385 30.783 0.097 CB 86 386 21.939 0.040 CG1 86 387 20.708 0.013 CG2 86 388 175.779 0.000 C 86 389 6.994 0.005 H 86 390 3.512 0.009 HA 86 391 1.575 0.011 HB 86 392 0.046 0.005 HG1 86 393 -0.044 0.006 HG2 86 394 122.376 0.031 N 86 395 56.585 0.084 CA 87 396 67.818 0.045 CB 87 397 175.184 0.000 C 87 398 9.490 0.007 H 87 399 4.931 0.007 HA 87 400 3.979 0.006 HB2 87 401 4.384 0.007 HB3 87 402 126.189 0.019 N 87 403 58.243 0.008 CA 88 404 40.068 0.000 CB 88 405 177.747 0.000 C 88 406 8.714 0.005 H 88 407 4.127 0.004 HA 88 408 2.806 0.014 HB2 88 409 2.985 0.008 HB3 88 410 120.694 0.019 N 88 411 55.087 0.055 CA 89 412 18.298 0.091 CB 89 413 180.447 0.000 C 89 414 8.158 0.007 H 89 415 4.115 0.006 HA 89 416 1.467 0.007 HB 89 417 119.502 0.013 N 89 418 57.684 0.000 CA 90 419 41.985 0.070 CB 90 420 177.080 0.000 C 90 421 7.473 0.007 H 90 422 4.719 0.018 HA 90 423 2.963 0.018 HB2 90 1467 2.969 0.000 HB3 90 424 118.999 0.028 N 90 425 61.888 0.084 CA 91 426 36.199 0.000 CB 91 427 10.451 0.033 CD1 91 428 26.660 0.017 CG1 91 429 18.920 0.059 CG2 91 430 178.431 0.000 C 91 431 7.384 0.008 H 91 432 4.047 0.004 HA 91 433 2.135 0.009 HB 91 434 0.590 0.008 HD1 91 435 1.050 0.006 HG12 91 436 1.499 0.006 HG13 91 437 0.843 0.008 HG2 91 438 116.778 0.014 N 91 439 59.738 0.033 CA 92 440 27.884 0.049 CB 92 441 34.143 0.005 CG 92 442 177.073 0.000 C 92 443 8.508 0.007 H 92 444 3.747 0.007 HA 92 445 2.247 0.011 HB2 92 446 2.198 0.011 HB3 92 447 6.869 0.007 HE21 92 448 7.501 0.005 HE22 92 449 2.473 0.022 HG2 92 1468 2.470 0.002 HG3 92 450 120.321 0.007 N 92 451 109.995 0.019 NE2 92 452 58.988 0.064 CA 93 453 29.190 0.056 CB 93 454 36.482 0.038 CG 93 455 178.992 0.000 C 93 456 8.114 0.006 H 93 457 4.020 0.009 HA 93 458 2.224 0.013 HB2 93 459 2.379 0.018 HB3 93 460 2.287 0.005 HG2 93 461 2.462 0.009 HG3 93 462 117.266 0.031 N 93 463 57.563 0.032 CA 94 464 43.233 0.115 CB 94 465 23.502 0.083 CD1 94 466 25.912 0.052 CD2 94 467 26.649 0.000 CG 94 468 178.857 0.000 C 94 469 7.887 0.008 H 94 470 4.094 0.005 HA 94 471 1.731 0.007 HB2 94 1454 1.507 0.004 HB3 94 472 0.364 0.011 HD1 94 473 -0.051 0.007 HD2 94 474 0.615 0.009 HG 94 475 117.388 0.008 N 94 476 62.096 0.043 CA 95 477 39.689 0.030 CB 95 478 132.728 0.076 CD1 95 1446 132.688 0.000 CD2 95 479 130.672 0.106 CE1 95 1447 130.664 0.000 CE2 95 480 177.044 0.000 C 95 481 129.692 0.000 CZ 95 482 8.219 0.003 H 95 483 4.876 0.008 HA 95 484 2.921 0.011 HB2 95 485 3.488 0.011 HB3 95 486 7.807 0.012 HD1 95 1448 7.807 0.000 HD2 95 487 7.232 0.013 HE1 95 1449 7.237 0.000 HE2 95 488 7.225 0.006 HZ 95 489 112.254 0.016 N 95 490 54.940 0.042 CA 96 491 18.050 0.023 CB 96 492 179.037 0.000 C 96 493 8.677 0.005 H 96 494 4.541 0.010 HA 96 495 1.619 0.003 HB 96 496 121.699 0.021 N 96 497 57.867 0.048 CA 97 498 29.695 0.000 CB 97 499 35.236 0.030 CG 97 500 177.053 0.000 C 97 501 7.311 0.004 H 97 502 4.058 0.005 HA 97 503 1.738 0.004 HB2 97 504 1.936 0.013 HB3 97 505 1.573 0.007 HG2 97 506 1.837 0.012 HG3 97 507 113.840 0.023 N 97 508 59.981 0.075 CA 98 509 40.102 0.021 CB 98 510 131.879 0.000 CD1 98 1450 131.879 0.000 CD2 98 511 131.832 0.081 CE1 98 1451 131.879 0.000 CE2 98 512 174.798 0.000 C 98 513 129.666 0.027 CZ 98 514 7.863 0.004 H 98 515 4.337 0.005 HA 98 516 