NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
632624 | 6mce | 30510 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H5' G 16 H5' G 16 0.843 -1.241 -2.712 2 H5'' G 16 H5" G 16 2.387 -2.049 -3.002 3 H4' G 16 H4' G 16 1.866 -0.458 -4.766 4 H3' G 16 H3' G 16 4.262 0.258 -3.062 5 H2' G 16 H2' G 16 4.702 1.948 -4.745 6 HO2' G 16 HO2' G 16 3.771 0.438 -6.515 7 H1' G 16 H1' G 16 2.131 2.841 -4.822 8 H8 G 16 H8 G 16 2.785 1.860 -1.235 9 H1 G 16 H1 G 16 5.265 7.592 -2.841 10 H21 G 16 H21 G 16 5.431 7.713 -5.031 11 H22 G 16 H22 G 16 4.738 6.456 -6.066 12 HO5' G 16 HO5' G 16 1.703 -0.170 -1.009 13 H5' G 17 H5' G 17 5.738 0.436 -6.875 14 H5'' G 17 H5" G 17 7.348 -0.281 -6.969 15 H4' G 17 H4' G 17 7.417 2.021 -7.712 16 H3' G 17 H3' G 17 8.710 1.664 -4.997 17 H2' G 17 H2' G 17 9.675 3.841 -5.430 18 HO2' G 17 HO2' G 17 10.006 3.777 -7.717 19 H1' G 17 H1' G 17 7.251 4.871 -6.118 20 H8 G 17 H8 G 17 6.581 2.315 -3.391 21 H1 G 17 H1 G 17 9.043 7.917 -1.326 22 H21 G 17 H21 G 17 9.999 8.938 -3.072 23 H22 G 17 H22 G 17 9.790 8.271 -4.691 24 H5' G 18 H5' G 18 11.650 2.794 -7.887 25 H5'' G 18 H5" G 18 13.219 2.060 -7.561 26 H4' G 18 H4' G 18 13.294 4.544 -7.808 27 H3' G 18 H3' G 18 14.149 3.307 -5.197 28 H2' G 18 H2' G 18 14.813 5.486 -4.466 29 HO2' G 18 HO2' G 18 15.027 7.247 -5.811 30 H1' G 18 H1' G 18 12.584 6.780 -5.380 31 H8 G 18 H8 G 18 11.377 3.445 -4.081 32 H1 G 18 H1 G 18 12.392 7.868 0.488 33 H21 G 18 H21 G 18 13.781 9.391 -0.280 34 H22 G 18 H22 G 18 14.262 9.399 -1.981 35 H5' C 19 H5' C 19 17.344 5.828 -6.212 36 H5'' C 19 H5" C 19 18.903 5.048 -5.925 37 H4' C 19 H4' C 19 18.768 7.096 -4.643 38 H3' C 19 H3' C 19 18.570 4.626 -2.907 39 H2' C 19 H2' C 19 18.785 6.134 -1.025 40 HO2' C 19 HO2' C 19 20.283 7.626 -2.286 41 H1' C 19 H1' C 19 16.939 7.895 -1.986 42 H41 C 19 H41 C 19 13.453 4.074 1.502 43 H42 C 19 H42 C 19 13.343 2.873 0.210 44 H5 C 19 H5 C 19 14.689 3.000 -1.783 45 H6 C 19 H6 C 19 16.184 4.435 -3.036 46 H5' A 20 H5' A 20 21.775 6.801 -1.106 47 H5'' A 20 H5" A 20 23.021 5.646 -0.627 48 H4' A 20 H4' A 20 22.317 6.972 1.268 49 H3' A 20 H3' A 20 21.375 4.097 1.473 50 H2' A 20 H2' A 20 20.851 4.663 3.771 51 HO2' A 20 HO2' A 20 22.725 6.200 3.995 52 H1' A 20 H1' A 20 19.514 6.914 3.059 53 H8 A 20 H8 A 20 19.075 4.344 0.256 54 H61 A 20 H61 A 20 14.409 2.236 3.867 55 H62 A 20 H62 A 20 15.129 2.110 2.263 56 H2 A 20 H2 A 20 16.765 4.997 6.237 57 H5' G 21 H5' G 21 23.695 4.662 5.041 58 H5'' G 21 H5" G 21 24.643 3.194 5.285 59 H4' G 21 H4' G 21 23.432 3.681 7.271 60 H3' G 21 H3' G 21 22.152 1.303 5.872 61 H2' G 21 H2' G 21 21.027 0.992 7.989 62 HO2' G 21 HO2' G 21 22.946 1.957 9.261 63 H1' G 21 H1' G 21 20.175 3.564 8.021 64 H8 G 21 H8 G 21 20.555 2.627 4.359 65 H1 G 21 H1 G 21 15.513 -0.204 7.204 66 H21 G 21 H21 G 21 15.722 -0.042 9.394 67 H22 G 21 H22 G 21 17.033 0.911 10.086 68 H5' A 22 H5' A 22 23.004 0.035 9.616 69 H5'' A 22 H5" A 22 24.192 -1.244 9.579 70 H4' A 22 H4' A 22 22.568 -1.859 11.204 71 H3' A 22 H3' A 22 22.135 -3.436 8.659 72 H2' A 22 H2' A 22 20.311 -4.547 9.687 73 HO2' A 22 HO2' A 22 21.408 -4.706 11.822 74 H1' A 22 H1' A 22 19.200 -2.341 10.849 75 H8 A 22 H8 A 22 20.614 -1.295 7.464 76 H61 A 22 H61 A 22 15.253 -3.427 5.143 77 H62 A 22 H62 A 22 16.517 -2.229 4.932 78 H2 A 22 H2 A 22 15.590 -4.923 9.236 79 H5' U 23 H5' U 23 25.600 -6.309 7.670 80 H5'' U 23 H5" U 23 24.315 -6.241 6.465 81 H4' U 23 H4' U 23 24.043 -7.576 9.195 82 H3' U 23 H3' U 23 25.410 -8.640 6.973 83 H2' U 23 H2' U 23 23.583 -8.670 5.558 84 HO2' U 23 HO2' U 23 23.791 -11.092 6.905 85 H1' U 23 H1' U 23 21.860 -9.469 7.923 86 H3 U 23 H3 U 23 18.226 -9.870 5.348 87 H5 U 23 H5 U 23 20.443 -6.969 3.277 88 H6 U 23 H6 U 23 22.090 -7.010 5.087 89 H5' U 25 H5' U 25 24.180 -8.894 11.133 90 H5'' U 25 H5" U 25 25.725 -8.070 10.862 91 H4' U 25 H4' U 25 25.420 -9.895 13.255 92 H3' U 25 H3' U 25 24.386 -7.086 12.890 93 H2' U 25 H2' U 25 25.092 -6.518 15.061 94 HO2' U 25 HO2' U 25 25.486 -8.009 16.705 95 H1' U 25 H1' U 25 27.369 -8.205 15.052 96 H3 U 25 H3 U 25 29.975 -4.531 15.195 97 H5 U 25 H5 U 25 27.050 -3.434 12.410 98 H6 U 25 H6 U 25 26.027 -5.628 12.667 99 H5' G 26 H5' G 26 21.798 -9.587 11.835 100 H5'' G 26 H5" G 26 21.171 -8.498 10.608 101 H4' G 26 H4' G 26 19.607 -9.539 12.905 102 H3' G 26 H3' G 26 19.717 -10.298 9.995 103 H2' G 26 H2' G 26 17.379 -10.685 10.005 104 HO2' G 26 HO2' G 26 17.564 -11.516 12.387 105 H1' G 26 H1' G 26 16.673 -8.439 11.333 106 H8 G 26 H8 G 26 19.619 -7.322 9.390 107 H1 G 26 H1 G 26 14.519 -8.350 5.616 108 H21 G 26 H21 G 26 13.118 -9.711 6.726 109 H22 G 26 H22 G 26 13.428 -10.101 8.421 110 H5' A 27 H5' A 27 17.112 -13.358 11.601 111 H5'' A 27 H5" A 27 17.837 -14.908 11.158 112 H4' A 27 H4' A 27 15.546 -14.915 10.475 113 H3' A 27 H3' A 27 17.434 -14.612 8.119 114 H2' A 27 H2' A 27 15.510 -15.056 6.770 115 HO2' A 27 HO2' A 27 14.574 -16.620 8.448 116 H1' A 27 H1' A 27 13.910 -13.309 8.127 117 H8 A 27 H8 A 27 17.297 -11.650 8.095 118 H61 A 27 H61 A 27 16.197 -10.532 2.036 119 H62 A 27 H62 A 27 17.197 -10.047 3.362 120 H2 A 27 H2 A 27 13.155 -13.298 3.425 121 H5' G 28 H5' G 28 15.263 -18.069 7.260 122 H5'' G 28 H5" G 28 16.249 -19.295 6.463 123 H4' G 28 H4' G 28 14.222 -18.571 5.199 124 H3' G 28 H3' G 28 16.884 -18.108 3.801 125 H2' G 28 H2' G 28 15.572 -17.621 1.885 126 HO2' G 28 HO2' G 28 13.307 -17.830 1.825 127 H1' G 28 H1' G 28 13.942 -15.894 3.200 128 H8 G 28 H8 G 28 17.233 -15.474 4.927 129 H1 G 28 H1 G 28 17.186 -13.083 -1.038 130 H21 G 28 H21 G 28 15.523 -14.069 -2.180 131 H22 G 28 H22 G 28 14.452 -15.179 -1.322 132 H5' C 29 H5' C 29 14.565 -20.104 1.225 133 H5'' C 29 H5" C 29 15.361 -21.504 0.522 134 H4' C 29 H4' C 29 14.425 -20.039 -1.204 135 H3' C 29 H3' C 29 17.440 -20.212 -1.101 136 H2' C 29 H2' C 29 17.391 -19.123 -3.249 137 HO2' C 29 HO2' C 29 15.652 -20.001 -4.335 138 H1' C 29 H1' C 29 15.503 -17.290 -2.507 139 H41 C 29 H41 C 29 20.762 -14.065 -1.641 140 H42 C 29 H42 C 29 20.889 -14.612 0.022 141 H5 C 29 H5 C 29 19.481 -16.379 0.908 142 H6 C 29 H6 C 29 17.595 -17.833 0.434 143 H5' C 30 H5' C 30 16.021 -22.086 -4.752 144 H5'' C 30 H5" C 30 17.093 -23.376 -5.321 145 H4' C 30 H4' C 30 16.829 -21.552 -6.977 146 H3' C 30 H3' C 30 19.602 -21.904 -5.798 147 H2' C 30 H2' C 30 20.350 -20.244 -7.337 148 HO2' C 30 HO2' C 30 18.722 -21.161 -9.028 149 H1' C 30 H1' C 30 18.135 -18.606 -7.046 150 H41 C 30 H41 C 30 22.533 -15.951 -3.546 151 H42 C 30 H42 C 30 22.391 -17.127 -2.239 152 H5 C 30 H5 C 30 20.782 -18.964 -2.354 153 H6 C 30 H6 C 30 19.243 -20.121 -3.832 154 H5' U 31 H5' U 31 20.460 -21.854 -9.860 155 H5'' U 31 H5" U 31 21.599 -23.152 -10.238 156 H4' U 31 H4' U 31 22.561 -21.002 -10.841 157 H3' U 31 H3' U 31 23.834 -22.354 -8.455 158 H2' U 31 H2' U 31 25.476 -20.631 -8.440 159 HO2' U 31 HO2' U 31 25.467 -20.695 -10.924 160 H1' U 31 H1' U 31 23.708 -18.571 -9.072 161 H3 U 31 H3 U 31 24.514 -17.292 -4.813 162 H5 U 31 H5 U 31 23.123 -21.199 -4.323 163 H6 U 31 H6 U 31 22.766 -21.344 -6.728 164 H5' G 32 H5' G 32 28.018 -23.494 -8.573 165 H5'' G 32 H5" G 32 27.256 -21.953 -8.128 166 H4' G 32 H4' G 32 29.773 -21.952 -8.354 167 H3' G 32 H3' G 32 27.952 -20.007 -9.612 168 H2' G 32 H2' G 32 29.434 -19.163 -11.221 169 HO2' G 32 HO2' G 32 31.303 -18.839 -9.975 170 H1' G 32 H1' G 32 30.714 -21.429 -11.974 171 H8 G 32 H8 G 32 27.434 -19.720 -12.014 172 H1 G 32 H1 G 32 27.463 -25.069 -15.608 173 H21 G 32 H21 G 32 29.312 -26.261 -15.115 174 H22 G 32 H22 G 32 30.442 -25.656 -13.913 175 H5' G 33 H5' G 33 31.329 -17.378 -8.703 176 H5'' G 33 H5" G 33 30.686 -15.863 -8.081 177 H4' G 33 H4' G 33 31.985 -15.613 -10.188 178 H3' G 33 H3' G 33 29.087 -14.767 -10.237 179 H2' G 33 H2' G 33 29.283 -14.208 -12.522 180 HO2' G 33 HO2' G 33 31.512 -13.251 -12.129 181 H1' G 33 H1' G 33 30.859 -16.321 -13.309 182 H8 G 33 H8 G 33 27.908 -16.901 -10.823 183 H1 G 33 H1 G 33 26.548 -17.626 -17.085 184 H21 G 33 H21 G 33 28.418 -17.212 -18.277 185 H22 G 33 H22 G 33 29.896 -16.758 -17.444 186 H5' G 34 H5' G 34 28.556 -10.198 -8.422 187 H5'' G 34 H5" G 34 27.553 -11.584 -7.987 188 H4' G 34 H4' G 34 27.185 -10.172 -10.570 189 H3' G 34 H3' G 34 26.079 -9.250 -7.908 190 H2' G 34 H2' G 34 23.939 -9.163 -8.584 191 HO2' G 34 HO2' G 34 24.777 -9.677 -11.295 192 H1' G 34 H1' G 34 23.749 -11.505 -9.843 193 H8 G 34 H8 G 34 25.933 -10.697 -6.637 194 H1 G 34 H1 G 34 21.898 -15.671 -6.189 195 H21 G 34 H21 G 34 20.697 -15.806 -8.008 196 H22 G 34 H22 G 34 20.924 -14.681 -9.345 197 H5' A 35 H5' A 35 27.839 -4.214 -8.472 198 H5'' A 35 H5" A 35 26.852 -5.507 -7.800 199 H4' A 35 H4' A 35 25.598 -3.538 -8.695 200 H3' A 35 H3' A 35 24.966 -6.329 -9.503 201 H2' A 35 H2' A 35 23.636 -5.781 -11.306 202 HO2' A 35 HO2' A 35 22.539 -4.054 -9.930 203 H1' A 35 H1' A 35 24.905 -3.552 -12.238 204 H8 A 35 H8 A 35 25.606 -7.303 -11.590 205 H61 A 35 H61 A 35 28.693 -6.760 -17.017 206 H62 A 35 H62 A 35 28.115 -7.953 -15.849 207 H2 A 35 H2 A 35 27.642 -2.793 -15.742 208 H5' G 36 H5' G 36 22.745 -7.314 -9.629 209 H5'' G 36 H5" G 36 21.422 -6.213 -9.235 210 H4' G 36 H4' G 36 20.548 -8.206 -10.243 211 H3' G 36 H3' G 36 19.949 -8.061 -7.286 212 H2' G 36 H2' G 36 18.641 -10.060 -7.610 213 HO2' G 36 HO2' G 36 18.066 -9.237 -9.950 214 H1' G 36 H1' G 36 20.483 -11.395 -9.055 215 H8 G 36 H8 G 36 22.618 -9.450 -6.721 216 H1 G 36 H1 G 36 19.528 -14.351 -3.826 217 H21 G 36 H21 G 36 18.043 -15.184 -5.219 218 H22 G 36 H22 G 36 17.862 -14.521 -6.845 219 H5' C 37 H5' C 37 16.317 -8.982 -9.133 220 H5'' C 37 H5" C 37 14.947 -8.127 -8.448 221 H4' C 37 H4' C 37 14.623 -10.531 -8.454 222 H3' C 37 H3' C 37 14.889 -9.326 -5.701 223 H2' C 37 H2' C 37 14.062 -11.455 -4.899 224 HO2' C 37 HO2' C 37 13.689 -12.187 -7.661 225 H1' C 37 H1' C 37 15.818 -12.884 -6.390 226 H41 C 37 H41 C 37 18.736 -11.783 -0.865 227 H42 C 37 H42 C 37 19.601 -10.483 -1.654 228 H5 C 37 H5 C 37 19.126 -9.671 -3.818 229 H6 C 37 H6 C 37 17.676 -9.901 -5.755 230 H5' U 38 H5' U 38 11.235 -11.277 -5.884 231 H5'' U 38 H5" U 38 9.891 -10.328 -5.234 232 H4' U 38 H4' U 38 9.967 -12.562 -4.247 233 H3' U 38 H3' U 38 10.515 -10.244 -2.370 234 H2' U 38 H2' U 38 10.625 -11.783 -0.579 235 HO2' U 38 HO2' U 38 8.803 -13.134 -1.713 236 H1' U 38 H1' U 38 12.084 -13.708 -1.876 237 H3 U 38 H3 U 38 14.645 -11.711 1.341 238 H5 U 38 H5 U 38 15.286 -9.495 -2.147 239 H6 U 38 H6 U 38 13.395 -10.610 -3.161 240 H5' C 39 H5' C 39 8.221 -12.047 0.198 241 H5'' C 39 H5" C 39 6.994 -10.924 0.775 242 H4' C 39 H4' C 39 8.277 -11.646 2.599 243 H3' C 39 H3' C 39 9.251 -8.827 1.994 244 H2' C 39 H2' C 39 10.017 -8.986 4.252 245 HO2' C 39 HO2' C 39 9.488 -10.614 5.640 246 H1' C 39 H1' C 39 11.017 -11.541 3.772 247 H41 C 39 H41 C 39 15.570 -7.227 3.526 248 H42 C 39 H42 C 39 15.353 -6.973 1.792 249 H5 C 39 H5 C 39 13.489 -8.005 0.565 250 H6 C 39 H6 C 39 11.599 -9.565 0.770 251 H5' U 40 H5' U 40 7.312 -8.989 5.713 252 H5'' U 40 H5" U 40 6.466 -7.486 6.100 253 H4' U 40 H4' U 40 8.019 -8.157 7.885 254 H3' U 40 H3' U 40 8.889 -5.636 6.441 255 H2' U 40 H2' U 40 10.376 -5.349 8.305 256 HO2' U 40 HO2' U 40 10.385 -6.705 10.094 257 H1' U 40 H1' U 40 11.303 -7.916 8.059 258 H3 U 40 H3 U 40 14.322 -4.831 6.472 259 H5 U 40 H5 U 40 11.792 -5.601 3.221 260 H6 U 40 H6 U 40 10.375 -6.955 4.665 261 H5' C 41 H5' C 41 8.421 -4.664 10.431 262 H5'' C 41 H5" C 41 7.569 -3.132 10.658 263 H4' C 41 H4' C 41 9.635 -3.187 11.943 264 H3' C 41 H3' C 41 9.664 -1.222 9.640 265 H2' C 41 H2' C 41 11.727 -0.400 10.586 266 HO2' C 41 HO2' C 41 10.927 -0.877 12.881 267 H1' C 41 H1' C 41 12.803 -2.886 10.919 268 H41 C 41 H41 C 41 14.452 -0.639 5.261 269 H42 C 41 H42 C 41 13.003 -1.217 4.496 270 H5 C 41 H5 C 41 11.389 -2.584 5.754 271 H6 C 41 H6 C 41 10.683 -3.222 7.986 272 H5' U 42 H5' U 42 10.729 1.191 12.901 273 H5'' U 42 H5" U 42 9.843 2.717 12.840 274 H4' U 42 H4' U 42 12.258 3.066 12.939 275 H3' U 42 H3' U 42 11.016 3.906 10.304 276 H2' U 42 H2' U 42 13.155 4.958 9.874 277 HO2' U 42 HO2' U 42 13.470 5.510 12.249 278 H1' U 42 H1' U 42 14.575 2.750 10.635 279 H3 U 42 H3 U 42 14.744 3.126 6.079 280 H5 U 42 H5 U 42 11.118 1.186 6.807 281 H6 U 42 H6 U 42 11.425 1.567 9.197 282 H5' G 43 H5' G 43 13.011 7.421 11.820 283 H5'' G 43 H5" G 43 11.997 8.836 11.520 284 H4' G 43 H4' G 43 14.281 9.095 10.621 285 H3' G 43 H3' G 43 12.056 9.016 8.579 286 H2' G 43 H2' G 43 13.720 9.639 6.957 287 HO2' G 43 HO2' G 43 15.771 10.334 7.487 288 H1' G 43 H1' G 43 15.589 7.848 7.868 289 H8 G 43 H8 G 43 12.221 6.115 8.113 290 H1 G 43 H1 G 43 14.735 6.256 2.184 291 H21 G 43 H21 G 43 16.272 7.832 2.083 