3.254 0.008 HB2 98 517 3.441 0.007 HB3 98 518 7.631 0.011 HD1 98 1452 7.631 0.000 HD2 98 519 7.449 0.009 HE1 98 1453 7.441 0.004 HE2 98 520 7.061 0.013 HZ 98 521 115.655 0.015 N 98 522 44.834 0.052 CA 99 523 184.935 0.000 C 99 524 7.535 0.011 H 99 525 3.944 0.008 HA2 99 526 4.894 0.004 HA3 99 527 105.065 0.019 N 99 528 64.366 0.041 CA 100 529 69.397 0.016 CB 100 530 22.616 0.021 CG2 100 531 175.067 0.000 C 100 532 8.227 0.009 H 100 533 4.119 0.013 HA 100 534 4.074 0.005 HB 100 535 1.243 0.008 HG2 100 536 112.834 0.013 N 100 537 53.649 0.001 CA 101 538 43.115 0.086 CB 101 539 23.196 0.054 CD1 101 540 26.100 0.037 CD2 101 541 26.395 0.000 CG 101 542 177.275 0.000 C 101 543 8.960 0.010 H 101 544 4.573 0.011 HA 101 545 1.742 0.016 HB2 101 546 1.024 0.004 HB3 101 547 -0.074 0.005 HD1 101 548 0.788 0.010 HD2 101 549 1.691 0.015 HG 101 550 127.972 0.013 N 101 551 56.521 0.000 CA 102 552 33.148 0.057 CB 102 553 28.177 0.097 CD 102 554 41.479 0.032 CE 102 555 24.541 0.004 CG 102 556 176.342 0.000 C 102 557 8.907 0.006 H 102 558 4.316 0.005 HA 102 559 1.712 0.012 HB2 102 560 1.287 0.006 HB3 102 561 1.463 0.007 HD2 102 1442 1.456 0.000 HD3 102 562 2.883 0.003 HE2 102 563 2.947 0.028 HE3 102 564 1.263 0.006 HG2 102 1443 1.263 0.000 HG3 102 565 121.827 0.025 N 102 566 56.568 0.000 CA 103 567 35.491 0.041 CB 103 568 28.967 0.086 CD 103 569 42.261 0.014 CE 103 570 24.895 0.036 CG 103 571 173.940 0.000 C 103 572 7.454 0.008 H 103 573 4.264 0.009 HA 103 574 1.758 0.011 HB2 103 575 1.297 0.006 HB3 103 576 1.447 0.014 HD2 103 577 1.304 0.003 HD3 103 578 2.832 0.019 HE2 103 579 2.884 0.005 HE3 103 580 1.154 0.005 HG2 103 581 1.318 0.005 HG3 103 582 117.334 0.015 N 103 583 52.128 0.038 CA 104 584 20.154 0.067 CB 104 585 173.714 0.000 C 104 586 8.744 0.005 H 104 587 4.952 0.013 HA 104 588 1.311 0.008 HB 104 589 128.613 0.016 N 104 590 51.245 0.021 CA 105 591 22.558 0.061 CB 105 592 176.257 0.000 C 105 593 8.253 0.006 H 105 594 4.833 0.014 HA 105 595 1.390 0.012 HB 105 596 123.917 0.014 N 105 597 62.462 0.075 CA 106 598 33.140 0.014 CB 106 599 22.872 0.017 CG1 106 600 20.465 0.021 CG2 106 601 175.000 0.000 C 106 602 9.161 0.003 H 106 603 3.983 0.006 HA 106 604 1.921 0.008 HB 106 605 0.682 0.005 HG1 106 606 0.465 0.013 HG2 106 607 127.396 0.028 N 106 608 54.196 0.021 CA 107 609 41.733 0.019 CB 107 610 173.206 0.000 C 107 611 8.423 0.006 H 107 612 4.734 0.016 HA 107 613 2.480 0.014 HB2 107 614 2.442 0.010 HB3 107 615 125.184 0.011 N 107 616 57.114 0.071 CA 108 617 42.261 0.011 CB 108 618 132.767 0.120 CD1 108 1444 132.864 0.000 CD2 108 619 117.928 0.042 CE1 108 620 117.875 0.022 CE2 108 621 176.749 0.000 C 108 622 8.432 0.012 H 108 623 5.075 0.011 HA 108 624 2.799 0.010 HB2 108 625 2.840 0.021 HB3 108 626 6.930 0.006 HD1 108 1445 6.940 0.000 HD2 108 627 6.930 0.007 HE1 108 628 6.923 0.006 HE2 108 629 120.347 0.016 N 108 630 52.370 0.084 CA 109 631 41.144 0.111 CB 109 632 178.363 0.000 C 109 633 9.048 0.007 H 109 634 4.762 0.010 HA 109 635 2.758 0.026 HB2 109 636 3.457 0.007 HB3 109 637 121.175 0.016 N 109 638 58.519 0.042 CA 110 639 29.540 0.000 CB 110 640 43.361 0.031 CD 110 641 27.376 0.097 CG 110 642 177.329 0.000 C 110 643 8.510 0.006 H 110 644 4.194 0.005 HA 110 645 1.964 0.002 HB2 110 646 1.978 0.010 HB3 110 647 3.271 0.003 HD2 110 1437 3.285 0.000 HD3 110 648 1.784 0.010 HG2 110 1438 1.784 0.000 HG3 110 649 117.739 0.034 N 110 650 58.475 0.031 CA 111 651 64.097 0.018 CB 111 652 174.500 0.000 C 111 653 8.445 0.001 H 111 654 4.622 0.004 HA 111 655 4.009 0.004 HB2 111 1439 4.009 0.000 HB3 111 656 115.526 0.013 N 111 657 45.434 0.003 CA 112 658 173.643 0.000 C 112 659 8.254 0.006 H 112 660 3.618 0.013 HA2 112 661 4.223 0.008 HA3 112 662 109.787 0.020 N 112 663 55.308 0.009 CA 113 664 30.550 0.056 CB 113 665 43.345 0.001 CD 113 666 27.497 0.005 CG 113 667 176.262 0.000 C 113 668 8.291 0.004 H 113 669 4.515 0.011 HA 113 670 1.848 0.008 HB2 113 671 1.873 0.012 HB3 113 672 3.155 0.011 HD2 113 1440 3.159 0.000 HD3 113 673 7.347 0.001 HE 113 674 1.629 0.003 HG2 113 1441 1.629 0.000 HG3 113 675 122.140 0.019 N 113 676 85.400 0.010 NE 113 677 58.221 0.039 CA 114 678 64.001 0.049 CB 114 679 175.943 0.000 C 114 680 8.809 0.004 H 114 681 4.097 0.016 HA 114 682 3.884 0.009 HB2 114 683 4.062 0.006 HB3 114 684 118.398 0.029 N 114 685 54.988 0.067 CA 115 686 42.279 0.044 CB 115 687 25.555 0.109 CD1 115 688 23.386 0.041 CD2 115 689 27.519 0.000 CG 115 690 178.888 0.000 C 115 691 8.722 0.008 H 115 692 4.454 0.008 HA 115 693 1.653 0.025 HB2 115 694 1.559 0.013 HB3 115 695 0.741 0.014 HD1 115 696 0.964 0.006 HD2 115 697 1.527 0.007 HG 115 698 125.225 0.029 N 115 699 46.016 0.000 CA 116 700 172.086 0.000 C 116 701 9.657 0.004 H 116 702 3.416 0.016 HA2 116 703 4.051 0.005 HA3 116 704 109.777 0.014 N 116 705 58.361 0.013 CA 117 706 72.478 0.137 CB 117 707 21.266 0.020 CG2 117 708 172.503 0.000 C 117 709 7.054 0.004 H 117 710 5.376 0.015 HA 117 711 4.361 0.006 HB 117 712 1.112 0.005 HG2 117 713 106.376 0.027 N 117 714 50.884 0.017 CA 118 715 23.441 0.042 CB 118 716 174.444 0.000 C 118 717 9.174 0.007 H 118 718 4.852 0.020 HA 118 719 0.950 0.015 HB 118 720 119.536 0.045 N 118 721 52.820 0.045 CA 119 722 43.288 0.038 CB 119 723 175.109 0.000 C 119 724 8.366 0.007 H 119 725 5.173 0.009 HA 119 726 2.619 0.016 HB2 119 727 2.655 0.011 HB3 119 728 121.260 0.030 N 119 729 61.081 0.000 CA 120 730 33.858 0.021 CB 120 731 21.062 0.052 CG1 120 732 22.676 0.065 CG2 120 733 173.939 0.000 C 120 734 8.387 0.007 H 120 735 4.425 0.006 HA 120 736 1.682 0.004 HB 120 737 0.378 0.012 HG1 120 738 0.341 0.008 HG2 120 739 122.980 0.028 N 120 740 53.326 0.019 CA 121 741 33.608 0.000 CB 121 742 116.893 0.131 CD2 121 743 174.910 0.000 C 121 744 9.271 0.011 H 121 745 5.501 0.006 HA 121 746 3.197 0.009 HB2 121 747 2.957 0.013 HB3 121 748 6.933 0.014 HD2 121 749 127.248 0.019 N 121 750 58.238 0.039 CA 122 751 41.253 0.051 CB 122 752 129.903 0.000 CD1 122 753 175.563 0.000 C 122 1395 129.365 0.000 CZ 122 754 9.310 0.011 H 122 755 4.853 0.015 HA 122 756 2.733 0.014 HB2 122 757 3.736 0.010 HB3 122 758 7.285 0.012 HD1 122 1433 7.268 0.002 HD2 122 759 7.151 0.012 HE1 122 1434 7.179 0.000 HE2 122 1396 7.463 0.011 HZ 122 760 125.565 0.023 N 122 761 59.385 0.042 CA 123 762 30.390 0.057 CB 123 763 36.904 0.030 CG 123 764 176.391 0.000 C 123 765 8.211 0.004 H 123 766 4.091 0.007 HA 123 767 1.981 0.008 HB2 123 768 2.241 0.010 HB3 123 769 2.183 0.006 HG2 123 770 2.278 0.004 HG3 123 771 120.966 0.019 N 123 772 54.191 