292 H22 G 43 H22 G 43 16.759 8.707 3.539 293 H5' C 44 H5' C 44 14.185 12.595 7.746 294 H5'' C 44 H5" C 44 13.085 13.924 7.361 295 H4' C 44 H4' C 44 14.681 13.585 5.562 296 H3' C 44 H3' C 44 11.863 12.775 4.802 297 H2' C 44 H2' C 44 12.722 12.554 2.557 298 HO2' C 44 HO2' C 44 14.300 14.429 2.908 299 H1' C 44 H1' C 44 14.924 11.147 3.304 300 H41 C 44 H41 C 44 10.748 6.675 2.135 301 H42 C 44 H42 C 44 10.101 6.744 3.783 302 H5 C 44 H5 C 44 10.678 8.531 5.298 303 H6 C 44 H6 C 44 12.162 10.425 5.612 304 H5' C 45 H5' C 45 13.018 15.441 1.697 305 H5'' C 45 H5" C 45 11.635 16.395 1.161 306 H4' C 45 H4' C 45 12.678 15.070 -0.639 307 H3' C 45 H3' C 45 9.821 14.287 0.007 308 H2' C 45 H2' C 45 9.946 12.946 -1.998 309 HO2' C 45 HO2' C 45 11.431 14.599 -3.084 310 H1' C 45 H1' C 45 12.371 11.871 -1.360 311 H41 C 45 H41 C 45 8.198 7.811 0.908 312 H42 C 45 H42 C 45 8.037 8.701 2.431 313 H5 C 45 H5 C 45 9.093 10.854 2.780 314 H6 C 45 H6 C 45 10.545 12.521 1.765 315 H5' C 46 H5' C 46 9.825 15.097 -4.196 316 H5'' C 46 H5" C 46 8.396 16.056 -4.593 317 H4' C 46 H4' C 46 8.489 14.068 -5.983 318 H3' C 46 H3' C 46 6.264 14.035 -3.924 319 HO3' C 46 HO3' C 46 5.049 14.753 -5.731 320 H2' C 46 H2' C 46 5.460 12.062 -4.993 321 HO2' C 46 HO2' C 46 5.985 12.905 -7.215 322 H1' C 46 H1' C 46 7.961 10.928 -5.338 323 H41 C 46 H41 C 46 5.319 8.385 -0.256 324 H42 C 46 H42 C 46 5.764 9.745 0.784 325 H5 C 46 H5 C 46 6.869 11.722 -0.106 326 H6 C 46 H6 C 46 7.729 12.749 -2.138 327 H1 GLY 44 H1 GLY 44 31.809 -5.161 4.910 328 H2 GLY 44 H2 GLY 44 33.211 -5.964 4.634 329 H3 GLY 44 H3 GLY 44 31.784 -6.761 4.556 330 HA2 GLY 44 HA2 GLY 44 31.092 -5.466 2.641 331 HA3 GLY 44 HA3 GLY 44 32.651 -4.625 2.718 332 H ILE 45 H ILE 45 32.956 -5.354 0.526 333 HA ILE 45 HA ILE 45 33.595 -6.715 -1.166 334 HB ILE 45 HB ILE 45 35.533 -7.933 0.807 335 HG12 ILE 45 HG12 ILE 45 35.577 -5.573 1.357 336 HG13 ILE 45 HG13 ILE 45 37.033 -6.035 0.515 337 HG21 ILE 45 HG21 ILE 45 37.100 -7.732 -1.144 338 HG22 ILE 45 HG22 ILE 45 35.738 -8.794 -1.480 339 HG23 ILE 45 HG23 ILE 45 35.751 -7.155 -2.143 340 HD11 ILE 45 HD11 ILE 45 34.699 -4.543 -0.774 341 HD12 ILE 45 HD12 ILE 45 36.212 -3.825 -0.200 342 HD13 ILE 45 HD13 ILE 45 36.241 -4.956 -1.558 343 H SER 46 H SER 46 31.299 -7.668 -0.464 344 HA SER 46 HA SER 46 31.429 -10.640 -0.653 345 HB2 SER 46 HB2 SER 46 29.820 -9.083 1.421 346 HB3 SER 46 HB3 SER 46 29.647 -10.811 1.084 347 HG SER 46 HG SER 46 31.956 -9.481 2.091 348 H TYR 47 H TYR 47 29.249 -11.571 -1.099 349 HA TYR 47 HA TYR 47 27.293 -9.809 -2.440 350 HB2 TYR 47 HB2 TYR 47 27.307 -11.121 -4.480 351 HB3 TYR 47 HB3 TYR 47 28.854 -10.370 -4.205 352 HD1 TYR 47 HD1 TYR 47 27.077 -13.553 -4.583 353 HD2 TYR 47 HD2 TYR 47 30.848 -11.728 -3.543 354 HE1 TYR 47 HE1 TYR 47 28.247 -15.694 -5.066 355 HE2 TYR 47 HE2 TYR 47 32.009 -13.888 -3.988 356 HH TYR 47 HH TYR 47 30.281 -16.730 -5.314 357 H GLY 48 H GLY 48 25.437 -11.379 -3.351 358 HA2 GLY 48 HA2 GLY 48 23.871 -13.040 -2.818 359 HA3 GLY 48 HA3 GLY 48 24.719 -13.435 -1.328 360 H ARG 49 H ARG 49 23.884 -10.133 -2.195 361 HA ARG 49 HA ARG 49 21.384 -9.969 -0.678 362 HB2 ARG 49 HB2 ARG 49 23.893 -8.437 0.160 363 HB3 ARG 49 HB3 ARG 49 22.273 -7.962 0.640 364 HG2 ARG 49 HG2 ARG 49 23.670 -10.538 1.441 365 HG3 ARG 49 HG3 ARG 49 23.377 -9.113 2.435 366 HD2 ARG 49 HD2 ARG 49 20.887 -9.466 2.094 367 HD3 ARG 49 HD3 ARG 49 21.271 -11.010 1.323 368 HE ARG 49 HE ARG 49 22.489 -10.644 3.966 369 HH11 ARG 49 HH11 ARG 49 19.613 -12.078 2.325 370 HH12 ARG 49 HH12 ARG 49 19.245 -12.998 3.617 371 HH21 ARG 49 HH21 ARG 49 21.898 -11.791 5.629 372 HH22 ARG 49 HH22 ARG 49 20.481 -12.799 5.601 373 H LYS 50 H LYS 50 20.492 -7.703 -0.849 374 HA LYS 50 HA LYS 50 21.434 -6.143 -3.201 375 HB2 LYS 50 HB2 LYS 50 19.203 -5.910 -4.102 376 HB3 LYS 50 HB3 LYS 50 19.680 -7.587 -4.094 377 HG2 LYS 50 HG2 LYS 50 18.255 -8.062 -2.166 378 HG3 LYS 50 HG3 LYS 50 17.905 -6.357 -1.915 379 HD2 LYS 50 HD2 LYS 50 17.145 -7.835 -4.460 380 HD3 LYS 50 HD3 LYS 50 16.084 -7.714 -3.051 381 HE2 LYS 50 HE2 LYS 50 15.960 -5.318 -3.207 382 HE3 LYS 50 HE3 LYS 50 17.199 -5.281 -4.470 383 HZ1 LYS 50 HZ1 LYS 50 14.547 -6.605 -4.810 384 HZ2 LYS 50 HZ2 LYS 50 14.956 -5.131 -5.410 385 HZ3 LYS 50 HZ3 LYS 50 15.729 -6.473 -5.930 386 H LYS 51 H LYS 51 20.016 -4.131 -3.406 387 HA LYS 51 HA LYS 51 20.312 -2.404 -1.131 388 HB2 LYS 51 HB2 LYS 51 18.594 -2.061 -3.642 389 HB3 LYS 51 HB3 LYS 51 18.963 -0.814 -2.461 390 HG2 LYS 51 HG2 LYS 51 20.441 -0.325 -4.147 391 HG3 LYS 51 HG3 LYS 51 21.459 -1.213 -3.014 392 HD2 LYS 51 HD2 LYS 51 21.306 -3.231 -4.455 393 HD3 LYS 51 HD3 LYS 51 20.152 -2.394 -5.517 394 HE2 LYS 51 HE2 LYS 51 21.917 -0.724 -6.058 395 HE3 LYS 51 HE3 LYS 51 23.041 -1.575 -4.987 396 HZ1 LYS 51 HZ1 LYS 51 21.796 -2.726 -7.426 397 HZ2 LYS 51 HZ2 LYS 51 23.362 -2.286 -7.274 398 HZ3 LYS 51 HZ3 LYS 51 22.779 -3.557 -6.416 399 H ARG 52 H ARG 52 18.850 -1.627 0.317 400 HA ARG 52 HA ARG 52 16.669 -3.360 1.166 401 HB2 ARG 52 HB2 ARG 52 17.282 -0.562 2.171 402 HB3 ARG 52 HB3 ARG 52 16.471 -1.870 3.014 403 HG2 ARG 52 HG2 ARG 52 19.444 -1.652 2.382 404 HG3 ARG 52 HG3 ARG 52 18.661 -1.488 3.938 405 HD2 ARG 52 HD2 ARG 52 17.930 -3.933 3.694 406 HD3 ARG 52 HD3 ARG 52 19.036 -4.033 2.323 407 HE ARG 52 HE ARG 52 20.830 -3.199 3.999 408 HH11 ARG 52 HH11 ARG 52 18.192 -5.286 5.075 409 HH12 ARG 52 HH12 ARG 52 19.015 -5.746 6.496 410 HH21 ARG 52 HH21 ARG 52 21.893 -3.936 5.946 411 HH22 ARG 52 HH22 ARG 52 20.890 -4.753 7.077 412 H ARG 53 H ARG 53 14.501 -2.214 1.853 413 HA ARG 53 HA ARG 53 13.452 -0.458 -0.338 414 HB2 ARG 53 HB2 ARG 53 11.434 -1.735 -0.526 415 HB3 ARG 53 HB3 ARG 53 12.816 -2.761 -0.829 416 HG2 ARG 53 HG2 ARG 53 11.205 -4.036 0.341 417 HG3 ARG 53 HG3 ARG 53 12.541 -3.778 1.461 418 HD2 ARG 53 HD2 ARG 53 11.288 -2.286 2.790 419 HD3 ARG 53 HD3 ARG 53 10.132 -1.946 1.479 420 HE ARG 53 HE ARG 53 9.647 -4.572 1.988 421 HH11 ARG 53 HH11 ARG 53 9.635 -1.750 4.220 422 HH12 ARG 53 HH12 ARG 53 8.594 -2.676 5.303 423 HH21 ARG 53 HH21 ARG 53 8.174 -5.372 3.431 424 HH22 ARG 53 HH22 ARG 53 7.816 -4.430 4.892 425 H GLN 54 H GLN 54 11.512 0.799 0.209 426 HA GLN 54 HA GLN 54 11.452 1.639 3.044 427 HB2 GLN 54 HB2 GLN 54 11.264 3.394 1.487 428 HB3 GLN 54 HB3 GLN 54 10.006 2.591 0.558 429 HG2 GLN 54 HG2 GLN 54 9.200 4.497 1.961 430 HG3 GLN 54 HG3 GLN 54 8.365 2.982 2.254 431 HE21 GLN 54 HE21 GLN 54 11.017 4.304 5.179 432 HE22 GLN 54 HE22 GLN 54 11.281 4.777 3.612 433 H ARG 55 H ARG 55 8.805 0.670 0.826 434 HA ARG 55 HA ARG 55 7.775 -1.312 2.764 435 HB2 ARG 55 HB2 ARG 55 5.612 -0.409 2.946 436 HB3 ARG 55 HB3 ARG 55 6.729 0.894 3.324 437 HG2 ARG 55 HG2 ARG 55 6.413 1.715 0.908 438 HG3 ARG 55 HG3 ARG 55 5.154 0.486 0.740 439 HD2 ARG 55 HD2 ARG 55 3.993 2.479 1.309 440 HD3 ARG 55 HD3 ARG 55 3.994 1.493 2.760 441 HE ARG 55 HE ARG 55 5.266 3.105 3.847 442 HH11 ARG 55 HH11 ARG 55 5.338 3.887 0.426 443 HH12 ARG 55 HH12 ARG 55 6.408 5.241 0.665 444 HH21 ARG 55 HH21 ARG 55 6.435 5.004 4.088 445 HH22 ARG 55 HH22 ARG 55 6.852 5.933 2.673 446 H ARG 56 H ARG 56 5.844 -2.471 1.789 447 HA ARG 56 HA ARG 56 5.894 -2.730 -1.151 448 HB2 ARG 56 HB2 ARG 56 6.583 -4.986 0.780 449 HB3 ARG 56 HB3 ARG 56 6.111 -5.280 -0.884 450 HG2 ARG 56 HG2 ARG 56 8.561 -3.654 -0.086 451 HG3 ARG 56 HG3 ARG 56 8.579 -5.361 -0.508 452 HD2 ARG 56 HD2 ARG 56 7.910 -4.949 -2.758 453 HD3 ARG 56 HD3 ARG 56 7.464 -3.292 -2.413 454 HE ARG 56 HE ARG 56 10.264 -4.323 -2.516 455 HH11 ARG 56 HH11 ARG 56 8.093 -1.510 -2.914 456 HH12 ARG 56 HH12 ARG 56 9.424 -0.614 -3.661 457 HH21 ARG 56 HH21 ARG 56 11.785 -2.938 -3.491 458 HH22 ARG 56 HH22 ARG 56 11.248 -1.316 -3.927 459 H ARG 57 H ARG 57 4.277 -4.175 -1.949 460 HA ARG 57 HA ARG 57 1.688 -3.451 -1.261 461 HB2 ARG 57 HB2 ARG 57 0.977 -5.056 -2.922 462 HB3 ARG 57 HB3 ARG 57 2.512 -4.364 -3.445 463 HG2 ARG 57 HG2 ARG 57 3.591 -6.458 -2.280 464 HG3 ARG 57 HG3 ARG 57 1.959 -7.128 -2.319 465 HD2 ARG 57 HD2 ARG 57 1.919 -6.784 -4.801 466 HD3 ARG 57 HD3 ARG 57 3.590 -6.213 -4.737 467 HE ARG 57 HE ARG 57 2.647 -8.957 -4.610 468 HH11 ARG 57 HH11 ARG 57 5.407 -7.000 -3.664 469 HH12 ARG 57 HH12 ARG 57 6.344 -8.393 -3.174 470 HH21 ARG 57 HH21 ARG 57 3.890 -10.667 -3.959 471 HH22 ARG 57 HH22 ARG 57 5.407 -10.357 -3.150 472 H ALA 58 H ALA 58 -0.151 -4.527 -0.534 473 HA ALA 58 HA ALA 58 0.058 -6.950 1.113 474 HB1 ALA 58 HB1 ALA 58 -0.780 -4.257 2.294 475 HB2 ALA 58 HB2 ALA 58 -0.847 -5.825 3.127 476 HB3 ALA 58 HB3 ALA 58 0.719 -5.133 2.675 477 H HIS 59 H HIS 59 -2.134 -7.560 1.987 478 HA HIS 59 HA HIS 59 -4.079 -7.566 -0.145 479 HB2 HIS 59 HB2 HIS 59 -4.269 -8.570 2.721 480 HB3 HIS 59 HB3 HIS 59 -5.392 -8.961 1.421 481 HD2 HIS 59 HD2 HIS 59 -2.422 -10.355 3.071 482 HE1 HIS 59 HE1 HIS 59 -2.297 -12.091 -0.826 483 HE2 HIS 59 HE2 HIS 59 -1.349 -12.211 1.534 484 H GLN 60 H GLN 60 -3.645 -5.273 2.336 485 HA GLN 60 HA GLN 60 -6.320 -4.055 1.894 486 HB2 GLN 60 HB2 GLN 60 -5.087 -4.627 4.627 487 HB3 GLN 60 HB3 GLN 60 -6.472 -3.568 4.338 488 HG2 GLN 60 HG2 GLN 60 -7.717 -5.504 3.354 489 HG3 GLN 60 HG3 GLN 60 -6.383 -6.571 3.803 490 HE21 GLN 60 HE21 GLN 60 -9.163 -6.258 6.514 491 HE22 GLN 60 HE22 GLN 60 -9.353 -6.256 4.763 Start of MODEL 2 1 H5' G 16 H5' G 16 1.384 -2.125 -2.761 2 H5'' G 16 H5" G 16 2.955 -2.800 -3.208 3 H4' G 16 H4' G 16 2.219 -1.323 -4.948 4 H3' G 16 H3' G 16 4.475 -0.142 -3.322 5 H2' G 16 H2' G 16 4.540 1.629 -4.947 6 HO2' G 16 HO2' G 16 3.872 0.029 -6.755 7 H1' G 16 H1' G 16 1.876 2.078 -4.916 8 H8 G 16 H8 G 16 2.581 0.996 -1.426 9 H1 G 16 H1 G 16 4.893 6.885 -2.676 10 H21 G 16 H21 G 16 5.076 7.117 -4.869 11 H22 G 16 H22 G 16 4.419 5.890 -5.959 12 HO5' G 16 HO5' G 16 2.839 -2.122 -0.978 13 H5' G 17 H5' G 17 5.755 0.327 -7.405 14 H5'' G 17 H5" G 17 7.373 -0.379 -7.518 15 H4' G 17 H4' G 17 7.400 1.851 -8.467 16 H3' G 17 H3' G 17 8.813 1.612 -5.801 17 H2' G 17 H2' G 17 9.673 3.804 -6.206 18 HO2' G 17 HO2' G 17 9.410 4.904 -8.151 19 H1' G 17 H1' G 17 7.235 4.825 -6.877 20 H8 G 17 H8 G 17 6.539 2.200 -4.253 21 H1 G 17 H1 G 17 9.009 7.660 -1.898 22 H21 G 17 H21 G 17 9.901 8.819 -3.561 23 H22 G 17 H22 G 17 9.733 8.262 -5.231 24 H5' G 18 H5' G 18 11.600 3.161 -8.390 25 H5'' G 18 H5" G 18 13.198 2.435 -8.201 26 H4' G 18 H4' G 18 13.257 4.887 -8.016 27 H3' G 18 H3' G 18 13.962 3.372 -5.496 28 H2' G 18 H2' G 18 14.598 5.486 -4.562 29 HO2' G 18 HO2' G 18 14.820 7.355 -5.747 30 H1' G 18 H1' G 18 12.366 6.802 -5.431 31 H8 G 18 H8 G 18 11.243 3.305 -4.503 32 H1 G 18 H1 G 18 12.002 7.330 0.483 33 H21 G 18 H21 G 18 13.306 9.011 -0.170 34 H22 G 18 H22 G 18 13.773 9.160 -1.867 35 H5' C 19 H5' C 19 17.155 6.020 -6.184 36 H5'' C 19 H5" C 19 18.714 5.251 -5.870 37 H4' C 19 H4' C 19 18.481 7.264 -4.533 38 H3' C 19 H3' C 19 18.336 4.726 -2.891 39 H2' C 19 H2' C 19 18.511 6.183 -0.963 40 HO2' C 19 HO2' C 19 19.987 7.741 -2.146 41 H1' C 19 H1' C 19 16.636 7.938 -1.900 42 H41 C 19 H41 C 19 13.342 3.994 1.636 43 H42 C 19 H42 C 19 13.196 2.809 0.333 44 H5 C 19 H5 C 19 14.473 3.003 -1.720 45 H6 C 19 H6 C 19 15.878 4.499 -3.013 46 H5' A 20 H5' A 20 21.556 6.928 -1.045 47 H5'' A 20 H5" A 20 22.828 5.772 -0.640 48 H4' A 20 H4' A 20 22.164 7.025 1.326 49 H3' A 20 H3' A 20 21.259 4.137 1.437 50 H2' A 20 H2' A 20 20.769 4.586 3.755 51 HO2' A 20 HO2' A 20 21.315 6.507 4.782 52 H1' A 20 H1' A 20 19.410 6.881 3.166 53 H8 A 20 H8 A 20 18.866 4.416 0.292 54 H61 A 20 H61 A 20 14.414 2.119 4.063 55 H62 A 20 H62 A 20 15.030 2.068 2.409 56 H2 A 20 H2 A 20 16.846 4.821 6.398 57 H5' G 21 H5' G 21 23.526 4.687 4.968 58 H5'' G 21 H5" G 21 24.584 3.288 5.193 59 H4' G 21 H4' G 21 23.359 3.638 7.202 60 H3' G 21 H3' G 21 22.202 1.238 5.741 61 H2' G 21 H2' G 21 21.082 0.806 7.829 62 HO2' G 21 HO2' G 21 21.387 2.110 9.670 63 H1' G 21 H1' G 21 20.107 3.344 7.935 64 H8 G 21 H8 G 21 20.524 2.509 4.251 65 H1 G 21 H1 G 21 15.538 -0.467 7.049 66 H21 G 21 H21 G 21 15.765 -0.351 9.247 67 H22 G 21 H22 G 21 17.092 0.577 9.951 68 H5' A 22 H5' A 22 23.163 0.009 9.496 69 H5'' A 22 H5" A 22 24.376 -1.248 9.463 70 H4' A 22 H4' A 22 22.761 -1.884 11.100 71 H3' A 22 H3' A 22 22.434 -3.496 8.565 72 H2' A 22 H2' A 22 20.613 -4.653 9.534 73 HO2' A 22 HO2' A 22 21.701 -4.788 11.687 74 H1' A 22 H1' A 22 19.422 -2.499 10.731 75 H8 A 22 H8 A 22 20.806 -1.423 7.339 76 H61 A 22 H61 A 22 15.480 -3.601 5.017 77 H62 A 22 H62 A 22 16.749 -2.409 4.796 78 H2 A 22 H2 A 22 15.763 -5.010 9.152 79 H5' U 23 H5' U 23 25.899 -6.464 7.745 80 H5'' U 23 H5" U 23 24.595 -6.518 6.562 81 H4' U 23 H4' U 23 24.440 -7.674 9.386 82 H3' U 23 H3' U 23 25.739 -8.798 7.181 83 H2' U 23 H2' U 23 23.929 -8.872 