0.021 CA 124 773 31.723 0.000 CB 124 774 43.610 0.010 CD 124 775 27.098 0.019 CG 124 776 176.856 0.000 C 124 777 9.397 0.008 H 124 778 4.881 0.017 HA 124 779 1.971 0.011 HB2 124 1435 1.971 0.000 HB3 124 780 3.349 0.016 HD2 124 781 3.406 0.006 HD3 124 782 7.646 0.002 HE 124 783 1.673 0.003 HG2 124 784 1.845 0.006 HG3 124 1393 6.931 0.002 HH11 124 785 115.287 0.008 N 124 786 84.704 0.029 NE 124 787 59.798 0.092 CA 125 788 29.684 0.000 CB 125 789 42.317 0.073 CD 125 790 27.954 0.000 CG 125 791 177.253 0.000 C 125 792 9.358 0.004 H 125 793 3.719 0.004 HA 125 794 1.828 0.006 HB2 125 1436 1.833 0.000 HB3 125 795 3.228 0.012 HD2 125 1391 3.147 0.000 HD3 125 796 7.409 0.017 HE 125 797 1.488 0.014 HG2 125 798 1.788 0.013 HG3 125 799 127.396 0.017 N 125 800 84.448 0.007 NE 125 801 55.260 0.055 CA 126 802 18.508 0.062 CB 126 803 179.946 0.000 C 126 804 9.168 0.005 H 126 805 3.959 0.008 HA 126 806 1.433 0.006 HB 126 807 118.374 0.021 N 126 808 56.772 0.000 CA 127 809 41.684 0.000 CB 127 810 176.273 0.000 C 127 811 6.767 0.009 H 127 812 4.355 0.014 HA 127 813 2.656 0.010 HB2 127 814 2.896 0.007 HB3 127 815 117.864 0.022 N 127 816 54.054 0.022 CA 128 817 18.774 0.037 CB 128 818 179.084 0.000 C 128 819 6.692 0.006 H 128 820 2.833 0.008 HA 128 821 1.167 0.008 HB 128 822 121.331 0.023 N 128 823 58.024 0.067 CA 129 824 41.181 0.068 CB 129 825 23.368 0.040 CD1 129 826 24.967 0.034 CD2 129 827 179.605 0.000 C 129 828 7.900 0.005 H 129 829 3.830 0.010 HA 129 830 1.479 0.011 HB2 129 831 1.715 0.011 HB3 129 832 0.812 0.010 HD1 129 833 0.862 0.004 HD2 129 834 1.497 0.001 HG 129 835 115.741 0.011 N 129 836 59.668 0.022 CA 130 837 32.687 0.038 CB 130 838 42.307 0.042 CE 130 839 25.486 0.030 CG 130 840 178.385 0.000 C 130 841 7.329 0.006 H 130 842 3.881 0.004 HA 130 843 2.023 0.018 HB2 130 1431 2.015 0.000 HB3 130 844 1.910 0.012 HD2 130 1432 1.894 0.000 HD3 130 845 3.112 0.005 HE2 130 1424 3.123 0.000 HE3 130 846 1.718 0.007 HG2 130 847 1.538 0.009 HG3 130 848 119.702 0.015 N 130 849 54.716 0.123 CA 131 850 19.420 0.057 CB 131 851 178.686 0.000 C 131 852 7.454 0.005 H 131 853 2.562 0.007 HA 131 854 1.200 0.007 HB 131 855 122.302 0.020 N 131 856 59.571 0.066 CA 132 857 33.335 0.142 CB 132 858 17.117 0.057 CE 132 859 31.568 0.028 CG 132 860 176.973 0.000 C 132 861 8.111 0.006 H 132 862 3.865 0.009 HA 132 863 2.250 0.009 HB2 132 864 1.943 0.015 HB3 132 865 2.097 0.006 HE 132 866 2.435 0.009 HG2 132 867 2.239 0.005 HG3 132 868 115.729 0.023 N 132 869 58.820 0.042 CA 133 870 32.221 0.092 CB 133 871 29.025 0.079 CD 133 872 24.938 0.058 CG 133 873 178.584 0.000 C 133 874 7.884 0.004 H 133 875 3.950 0.008 HA 133 876 1.867 0.014 HB2 133 1425 1.866 0.000 HB3 133 877 1.689 0.006 HD2 133 1426 1.675 0.000 HD3 133 878 2.964 0.009 HE2 133 1427 2.966 0.000 HE3 133 879 1.512 0.009 HG2 133 880 1.452 0.014 HG3 133 881 117.056 0.009 N 133 882 58.057 0.054 CA 134 883 28.216 0.006 CB 134 884 32.305 0.049 CG 134 885 177.555 0.000 C 134 886 7.441 0.004 H 134 887 3.979 0.008 HA 134 888 1.233 0.009 HB2 134 889 1.781 0.011 HB3 134 890 6.850 0.005 HE21 134 891 6.941 0.002 HE22 134 892 1.486 0.004 HG2 134 893 1.846 0.010 HG3 134 894 116.470 0.018 N 134 895 110.933 0.026 NE2 134 896 57.785 0.000 CA 135 897 40.395 0.047 