5.781 84 HO2' U 23 HO2' U 23 24.067 -11.281 7.188 85 H1' U 23 H1' U 23 22.158 -9.666 8.103 86 H3 U 23 H3 U 23 18.576 -9.905 5.438 87 H5 U 23 H5 U 23 20.919 -7.029 3.480 88 H6 U 23 H6 U 23 22.515 -7.144 5.330 89 H5' U 25 H5' U 25 26.578 -8.185 12.348 90 H5'' U 25 H5" U 25 26.892 -9.915 12.267 91 H4' U 25 H4' U 25 24.151 -8.765 11.626 92 H3' U 25 H3' U 25 25.035 -8.103 14.059 93 H2' U 25 H2' U 25 26.226 -10.092 14.403 94 HO2' U 25 HO2' U 25 24.815 -9.680 16.290 95 H1' U 25 H1' U 25 23.790 -11.781 13.833 96 H3 U 25 H3 U 25 25.960 -15.310 11.595 97 H5 U 25 H5 U 25 28.654 -13.723 14.366 98 H6 U 25 H6 U 25 27.133 -11.888 14.767 99 H5' G 26 H5' G 26 22.068 -9.674 11.701 100 H5'' G 26 H5" G 26 21.458 -8.623 10.441 101 H4' G 26 H4' G 26 19.971 -9.489 12.856 102 H3' G 26 H3' G 26 19.972 -10.294 9.968 103 H2' G 26 H2' G 26 17.627 -10.594 9.980 104 HO2' G 26 HO2' G 26 17.824 -10.433 12.844 105 H1' G 26 H1' G 26 16.999 -8.322 11.300 106 H8 G 26 H8 G 26 19.967 -7.327 9.320 107 H1 G 26 H1 G 26 14.748 -8.133 5.637 108 H21 G 26 H21 G 26 13.284 -9.384 6.782 109 H22 G 26 H22 G 26 13.620 -9.815 8.461 110 H5' A 27 H5' A 27 17.348 -13.184 11.601 111 H5'' A 27 H5" A 27 17.980 -14.784 11.197 112 H4' A 27 H4' A 27 15.698 -14.730 10.552 113 H3' A 27 H3' A 27 17.509 -14.496 8.131 114 H2' A 27 H2' A 27 15.519 -14.875 6.846 115 HO2' A 27 HO2' A 27 14.595 -16.384 8.599 116 H1' A 27 H1' A 27 14.043 -13.051 8.228 117 H8 A 27 H8 A 27 17.534 -11.616 8.149 118 H61 A 27 H61 A 27 16.381 -10.253 2.161 119 H62 A 27 H62 A 27 17.455 -9.908 3.471 120 H2 A 27 H2 A 27 13.174 -12.845 3.557 121 H5' G 28 H5' G 28 15.176 -17.750 7.226 122 H5'' G 28 H5" G 28 16.086 -19.035 6.432 123 H4' G 28 H4' G 28 14.131 -18.180 5.150 124 H3' G 28 H3' G 28 16.828 -17.864 3.776 125 H2' G 28 H2' G 28 15.555 -17.309 1.854 126 HO2' G 28 HO2' G 28 13.283 -17.388 1.783 127 H1' G 28 H1' G 28 14.018 -15.490 3.159 128 H8 G 28 H8 G 28 17.302 -15.257 4.920 129 H1 G 28 H1 G 28 17.511 -12.938 -1.065 130 H21 G 28 H21 G 28 15.820 -13.852 -2.232 131 H22 G 28 H22 G 28 14.692 -14.914 -1.385 132 H5' C 29 H5' C 29 14.424 -19.739 1.211 133 H5'' C 29 H5" C 29 15.137 -21.184 0.510 134 H4' C 29 H4' C 29 14.274 -19.652 -1.208 135 H3' C 29 H3' C 29 17.269 -20.057 -1.135 136 H2' C 29 H2' C 29 17.281 -18.969 -3.286 137 HO2' C 29 HO2' C 29 15.427 -19.785 -4.292 138 H1' C 29 H1' C 29 15.540 -17.002 -2.531 139 H41 C 29 H41 C 29 21.000 -14.110 -1.763 140 H42 C 29 H42 C 29 21.059 -14.583 -0.074 141 H5 C 29 H5 C 29 19.563 -16.260 0.851 142 H6 C 29 H6 C 29 17.601 -17.624 0.409 143 H5' C 30 H5' C 30 15.729 -21.854 -4.792 144 H5'' C 30 H5" C 30 16.711 -23.230 -5.317 145 H4' C 30 H4' C 30 16.636 -21.427 -7.015 146 H3' C 30 H3' C 30 19.336 -21.920 -5.725 147 H2' C 30 H2' C 30 20.244 -20.356 -7.244 148 HO2' C 30 HO2' C 30 19.208 -19.636 -9.087 149 H1' C 30 H1' C 30 18.097 -18.585 -7.099 150 H41 C 30 H41 C 30 22.594 -16.110 -3.583 151 H42 C 30 H42 C 30 22.364 -17.245 -2.251 152 H5 C 30 H5 C 30 20.667 -19.000 -2.358 153 H6 C 30 H6 C 30 19.077 -20.092 -3.834 154 H5' U 31 H5' U 31 20.193 -22.104 -9.785 155 H5'' U 31 H5" U 31 21.311 -23.428 -10.140 156 H4' U 31 H4' U 31 22.294 -21.290 -10.809 157 H3' U 31 H3' U 31 23.575 -22.606 -8.411 158 H2' U 31 H2' U 31 25.201 -20.897 -8.388 159 HO2' U 31 HO2' U 31 25.539 -19.446 -10.028 160 H1' U 31 H1' U 31 23.447 -18.839 -9.052 161 H3 U 31 H3 U 31 24.425 -17.555 -4.847 162 H5 U 31 H5 U 31 22.963 -21.429 -4.272 163 H6 U 31 H6 U 31 22.538 -21.593 -6.664 164 H5' G 32 H5' G 32 27.754 -23.792 -8.380 165 H5'' G 32 H5" G 32 26.860 -22.308 -8.018 166 H4' G 32 H4' G 32 29.283 -21.954 -8.018 167 H3' G 32 H3' G 32 27.583 -20.479 -9.983 168 H2' G 32 H2' G 32 29.363 -19.660 -11.233 169 HO2' G 32 HO2' G 32 30.839 -18.948 -9.707 170 H1' G 32 H1' G 32 30.914 -21.850 -11.323 171 H8 G 32 H8 G 32 27.354 -20.718 -12.106 172 H1 G 32 H1 G 32 29.457 -25.683 -15.643 173 H21 G 32 H21 G 32 31.388 -26.435 -14.756 174 H22 G 32 H22 G 32 32.050 -25.656 -13.328 175 H5' G 33 H5' G 33 30.584 -17.657 -8.200 176 H5'' G 33 H5" G 33 29.725 -16.188 -7.728 177 H4' G 33 H4' G 33 31.690 -15.678 -9.127 178 H3' G 33 H3' G 33 28.970 -14.840 -9.849 179 H2' G 33 H2' G 33 29.075 -14.902 -12.099 180 HO2' G 33 HO2' G 33 31.154 -13.362 -11.623 181 H1' G 33 H1' G 33 31.529 -16.250 -12.590 182 H8 G 33 H8 G 33 27.958 -17.326 -11.334 183 H1 G 33 H1 G 33 29.851 -19.435 -17.129 184 H21 G 33 H21 G 33 32.004 -18.844 -17.443 185 H22 G 33 H22 G 33 32.847 -17.939 -16.196 186 H5' G 34 H5' G 34 28.932 -11.768 -10.733 187 H5'' G 34 H5" G 34 29.232 -10.395 -9.680 188 H4' G 34 H4' G 34 27.120 -10.357 -10.979 189 H3' G 34 H3' G 34 26.606 -10.058 -7.969 190 H2' G 34 H2' G 34 24.439 -9.794 -8.450 191 HO2' G 34 HO2' G 34 23.551 -9.593 -10.476 192 H1' G 34 H1' G 34 24.209 -11.972 -10.023 193 H8 G 34 H8 G 34 26.900 -11.831 -7.137 194 H1 G 34 H1 G 34 21.908 -15.770 -6.219 195 H21 G 34 H21 G 34 20.657 -15.787 -8.012 196 H22 G 34 H22 G 34 20.990 -14.710 -9.373 197 H5' A 35 H5' A 35 28.657 -5.001 -8.070 198 H5'' A 35 H5" A 35 27.268 -4.811 -7.014 199 H4' A 35 H4' A 35 26.484 -3.832 -8.881 200 H3' A 35 H3' A 35 25.564 -6.691 -9.161 201 H2' A 35 H2' A 35 24.655 -6.167 -11.255 202 HO2' A 35 HO2' A 35 23.731 -4.101 -10.349 203 H1' A 35 H1' A 35 26.571 -4.280 -12.042 204 H8 A 35 H8 A 35 25.857 -7.961 -11.669 205 H61 A 35 H61 A 35 30.604 -8.651 -15.705 206 H62 A 35 H62 A 35 29.298 -9.545 -14.920 207 H2 A 35 H2 A 35 30.571 -4.545 -14.440 208 H5' G 36 H5' G 36 22.901 -7.115 -10.022 209 H5'' G 36 H5" G 36 21.690 -6.228 -9.092 210 H4' G 36 H4' G 36 20.842 -8.253 -10.323 211 H3' G 36 H3' G 36 20.487 -8.025 -7.342 212 H2' G 36 H2' G 36 19.101 -9.974 -7.506 213 HO2' G 36 HO2' G 36 18.313 -10.799 -9.401 214 H1' G 36 H1' G 36 20.779 -11.376 -9.128 215 H8 G 36 H8 G 36 23.127 -9.635 -6.858 216 H1 G 36 H1 G 36 19.844 -14.365 -3.890 217 H21 G 36 H21 G 36 18.212 -15.037 -5.202 218 H22 G 36 H22 G 36 18.018 -14.347 -6.814 219 H5' C 37 H5' C 37 16.752 -8.714 -9.123 220 H5'' C 37 H5" C 37 15.372 -7.880 -8.425 221 H4' C 37 H4' C 37 15.098 -10.327 -8.453 222 H3' C 37 H3' C 37 15.299 -9.115 -5.696 223 H2' C 37 H2' C 37 14.514 -11.272 -4.936 224 HO2' C 37 HO2' C 37 13.870 -12.914 -6.324 225 H1' C 37 H1' C 37 16.323 -12.630 -6.448 226 H41 C 37 H41 C 37 19.311 -11.957 -0.962 227 H42 C 37 H42 C 37 20.330 -10.792 -1.774 228 H5 C 37 H5 C 37 19.708 -9.652 -3.782 229 H6 C 37 H6 C 37 18.180 -9.703 -5.680 230 H5' U 38 H5' U 38 11.722 -11.293 -5.859 231 H5'' U 38 H5" U 38 10.366 -10.344 -5.244 232 H4' U 38 H4' U 38 10.406 -12.529 -4.186 233 H3' U 38 H3' U 38 11.087 -10.200 -2.368 234 H2' U 38 H2' U 38 11.002 -11.693 -0.542 235 HO2' U 38 HO2' U 38 9.176 -13.000 -1.615 236 H1' U 38 H1' U 38 12.507 -13.630 -1.750 237 H3 U 38 H3 U 38 14.898 -11.400 1.467 238 H5 U 38 H5 U 38 15.727 -9.444 -2.139 239 H6 U 38 H6 U 38 13.877 -10.632 -3.155 240 H5' C 39 H5' C 39 8.447 -11.688 0.146 241 H5'' C 39 H5" C 39 7.231 -10.451 0.495 242 H4' C 39 H4' C 39 8.201 -11.151 2.539 243 H3' C 39 H3' C 39 9.445 -8.453 1.876 244 H2' C 39 H2' C 39 10.005 -8.500 4.192 245 HO2' C 39 HO2' C 39 9.159 -9.877 5.635 246 H1' C 39 H1' C 39 10.910 -11.101 3.986 247 H41 C 39 H41 C 39 15.795 -7.177 3.546 248 H42 C 39 H42 C 39 15.659 -7.098 1.790 249 H5 C 39 H5 C 39 13.757 -8.064 0.594 250 H6 C 39 H6 C 39 11.745 -9.439 0.853 251 H5' U 40 H5' U 40 7.078 -8.355 5.281 252 H5'' U 40 H5" U 40 6.335 -6.798 5.664 253 H4' U 40 H4' U 40 7.696 -7.713 7.528 254 H3' U 40 H3' U 40 8.664 -5.137 6.274 255 H2' U 40 H2' U 40 10.190 -5.008 8.158 256 HO2' U 40 HO2' U 40 8.526 -6.109 9.637 257 H1' U 40 H1' U 40 11.001 -7.597 7.907 258 H3 U 40 H3 U 40 14.414 -4.919 6.432 259 H5 U 40 H5 U 40 11.874 -5.298 3.120 260 H6 U 40 H6 U 40 10.243 -6.427 4.520 261 H5' C 41 H5' C 41 8.135 -4.349 10.358 262 H5'' C 41 H5" C 41 7.469 -2.744 10.653 263 H4' C 41 H4' C 41 9.613 -3.133 11.817 264 H3' C 41 H3' C 41 9.597 -0.979 9.700 265 H2' C 41 H2' C 41 11.808 -0.392 10.497 266 HO2' C 41 HO2' C 41 11.158 -0.994 12.814 267 H1' C 41 H1' C 41 12.701 -2.970 10.592 268 H41 C 41 H41 C 41 14.479 -1.014 4.941 269 H42 C 41 H42 C 41 13.039 -1.653 4.170 270 H5 C 41 H5 C 41 11.116 -2.386 5.524 271 H6 C 41 H6 C 41 10.373 -2.828 7.797 272 H5' U 42 H5' U 42 11.093 1.018 13.183 273 H5'' U 42 H5" U 42 10.277 2.578 13.328 274 H4' U 42 H4' U 42 12.672 2.900 13.317 275 H3' U 42 H3' U 42 11.351 3.838 10.757 276 H2' U 42 H2' U 42 13.480 4.863 10.248 277 HO2' U 42 HO2' U 42 13.895 5.355 12.631 278 H1' U 42 H1' U 42 14.907 2.625 10.912 279 H3 U 42 H3 U 42 14.954 2.908 6.355 280 H5 U 42 H5 U 42 11.267 1.152 7.224 281 H6 U 42 H6 U 42 11.639 1.616 9.586 282 H5' G 43 H5' G 43 13.445 7.296 12.041 283 H5'' G 43 H5" G 43 12.367 8.685 11.868 284 H4' G 43 H4' G 43 14.442 9.093 10.695 285 H3' G 43 H3' G 43 12.120 8.621 8.808 286 H2' G 43 H2' G 43 13.600 9.416 7.095 287 HO2' G 43 HO2' G 43 15.589 10.358 7.510 288 H1' G 43 H1' G 43 15.718 7.891 7.971 289 H8 G 43 H8 G 43 12.563 5.833 8.404 290 H1 G 43 H1 G 43 14.642 6.222 2.310 291 H21 G 43 H21 G 43 16.115 7.851 2.155 292 H22 G 43 H22 G 43 16.643 8.731 3.596 293 H5' C 44 H5' C 44 13.665 12.324 7.757 294 H5'' C 44 H5" C 44 12.408 13.493 7.342 295 H4' C 44 H4' C 44 14.025 13.198 5.521 296 H3' C 44 H3' C 44 11.252 12.162 4.875 297 H2' C 44 H2' C 44 12.054 11.978 2.621 298 HO2' C 44 HO2' C 44 13.957 12.837 1.905 299 H1' C 44 H1' C 44 14.397 10.765 3.364 300 H41 C 44 H41 C 44 10.523 6.082 2.030 301 H42 C 44 H42 C 44 9.793 6.048 3.626 302 H5 C 44 H5 C 44 10.376 7.775 5.303 303 H6 C 44 H6 C 44 11.765 9.738 5.703 304 H5' C 45 H5' C 45 12.293 14.983 1.916 305 H5'' C 45 H5" C 45 10.913 15.945 1.379 306 H4' C 45 H4' C 45 12.018 14.806 -0.485 307 H3' C 45 H3' C 45 9.224 13.783 0.097 308 H2' C 45 H2' C 45 9.436 12.581 -1.991 309 HO2' C 45 HO2' C 45 10.817 14.412 -2.952 310 H1' C 45 H1' C 45 11.933 11.642 -1.415 311 H41 C 45 H41 C 45 8.048 7.174 0.523 312 H42 C 45 H42 C 45 7.862 7.893 2.127 313 H5 C 45 H5 C 45 8.760 10.105 2.639 314 H6 C 45 H6 C 45 10.077 11.943 1.744 315 H5' C 46 H5' C 46 9.090 14.674 -4.002 316 H5'' C 46 H5" C 46 7.588 15.521 -4.380 317 H4' C 46 H4' C 46 7.834 13.526 -5.761 318 H3' C 46 H3' C 46 5.613 13.341 -3.709 319 HO3' C 46 HO3' C 46 4.388 13.863 -5.679 320 H2' C 46 H2' C 46 4.942 11.339 -4.796 321 HO2' C 46 HO2' C 46 5.741 10.664 -6.801 322 H1' C 46 H1' C 46 7.537 10.383 -5.115 323 H41 C 46 H41 C 46 4.933 7.600 -0.140 324 H42 C 46 H42 C 46 5.259 8.970 0.928 325 H5 C 46 H5 C 46 6.282 11.024 0.095 326 H6 C 46 H6 C 46 7.125 12.135 -1.906 327 H1 GLY 44 H1 GLY 44 35.610 -6.435 2.910 328 H2 GLY 44 H2 GLY 44 34.175 -6.195 3.664 329 H3 GLY 44 H3 GLY 44 34.332 -5.855 2.068 330 HA2 GLY 44 HA2 GLY 44 34.509 -8.543 3.267 331 HA3 GLY 44 HA3 GLY 44 33.115 -7.915 2.369 332 H ILE 45 H ILE 45 34.294 -10.250 1.590 333 HA ILE 45 HA ILE 45 35.629 -9.574 -1.002 334 HB ILE 45 HB ILE 45 36.985 -11.671 -0.720 335 HG12 ILE 45 HG12 ILE 45 37.516 -12.480 1.517 336 HG13 ILE 45 HG13 ILE 45 36.282 -11.461 2.244 337 HG21 ILE 45 HG21 ILE 45 37.528 -9.479 1.313 338 HG22 ILE 45 HG22 ILE 45 38.705 -10.585 0.584 339 HG23 ILE 45 HG23 ILE 45 37.882 -9.389 -0.426 340 HD11 ILE 45 HD11 ILE 45 35.712 -13.716 0.268 341 HD12 ILE 45 HD12 ILE 45 35.645 -13.869 2.035 342 HD13 ILE 45 HD13 ILE 45 34.511 -12.793 1.213 343 H SER 46 H SER 46 32.798 -10.616 0.038 344 HA SER 46 HA SER 46 32.187 -12.063 -2.414 345 HB2 SER 46 HB2 SER 46 33.020 -13.840 -0.751 346 HB3 SER 46 HB3 SER 46 31.602 -13.445 0.234 347 HG SER 46 HG SER 46 31.759 -14.616 -2.347 348 H TYR 47 H TYR 47 29.752 -12.579 -2.436 349 HA TYR 47 HA TYR 47 28.140 -10.543 -0.979 350 HB2 TYR 47 HB2 TYR 47 28.352 -10.736 -4.010 351 HB3 TYR 47 HB3 TYR 47 27.249 -9.695 -3.127 352 HD1 TYR 47 HD1 TYR 47 28.184 -7.848 -1.630 353 HD2 TYR 47 HD2 TYR 47 30.601 -10.022 -4.470 354 HE1 TYR 47 HE1 TYR 47 29.907 -6.054 -1.535 355 HE2 TYR 47 HE2 TYR 47 32.331 -8.229 -4.363 356 HH TYR 47 HH TYR 47 31.942 -5.325 -2.294 357 H GLY 48 H GLY 48 25.880 -10.746 -1.237 358 HA2 GLY 48 HA2 GLY 48 24.469 -12.822 -2.588 359 HA3 GLY 48 HA3 GLY 48 24.832 -13.368 -0.944 360 H ARG 49 H ARG 49 24.061 -10.093 -2.093 361 HA ARG 49 HA ARG 49 21.498 -9.854 -0.649 362 HB2 ARG 49 HB2 ARG 49 23.997 -8.281 0.126 363 HB3 ARG 49 HB3 ARG 49 22.369 -7.859 0.634 364 HG2 ARG 49 HG2 ARG 49 23.869 -10.383 1.423 365 HG3 ARG 49 HG3 ARG 49 23.558 -8.961 2.416 366 HD2 ARG 49 HD2 ARG 49 21.085 -9.386 2.173 367 HD3 ARG 49 HD3 ARG 49 21.461 -10.896 1.345 368 HE ARG 49 HE ARG 49 22.781 -10.598 3.944 369 HH11 ARG 49 HH11 ARG 49 19.867 -12.001 2.357 370 HH12 ARG 49 HH12 ARG 49 19.585 -13.021 3.596 371 HH21 ARG 49 HH21 ARG 49 22.275 -11.863 5.593 372 HH22 ARG 49 HH22 ARG 49 20.881 -12.901 5.539 373 H LYS 50 H LYS 50 20.746 -7.493 -0.871 374 HA LYS 50 HA LYS 50 21.712 -6.120 -3.328 375 HB2 LYS 50 HB2 LYS 50 19.455 -5.771 -4.144 376 HB3 LYS 50 HB3 LYS 50 19.866 -7.470 -4.137 377 HG2 LYS 50 HG2 LYS 50 18.500 -7.852 -2.133 378 HG3 LYS 50 HG3 LYS 50 18.176 -6.125 -1.961 379 HD2 LYS 50 HD2 LYS 50 17.349 -7.777 -4.379 380 HD3 LYS 50 HD3 LYS 50 16.302 -7.469 -2.987 381 HE2 LYS 50 HE2 LYS 50 16.247 -5.109 -3.401 382 HE3 LYS 50 HE3 LYS 50 17.523 -5.225 -4.620 383 HZ1 LYS 50 HZ1 LYS 50 16.060 -6.512 -6.013 384 HZ2 LYS 50 HZ2 LYS 50 14.843 -6.490 -4.918 385 HZ3 LYS 50 HZ3 LYS 50 15.325 -5.097 -5.649 386 H LYS 51 H LYS 51 20.486 -3.996 -3.584 387 HA LYS 51 HA LYS 51 20.867 -2.229 -1.359 388 HB2 LYS 51 HB2 LYS 51 19.044 -1.858 -3.789 389 HB3 LYS 51 HB3 LYS 51 19.547 -0.616 -2.654 390 HG2 LYS 51 HG2 LYS 51 21.019 -0.180 -4.319 391 HG3 LYS 51 HG3 LYS 51 22.003 -1.297 -3.372 392 HD2 LYS 51 HD2 LYS 51 21.383 -3.139 -4.954 393 HD3 LYS 51 HD3 LYS 51 20.339 -2.011 -5.842 394 HE2 LYS 51 HE2 LYS 51 22.337 -0.601 -6.341 395 HE3 LYS 51 HE3 LYS 51 23.355 -1.758 -5.469 396 HZ1 LYS 51 HZ1 LYS 51 21.778 -2.359 -7.914 397 HZ2 LYS 51 HZ2 LYS 51 23.408 -2.243 -7.828 398 HZ3 LYS 51 HZ3 LYS 51 22.630 -3.472 -7.069 399 H ARG 52 H ARG 52 19.570 -1.615 0.273 400 HA ARG 52 HA ARG 52 17.331 -3.241 1.095 401 HB2 ARG 52 HB2 ARG 52 18.029 -0.465 2.124 402 HB3 ARG 52 HB3 ARG 52 17.165 -1.749 2.959 403 HG2 ARG 52 HG2 ARG 52 20.142 -1.702 2.304 404 HG3 ARG 52 HG3 ARG 52 19.387 -1.448 3.866 405 HD2 ARG 52 HD2 ARG 52 18.446 -3.824 3.657 406 HD3 ARG 52 HD3 ARG 52 19.552 -4.043 2.295 407 HE ARG 52 HE ARG 52 21.368 -3.274 4.009 408 HH11 ARG 52 HH11 ARG 52 18.626 -5.290 4.980 409 HH12 ARG 52 HH12 ARG 52 19.387 -5.773 6.427 410 HH21 ARG 52 HH21 ARG 52 22.313 -4.008 5.964 411 HH22 ARG 52 HH22 ARG 52 21.285 -4.854 7.059 412 H ARG 53 H ARG 53 15.103 -2.523 1.481 413 HA ARG 53 HA ARG 53 14.098 -0.304 -0.215 414 HB2 ARG 53 HB2 ARG 53 12.670 -1.625 -1.555 415 HB3 ARG 53 HB3 ARG 53 14.244 -2.377 -1.629 416 HG2 ARG 53 HG2 ARG 53 13.128 -4.303 -1.280 417 HG3 ARG 53 HG3 ARG 53 13.130 -3.846 0.422 418 HD2 ARG 53 HD2 ARG 53 10.897 -2.703 0.034 419 HD3 ARG 53 HD3 ARG 53 10.914 -3.300 -1.622 420 HE ARG 53 HE ARG 53 10.254 -4.771 0.803 421 HH11 ARG 53 HH11 ARG 53 11.365 -5.408 -2.522 422 HH12 ARG 53 HH12 ARG 53 10.519 -6.951 -2.490 423 HH21 ARG 53 HH21 ARG 53 9.241 -6.679 0.596 424 HH22 ARG 53 HH22 ARG 53 9.510 -7.648 -0.859 425 H GLN 54 H GLN 54 11.857 0.259 0.144 426 HA GLN 54 HA GLN 54 10.826 -0.597 2.822 427 HB2 GLN 54 HB2 GLN 54 11.900 1.696 2.825 428 HB3 GLN 54 HB3 GLN 54 10.642 2.221 1.697 429 HG2 GLN 54 HG2 GLN 54 8.910 1.491 3.420 430 HG3 GLN 54 HG3 GLN 54 10.239 1.143 4.531 431 HE21 GLN 54 HE21 GLN 54 10.995 4.676 4.976 432 HE22 GLN 54 HE22 GLN 54 11.692 3.125 5.094 433 H ARG 55 H ARG 55 8.796 -1.100 2.954 434 HA ARG 55 HA ARG 55 6.735 -0.263 1.008 435 HB2 ARG 55 HB2 ARG 55 7.427 -3.157 1.695 436 HB3 ARG 55 HB3 ARG 55 5.799 -2.690 1.198 437 HG2 ARG 55 HG2 ARG 55 6.703 -1.679 -0.879 438 HG3 ARG 55 HG3 ARG 55 8.317 -2.289 -0.457 439 HD2 ARG 55 HD2 ARG 55 7.503 -4.583 -0.485 440 HD3 ARG 55 HD3 ARG 55 5.841 -4.034 -0.781 441 HE ARG 55 HE ARG 55 7.054 -2.900 -2.889 442 HH11 ARG 55 HH11 ARG 55 7.332 -6.183 -1.718 443 HH12 ARG 55 HH12 ARG 55 7.839 -6.826 -3.244 444 HH21 ARG 55 HH21 ARG 55 7.432 -3.784 -4.903 445 HH22 ARG 55 HH22 ARG 55 7.798 -5.489 -5.046 446 H ARG 56 H ARG 56 4.565 -1.323 2.051 447 HA ARG 56 HA ARG 56 4.509 -0.664 4.962 448 HB2 ARG 56 HB2 ARG 56 2.589 0.507 2.885 449 HB3 ARG 56 HB3 ARG 56 2.509 0.707 4.633 450 HG2 ARG 56 HG2 ARG 56 3.548 2.681 4.101 451 HG3 ARG 56 HG3 ARG 56 4.959 1.671 4.379 452 HD2 ARG 56 HD2 ARG 56 4.691 1.255 1.710 453 HD3 ARG 56 HD3 ARG 56 3.816 2.777 1.815 454 HE ARG 56 HE ARG 56 6.274 3.127 3.190 455 HH11 ARG 56 HH11 ARG 56 5.186 2.717 -0.117 456 HH12 ARG 56 HH12 ARG 56 6.673 3.347 -0.779 457 HH21 ARG 56 HH21 ARG 56 8.082 4.067 2.260 458 HH22 ARG 56 HH22 ARG 56 8.080 4.356 0.533 459 H ARG 57 H ARG 57 3.003 -1.729 6.139 460 HA ARG 57 HA ARG 57 1.618 -4.051 4.837 461 HB2 ARG 57 HB2 ARG 57 4.007 -4.300 5.967 462 HB3 ARG 57 HB3 ARG 57 3.106 -4.209 7.471 463 HG2 ARG 57 HG2 ARG 57 3.428 -6.500 7.033 464 HG3 ARG 57 HG3 ARG 57 1.740 -6.219 6.619 465 HD2 ARG 57 HD2 ARG 57 2.440 -6.046 4.189 466 HD3 ARG 57 HD3 ARG 57 4.090 -6.439 4.697 467 HE ARG 57 HE ARG 57 1.857 -8.283 5.411 468 HH11 ARG 57 HH11 ARG 57 4.755 -7.882 3.398 469 HH12 ARG 57 HH12 ARG 57 4.826 -9.592 3.096 470 HH21 ARG 57 HH21 ARG 57 2.044 -10.415 4.921 471 HH22 ARG 57 HH22 ARG 57 3.331 -10.967 3.891 472 H ALA 58 H ALA 58 0.651 -1.412 6.148 473 HA ALA 58 HA ALA 58 -1.641 -2.599 7.575 474 HB1 ALA 58 HB1 ALA 58 0.151 -0.457 8.816 475 HB2 ALA 58 HB2 ALA 58 -1.368 -1.072 9.503 476 HB3 ALA 58 HB3 ALA 58 0.030 -2.148 9.354 477 H HIS 59 H HIS 59 -3.351 -0.994 7.979 478 HA HIS 59 HA HIS 59 -3.416 1.327 6.097 479 HB2 HIS 59 HB2 HIS 59 -4.250 -0.855 5.072 480 HB3 HIS 59 HB3 HIS 59 -5.567 -0.817 6.239 481 HD2 HIS 59 HD2 HIS 59 -7.714 0.102 5.132 482 HE1 HIS 59 HE1 HIS 59 -6.034 2.880 2.362 483 HE2 HIS 59 HE2 HIS 59 -8.203 1.870 3.236 484 H GLN 60 H GLN 60 -3.458 0.842 9.161 485 HA GLN 60 HA GLN 60 -5.466 2.862 9.836 486 HB2 GLN 60 HB2 GLN 60 -6.539 1.530 11.579 487 HB3 GLN 60 HB3 GLN 60 -6.805 0.834 9.984 488 HG2 GLN 60 HG2 GLN 60 -5.063 -0.893 10.439 489 HG3 GLN 60 HG3 GLN 60 -4.759 -0.162 12.015 490 HE21 GLN 60 HE21 GLN 60 -7.089 -2.473 13.367 491 HE22 GLN 60 HE22 GLN 60 -5.449 -1.834 13.403 Start of MODEL 3 1 H5' G 16 H5' G 16 0.970 -1.831 -3.180 2 H5'' G 16 H5" G 16 2.503 -2.606 -3.599 3 H4' G 16 H4' G 16 1.958 -0.938 -5.256 4 H3' G 16 H3' G 16 4.252 -0.088 -3.482 5 H2' G 16 H2' G 16 4.549 1.750 -4.997 6 HO2' G 16 HO2' G 16 3.396 1.962 -6.932 7 H1' G 16 H1' G 16 1.915 2.432 -5.006 8 H8 G 16 H8 G 16 2.514 1.137 -1.546 9 H1 G 16 H1 G 16 5.054 6.982 -2.569 10 H21 G 16 H21 G 16 5.188 7.314 -4.760 11 H22 G 16 H22 G 16 4.493 6.142 -5.886 12 HO5' G 16 HO5' G 16 2.331 -2.070 -1.334 13 H5' G 17 H5' G 17 5.594 0.436 -7.430 14 H5'' G 17 H5" G 17 7.194 -0.287 -7.614 15 H4' G 17 H4' G 17 7.257 1.981 -8.430 16 H3' G 17 H3' G 17 8.678 