CB 135 898 132.131 0.000 CD1 135 1428 132.131 0.000 CD2 135 899 118.242 0.048 CE1 135 900 118.186 0.000 CE2 135 901 175.744 0.000 C 135 902 7.206 0.010 H 135 903 5.059 0.009 HA 135 904 3.483 0.011 HB2 135 905 2.453 0.011 HB3 135 906 6.812 0.011 HD1 135 1429 6.811 0.000 HD2 135 907 6.664 0.016 HE1 135 908 6.660 0.013 HE2 135 909 111.017 0.010 N 135 910 60.350 0.028 CA 136 911 32.606 0.061 CB 136 912 25.489 0.024 CG 136 913 178.066 0.000 C 136 914 8.505 0.005 H 136 915 3.875 0.015 HA 136 916 2.015 0.011 HB2 136 1409 2.032 0.000 HB3 136 917 1.796 0.000 HD2 136 1410 1.796 0.000 HD3 136 1430 3.161 0.000 HE2 136 918 3.185 0.000 HE3 136 919 1.513 0.006 HG2 136 920 1.724 0.016 HG3 136 921 121.609 0.015 N 136 922 45.592 0.054 CA 137 923 174.022 0.000 C 137 924 9.244 0.005 H 137 925 3.663 0.008 HA2 137 926 4.311 0.009 HA3 137 927 116.853 0.015 N 137 928 61.199 0.087 CA 138 929 32.447 0.007 CB 138 930 23.578 0.050 CG1 138 931 21.319 0.021 CG2 138 932 7.932 0.006 H 138 933 4.074 0.008 HA 138 934 2.260 0.005 HB 138 935 1.141 0.007 HG1 138 936 0.993 0.018 HG2 138 937 122.924 0.037 N 138 938 31.918 0.123 CB 139 939 50.916 0.043 CD 139 940 27.398 0.028 CG 139 941 175.556 0.000 C 139 942 4.801 0.007 HA 139 943 1.827 0.011 HB2 139 944 2.017 0.006 HB3 139 945 3.658 0.007 HD2 139 946 4.209 0.010 HD3 139 947 2.033 0.011 HG2 139 948 2.256 0.005 HG3 139 949 53.704 0.110 CA 140 950 43.690 0.113 CB 140 951 24.951 0.059 CD1 140 952 25.452 0.155 CD2 140 953 177.116 0.000 C 140 954 7.590 0.004 H 140 955 4.504 0.004 HA 140 956 1.750 0.011 HB2 140 957 1.415 0.007 HB3 140 958 0.810 0.009 HD1 140 959 0.763 0.002 HD2 140 960 1.472 0.018 HG 140 961 122.598 0.024 N 140 962 55.545 0.000 CA 141 963 39.538 0.024 CB 141 964 175.979 0.000 C 141 965 9.496 0.008 H 141 966 4.332 0.011 HA 141 967 2.736 0.010 HB2 141 968 2.976 0.004 HB3 141 969 127.937 0.012 N 141 970 45.220 0.026 CA 142 971 173.955 0.000 C 142 972 8.522 0.005 H 142 973 3.653 0.005 HA2 142 974 4.218 0.008 HA3 142 975 102.533 0.030 N 142 976 53.163 0.024 CA 143 977 31.679 0.062 CB 143 978 42.899 0.026 CD 143 979 26.687 0.022 CG 143 980 7.700 0.007 H 143 981 4.955 0.007 HA 143 982 1.925 0.013 HB2 143 983 1.865 0.001 HB3 143 984 3.117 0.007 HD2 143 1411 3.116 0.000 HD3 143 985 6.916 0.002 HE 143 986 1.667 0.019 HG2 143 987 1.512 0.009 HG3 143 988 6.535 0.000 HH11 143 989 6.652 0.000 HH12 143 990 120.918 0.021 N 143 991 84.600 0.016 NE 143 992 61.901 0.095 CA 144 993 31.561 0.000 CB 144 994 51.178 0.053 CD 144 995 27.670 0.017 CG 144 996 176.507 0.000 C 144 997 4.345 0.007 HA 144 998 1.865 0.012 HB2 144 999 2.028 0.000 HB3 144 1000 3.706 0.016 HD2 144 1001 3.965 0.007 HD3 144 1002 2.203 0.006 HG2 144 1412 2.210 0.000 HG3 144 1003 57.193 0.083 CA 145 1004 33.856 0.058 CB 145 1005 16.689 0.080 CE 145 1006 31.810 0.000 CG 145 1007 175.592 0.000 C 145 1008 8.390 0.004 H 145 1009 4.424 0.011 HA 145 1010 2.339 0.011 HB2 145 1413 2.341 0.000 HB3 145 1011 1.998 0.008 HE 145 1012 2.509 0.017 HG2 145 1013 2.617 0.013 HG3 145 1014 127.846 0.011 N 145 1015 53.075 0.049 CA 146 1016 42.551 0.057 CB 146 1017 175.450 0.000 C 146 1018 8.221 0.006 H 146 1019 5.235 0.005 HA 146 1020 2.544 0.008 HB2 146 1021 2.792 0.018 HB3 146 1022 127.228 0.020 N 146 1023 61.033 0.117 CA 147 1024 43.209 0.000 CB 147 1025 14.792 0.021 CD1 147 1026 28.607 0.000 CG1 147 1027 20.324 0.025 CG2 147 1028 173.626 0.000 C 147 1029 7.725 0.004 H 147 1030 4.995 0.014 HA 147 1031 1.528 0.010 HB 147 1032 1.129 0.008 HD1 147 1033 1.318 0.011 HG12 147 1414 1.308 0.000 HG13 147 1034 0.901 0.008 HG2 147 1035 120.908 0.015 N 147 1036 53.767 0.000 CA 148 1037 32.980 0.068 CB 148 1038 33.539 0.025 CG 148 1039 173.848 0.000 C 148 1040 8.639 0.009 H 148 1041 4.762 0.010 HA 148 1042 1.842 0.007 HB2 148 1043 2.116 0.008 HB3 148 1044 6.790 0.004 HE21 148 1045 7.816 0.004 HE22 148 1046 2.324 0.007 HG2 148 1415 2.322 0.000 HG3 148 1047 124.222 0.014 N 148 1048 112.761 0.014 NE2 148 1049 55.013 0.004 CA 149 1050 43.242 0.058 CB 149 1051 24.653 0.000 CD1 149 1052 29.044 0.108 CG 149 1053 176.656 0.000 C 149 1054 8.657 0.004 H 149 1055 4.809 0.015 HA 149 1056 1.697 0.006 HB2 149 1057 1.416 0.001 HB3 149 1058 0.819 0.009 HD1 149 1416 0.811 0.000 HD2 149 1059 1.444 0.014 HG 149 1060 125.824 0.016 N 149 1061 62.138 0.034 CA 150 1062 33.145 0.000 CB 150 1063 21.411 0.041 CG1 150 1064 21.315 0.045 CG2 150 1065 175.136 0.000 C 150 1066 8.699 0.005 H 150 1067 4.145 0.009 HA 150 1068 1.966 0.005 HB 150 1069 0.916 0.013 HG1 150 1070 0.847 0.008 HG2 150 1071 126.799 0.015 N 150 1072 52.201 0.052 CA 151 1073 19.614 0.039 CB 151 1074 177.205 0.000 C 151 1075 8.532 0.003 H 151 1076 4.448 0.003 HA 151 1077 1.428 0.008 HB 151 1078 128.854 0.017 N 151 1079 58.355 0.076 CA 152 1080 64.076 0.045 CB 152 1081 174.348 0.000 C 152 1082 8.388 0.007 H 152 1083 4.445 0.004 HA 152 1084 3.872 0.006 HB2 152 1417 3.872 0.000 HB3 152 1085 115.662 0.050 N 152 1086 56.292 0.000 CA 153 1087 29.410 0.000 CB 153 1088 34.088 0.000 CG 153 1089 175.970 0.000 C 153 1090 8.542 0.007 H 153 1091 4.380 0.004 HA 153 1092 2.025 0.010 HB2 153 1093 2.125 0.014 HB3 153 1094 6.875 0.002 HE21 153 1095 7.617 0.012 HE22 153 1096 2.377 0.013 HG2 153 1418 2.377 0.000 HG3 153 1097 122.187 0.021 N 153 1098 112.336 0.049 NE2 153 1099 61.425 0.035 CA 154 1100 38.991 0.096 CB 154 1101 13.039 0.041 CD1 154 1102 27.553 0.057 CG1 154 1103 17.407 0.038 CG2 154 1104 175.707 0.000 C 154 1105 8.124 0.006 H 154 1106 4.139 0.007 HA 154 1107 1.838 0.002 HB 154 1108 0.851 0.007 HD1 154 1109 1.455 0.008 HG12 154 1110 1.173 0.013 HG13 154 1111 0.882 0.007 HG2 154 1112 121.071 0.022 N 154 1113 54.308 0.030 CA 155 1114 41.403 0.023 CB 155 1115 176.411 0.000 C 155 1116 8.322 0.005 H 155 1117 4.655 0.014 HA 155 1118 2.774 0.018 HB2 155 1119 2.676 0.009 HB3 155 1120 123.702 0.025 N 155 1121 55.643 0.043 CA 156 1122 42.266 0.036 CB 156 1123 23.179 0.029 CD1 156 1124 25.061 0.042 CD2 156 1125 27.153 0.068 CG 156 1126 177.789 0.000 C 156 1127 8.215 0.002 H 156 1128 4.231 0.004 HA 156 1129 1.648 0.012 HB2 156 1130 1.603 0.019 HB3 156 1131 0.847 0.003 HD1 156 1132 0.914 0.003 HD2 156 1133 1.632 0.007 HG 156 1134 122.794 0.022 N 156 1135 30.265 0.056 CB 157 1136 36.191 0.026 CG 157 1137 176.513 0.000 C 157 1138 8.223 0.002 H 157 1139 4.152 0.005 HA 157 1140 1.913 0.010 HB2 157 1419 1.906 0.000 HB3 157 1141 2.239 0.005 HG2 157 1142 2.153 0.004 HG3 157 1143 119.436 0.007 N 157 1144 8.188 0.005 H 158 1145 4.630 0.021 HA 158 1146 3.153 0.000 HB2 158 1147 3.064 0.000 HB3 158 1148 117.952 0.008 N 158 1149 173.715 0.000 C 159 1150 8.303 0.002 H 160 1151 4.494 0.000 HA 160 1152 3.225 0.000 HB2 160 1153 3.144 0.000 HB3 160 1154 125.227 0.013 N 160 1155 43.407 0.111 CA 198 1156 4.021 0.003 HA2 198 1420 4.023 0.000 HA3 198 1157 63.126 0.092 CA 199 1158 32.341 0.051 CB 199 1159 49.651 0.030 CD 199 1160 27.124 0.069 CG 199 1161 177.014 0.000 C 199 1162 4.510 0.003 HA 199 1163 2.350 0.002 HB2 199 1164 1.987 0.001 HB3 199 1165 3.607 0.001 HD2 199 1421 3.607 0.000 HD3 199 1166 2.048 0.001 HG2 199 1422 2.046 0.000 HG3 199 1167 55.521 0.077 CA 200 1168 42.308 0.031 CB 200 1169 24.332 0.309 CD1 200 1170 23.574 0.058 CD2 200 1171 178.015 0.000 C 200 1172 8.554 0.002 H 200 1173 4.387 0.003 HA 200 1174 1.716 0.006 HB2 200 1175 1.674 0.016 HB3 200 1176 0.973 0.003 HD1 200 1177 0.931 0.002 HD2 200 1178 1.509 0.000 HG 200 1179 122.375 0.006 N 200 1180 45.392 0.063 CA 201 1181 174.326 0.000 C 201 1182 8.446 0.003 H 201 1183 4.043 0.021 HA2 201 1423 4.029 0.000 HA3 201 1184 109.953 0.102 N 201 1185 58.479 0.017 CA 202 1186 63.905 0.015 CB 202 1187 174.792 0.000 C 202 1188 8.267 0.003 H 202 1189 4.546 0.009 HA 202 1190 3.908 0.000 HB2 202 1191 3.933 0.000 HB3 202 1192 115.540 0.018 N 202 1193 58.539 0.000 CA 203 1194 63.917 0.030 CB 203 1195 174.389 0.000 C 203 1196 8.471 0.003 H 203 1197 4.548 0.004 HA 203 1198 3.958 0.006 HB2 203 1199 3.926 0.001 HB3 203 1200 117.634 0.000 N 203 1201 58.539 0.000 CA 204 1202 28.071 0.093 CB 204 1203 174.408 0.000 C 204 1204 8.376 0.004 H 204 1205 4.561 0.005 HA 204 1206 2.976 0.003 HB2 204 1403 2.983 0.000 HB3 204 1207 120.862 0.011 N 204 1208 56.269 0.032 CA 205 1209 33.027 0.101 CB 205 1210 28.851 0.088 CD 205 1211 42.195 0.035 CE 205 1212 24.645 0.049 CG 205 1213 176.334 0.000 C 205 1214 8.495 0.007 H 205 1215 4.451 0.004 HA 205 1216 1.798 0.004 HB2 205 1217 1.881 0.011 HB3 205 1218 1.703 0.004 HD2 205 1404 1.703 0.000 HD3 205 1219 3.031 0.009 HE2 205 1405 2.986 0.000 HE3 205 1220 1.463 0.007 HG2 205 1406 1.467 0.000 HG3 205 1221 123.996 0.022 N 205 1223 61.678 0.071 CA 206 1224 70.105 0.022 CB 206 1225 22.235 0.063 CG2 206 1226 8.197 0.006 H 206 1227 4.459 0.006 HA 206 1228 4.141 0.006 HB 206 1229 1.304 0.005 HG2 206 1230 116.666 0.019 N 206 1407 57.783 0.000 CA 207 1231 65.167 0.104 CB 207 1232 174.228 0.000 C 207 1233 9.637 0.012 H 207 1408 4.543 0.000 HA 207 1234 4.580 0.016 HB2 207 1235 4.105 0.005 HB3 207 1236 117.098 0.000 N 207 1237 57.620 0.000 CA 208 1238 28.221 0.000 CB 208 1239 127.535 0.010 CD1 208 1240 123.041 0.043 CH2 208 1241 174.469 0.000 C 208 1242 115.581 0.027 CZ2 208 1243 120.450 0.041 CZ3 208 1244 9.194 0.005 H 208 1245 4.551 0.007 HA 208 1246 3.008 0.025 HB2 208 1247 3.348 0.012 HB3 208 1248 7.167 0.010 HD1 208 1249 9.974 0.003 HE1 208 1250 7.490 0.010 HE3 208 1251 6.720 0.012 HH2 208 1252 7.221 0.005 HZ2 208 1253 7.272 0.015 HZ3 208 1254 124.633 0.018 N 208 1255 130.799 0.019 NE1 208 1256 17.736 0.029 CB 209 1257 179.301 0.000 C 209 1258 9.139 0.008 H 209 1259 3.983 0.002 HA 209 1260 1.361 0.018 HB 209 1261 122.622 0.020 N 209 1262 57.323 0.048 CA 210 1263 40.160 0.077 CB 210 1264 179.357 0.000 C 210 1265 7.743 0.006 H 210 1266 4.386 0.011 HA 210 1267 2.888 0.009 HB2 210 1268 2.555 0.009 HB3 210 1269 116.437 0.016 N 210 1270 59.824 0.089 CA 211 1271 29.026 0.135 CB 211 1272 43.822 0.043 CD 211 1273 28.294 0.064 CG 211 1274 179.791 0.000 C 211 1275 8.110 0.006 H 211 1276 3.992 0.008 HA 211 1277 1.811 0.017 HB2 211 1278 1.925 0.016 HB3 211 1279 3.238 0.015 HD2 211 1280 3.176 0.015 HD3 211 1281 7.045 0.009 HE 211 1282 1.478 0.011 HG2 211 1283 1.884 0.011 HG3 211 1284 6.880 0.000 HH11 211 1397 6.805 0.000 HH21 211 1285 121.907 0.006 N 211 1286 84.330 0.015 NE 211 1287 66.711 0.048 CA 212 1288 30.350 0.140 CB 212 1289 21.452 0.026 CG1 212 1290 22.566 0.034 CG2 212 1291 177.905 0.000 C 212 1292 8.233 0.006 H 212 1293 3.209 0.009 HA 212 1294 1.375 0.013 HB 212 1295 -0.411 0.006 HG1 212 1296 0.275 0.009 HG2 212 1297 123.264 0.010 N 212 1298 60.635 0.000 CA 213 1299 30.339 0.078 CB 213 1300 43.635 0.020 CD 213 1301 27.895 0.003 CG 213 1302 179.871 0.000 C 213 1303 8.234 0.005 H 213 1304 4.017 0.009 HA 213 1305 1.829 0.012 HB2 213 1306 1.918 0.022 HB3 213 1307 3.255 0.023 HD2 213 1308 3.166 0.007 HD3 213 1309 7.383 0.003 HE 213 1310 1.769 0.000 HG2 213 1311 1.727 0.001 HG3 213 1312 6.492 0.000 HH11 213 1313 6.575 0.000 HH12 213 1314 6.806 0.000 HH21 213 1315 6.883 0.003 HH22 213 1316 119.465 0.026 N 213 1317 86.223 0.000 NE 213 1318 59.064 0.027 CA 214 1319 29.608 0.064 CB 214 1320 36.095 0.044 CG 214 1321 178.405 0.000 C 214 1322 7.964 0.005 H 214 1323 4.099 0.007 HA 214 1324 2.075 0.010 HB2 214 1398 2.079 0.000 HB3 214 1325 2.364 0.012 HG2 214 1326 2.214 0.007 HG3 214 1327 119.747 0.010 N 214 1328 54.764 0.011 CA 215 1329 18.415 0.079 CB 215 1330 180.738 0.000 C 215 1331 7.958 0.004 H 215 1332 4.166 0.006 HA 215 1333 1.481 0.007 HB 215 1334 122.811 0.017 N 215 1335 54.323 0.108 CA 216 1336 18.899 0.092 CB 216 1337 179.019 0.000 C 216 1338 8.623 0.006 H 216 1339 4.162 0.006 HA 216 1340 1.661 0.006 HB 216 1341 120.271 0.006 N 216 1342 53.674 0.046 CA 217 1343 18.450 0.097 CB 217 1344 178.651 0.000 C 217 1345 7.736 0.007 H 217 1346 4.278 0.010 HA 217 1347 1.553 0.011 HB 217 1348 120.162 0.023 N 217 1349 56.010 0.066 CA 218 1350 28.856 0.064 CB 218 1351 33.727 0.089 CG 218 1352 176.106 0.000 C 218 1353 7.652 0.009 H 218 1354 4.321 0.012 HA 218 1355 2.271 0.015 HB2 218 1356 2.100 0.005 HB3 218 1357 7.540 0.003 HE21 218 1358 6.864 0.004 HE22 218 1359 2.525 0.009 HG2 218 1360 2.560 0.014 HG3 218 1361 115.793 0.015 N 218 1362 112.181 0.067 NE2 218 1363 56.409 0.038 CA 219 1364 30.567 0.096 CB 219 1365 44.153 0.000 CD 219 1366 26.939 0.044 CG 219 1367 175.253 0.000 C 219 1368 7.707 0.005 H 219 1369 4.377 0.010 HA 219 1370 1.899 0.004 HB2 219 1371 1.995 0.013 HB3 219 1372 3.258 0.005 HD2 219 1399 3.222 0.000 HD3 219 1373 7.452 0.004 HE 219 1374 1.789 0.008 HG2 219 1400 1.815 0.000 HG3 219 1375 120.399 0.028 N 219 1376 84.454 0.017 NE 219 1377 57.173 0.135 CA 220 1378 31.568 0.111 CB 220 1379 43.332 0.000 CD 220 1380 27.591 0.158 CG 220 1381 7.899 0.006 H 220 1382 4.236 0.003 HA 220 1383 1.767 0.004 HB2 220 1384 1.910 0.008 HB3 220 1385 3.243 0.016 HD2 220 1401 3.257 0.000 HD3 220 1386 7.242 0.002 HE 220 1387 1.671 0.005 HG2 220 1402 1.676 0.000 HG3 220 1388 127.684 0.007 N 220 1389 85.281 0.010 NE 220
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