1.643 -5.779 17 H2' G 17 H2' G 17 9.601 3.822 -6.188 18 HO2' G 17 HO2' G 17 9.307 4.946 -8.115 19 H1' G 17 H1' G 17 7.159 4.886 -6.788 20 H8 G 17 H8 G 17 6.520 2.227 -4.176 21 H1 G 17 H1 G 17 9.074 7.678 -1.848 22 H21 G 17 H21 G 17 9.920 8.844 -3.538 23 H22 G 17 H22 G 17 9.700 8.284 -5.199 24 H5' G 18 H5' G 18 11.492 3.161 -8.385 25 H5'' G 18 H5" G 18 13.074 2.400 -8.198 26 H4' G 18 H4' G 18 13.179 4.850 -8.045 27 H3' G 18 H3' G 18 13.911 3.355 -5.519 28 H2' G 18 H2' G 18 14.592 5.489 -4.630 29 HO2' G 18 HO2' G 18 15.384 6.208 -6.868 30 H1' G 18 H1' G 18 12.376 6.826 -5.478 31 H8 G 18 H8 G 18 11.186 3.371 -4.486 32 H1 G 18 H1 G 18 12.244 7.370 0.469 33 H21 G 18 H21 G 18 13.506 9.050 -0.242 34 H22 G 18 H22 G 18 13.894 9.207 -1.960 35 H5' C 19 H5' C 19 17.274 5.903 -6.152 36 H5'' C 19 H5" C 19 18.759 5.013 -5.802 37 H4' C 19 H4' C 19 18.574 7.026 -4.422 38 H3' C 19 H3' C 19 18.288 4.455 -2.856 39 H2' C 19 H2' C 19 18.492 5.851 -0.895 40 HO2' C 19 HO2' C 19 19.047 8.008 -0.966 41 H1' C 19 H1' C 19 16.688 7.698 -1.836 42 H41 C 19 H41 C 19 13.393 3.702 1.683 43 H42 C 19 H42 C 19 13.273 2.519 0.375 44 H5 C 19 H5 C 19 14.503 2.762 -1.697 45 H6 C 19 H6 C 19 15.873 4.289 -2.999 46 H5' A 20 H5' A 20 21.479 6.641 -1.012 47 H5'' A 20 H5" A 20 22.777 5.533 -0.553 48 H4' A 20 H4' A 20 22.100 6.876 1.348 49 H3' A 20 H3' A 20 21.266 3.975 1.624 50 H2' A 20 H2' A 20 20.735 4.526 3.900 51 HO2' A 20 HO2' A 20 21.210 6.520 4.836 52 H1' A 20 H1' A 20 19.307 6.740 3.195 53 H8 A 20 H8 A 20 18.880 4.188 0.383 54 H61 A 20 H61 A 20 14.528 1.754 4.141 55 H62 A 20 H62 A 20 15.177 1.717 2.495 56 H2 A 20 H2 A 20 16.783 4.641 6.459 57 H5' G 21 H5' G 21 23.508 4.699 5.181 58 H5'' G 21 H5" G 21 24.625 3.345 5.394 59 H4' G 21 H4' G 21 23.445 3.637 7.419 60 H3' G 21 H3' G 21 22.303 1.212 5.984 61 H2' G 21 H2' G 21 21.228 0.767 8.107 62 HO2' G 21 HO2' G 21 23.112 1.816 9.367 63 H1' G 21 H1' G 21 20.214 3.273 8.249 64 H8 G 21 H8 G 21 20.596 2.465 4.543 65 H1 G 21 H1 G 21 15.634 -0.546 7.355 66 H21 G 21 H21 G 21 15.760 -0.310 9.544 67 H22 G 21 H22 G 21 17.079 0.621 10.255 68 H5' A 22 H5' A 22 23.323 -0.095 9.733 69 H5'' A 22 H5" A 22 24.573 -1.308 9.631 70 H4' A 22 H4' A 22 23.015 -2.056 11.274 71 H3' A 22 H3' A 22 22.630 -3.578 8.693 72 H2' A 22 H2' A 22 20.828 -4.769 9.660 73 HO2' A 22 HO2' A 22 21.881 -5.033 11.789 74 H1' A 22 H1' A 22 19.658 -2.662 10.947 75 H8 A 22 H8 A 22 21.002 -1.500 7.560 76 H61 A 22 H61 A 22 15.798 -3.835 5.178 77 H62 A 22 H62 A 22 17.071 -2.637 4.968 78 H2 A 22 H2 A 22 16.000 -5.147 9.357 79 H5' U 23 H5' U 23 26.213 -6.352 7.734 80 H5'' U 23 H5" U 23 25.002 -6.183 6.462 81 H4' U 23 H4' U 23 24.478 -7.526 9.145 82 H3' U 23 H3' U 23 25.937 -8.661 6.991 83 H2' U 23 H2' U 23 24.138 -8.674 5.517 84 HO2' U 23 HO2' U 23 24.251 -11.062 6.941 85 H1' U 23 H1' U 23 22.372 -9.333 7.900 86 H3 U 23 H3 U 23 18.737 -9.831 5.320 87 H5 U 23 H5 U 23 20.939 -6.966 3.186 88 H6 U 23 H6 U 23 22.622 -7.009 4.967 89 H5' U 25 H5' U 25 24.845 -8.528 10.932 90 H5'' U 25 H5" U 25 26.560 -8.180 11.237 91 H4' U 25 H4' U 25 24.932 -9.995 13.042 92 H3' U 25 H3' U 25 24.404 -7.220 12.650 93 H2' U 25 H2' U 25 26.359 -6.548 13.715 94 HO2' U 25 HO2' U 25 24.271 -6.260 15.218 95 H1' U 25 H1' U 25 25.988 -8.971 15.518 96 H3 U 25 H3 U 25 30.294 -9.730 17.024 97 H5 U 25 H5 U 25 30.096 -5.650 16.129 98 H6 U 25 H6 U 25 27.937 -6.006 15.082 99 H5' G 26 H5' G 26 22.133 -9.507 12.166 100 H5'' G 26 H5" G 26 21.592 -8.457 10.864 101 H4' G 26 H4' G 26 19.889 -9.394 13.104 102 H3' G 26 H3' G 26 20.106 -10.218 10.205 103 H2' G 26 H2' G 26 17.771 -10.570 10.141 104 HO2' G 26 HO2' G 26 17.844 -11.359 12.534 105 H1' G 26 H1' G 26 17.067 -8.273 11.390 106 H8 G 26 H8 G 26 20.099 -7.271 9.494 107 H1 G 26 H1 G 26 15.033 -8.299 5.657 108 H21 G 26 H21 G 26 13.559 -9.554 6.809 109 H22 G 26 H22 G 26 13.842 -9.891 8.518 110 H5' A 27 H5' A 27 17.436 -13.210 11.714 111 H5'' A 27 H5" A 27 18.150 -14.778 11.324 112 H4' A 27 H4' A 27 15.897 -14.753 10.522 113 H3' A 27 H3' A 27 17.881 -14.471 8.247 114 H2' A 27 H2' A 27 16.024 -14.920 6.829 115 HO2' A 27 HO2' A 27 14.021 -15.605 7.564 116 H1' A 27 H1' A 27 14.367 -13.164 8.155 117 H8 A 27 H8 A 27 17.772 -11.522 8.120 118 H61 A 27 H61 A 27 16.663 -10.513 2.031 119 H62 A 27 H62 A 27 17.692 -10.023 3.331 120 H2 A 27 H2 A 27 13.584 -13.180 3.489 121 H5' G 28 H5' G 28 15.668 -17.847 7.447 122 H5'' G 28 H5" G 28 16.581 -19.148 6.679 123 H4' G 28 H4' G 28 14.581 -18.386 5.406 124 H3' G 28 H3' G 28 17.246 -18.056 3.983 125 H2' G 28 H2' G 28 15.948 -17.534 2.064 126 HO2' G 28 HO2' G 28 13.692 -17.673 1.991 127 H1' G 28 H1' G 28 14.383 -15.735 3.351 128 H8 G 28 H8 G 28 17.693 -15.387 5.056 129 H1 G 28 H1 G 28 17.649 -13.042 -0.929 130 H21 G 28 H21 G 28 15.921 -13.960 -2.033 131 H22 G 28 H22 G 28 14.820 -15.016 -1.144 132 H5' C 29 H5' C 29 14.739 -20.067 1.533 133 H5'' C 29 H5" C 29 15.473 -21.442 0.724 134 H4' C 29 H4' C 29 14.412 -19.834 -0.839 135 H3' C 29 H3' C 29 17.397 -20.247 -1.049 136 H2' C 29 H2' C 29 17.233 -19.036 -3.130 137 HO2' C 29 HO2' C 29 15.294 -19.790 -4.016 138 H1' C 29 H1' C 29 15.583 -17.106 -2.138 139 H41 C 29 H41 C 29 21.160 -14.358 -1.661 140 H42 C 29 H42 C 29 21.529 -15.222 -0.169 141 H5 C 29 H5 C 29 19.918 -16.652 0.914 142 H6 C 29 H6 C 29 17.849 -17.878 0.603 143 H5' C 30 H5' C 30 15.557 -21.823 -4.653 144 H5'' C 30 H5" C 30 16.486 -23.148 -5.372 145 H4' C 30 H4' C 30 16.281 -21.170 -6.876 146 H3' C 30 H3' C 30 19.066 -21.842 -5.898 147 H2' C 30 H2' C 30 19.879 -20.152 -7.357 148 HO2' C 30 HO2' C 30 18.595 -19.125 -8.926 149 H1' C 30 H1' C 30 17.847 -18.349 -6.770 150 H41 C 30 H41 C 30 22.645 -16.324 -3.451 151 H42 C 30 H42 C 30 22.398 -17.439 -2.120 152 H5 C 30 H5 C 30 20.709 -19.259 -2.312 153 H6 C 30 H6 C 30 18.986 -20.186 -3.764 154 H5' U 31 H5' U 31 19.783 -21.304 -9.838 155 H5'' U 31 H5" U 31 20.768 -22.619 -10.479 156 H4' U 31 H4' U 31 21.920 -20.512 -10.818 157 H3' U 31 H3' U 31 23.134 -22.334 -8.736 158 H2' U 31 H2' U 31 24.968 -20.846 -8.566 159 HO2' U 31 HO2' U 31 24.878 -20.535 -11.023 160 H1' U 31 H1' U 31 23.451 -18.509 -8.820 161 H3 U 31 H3 U 31 24.680 -17.987 -4.493 162 H5 U 31 H5 U 31 22.662 -21.644 -4.420 163 H6 U 31 H6 U 31 22.238 -21.423 -6.812 164 H5' G 32 H5' G 32 27.248 -23.795 -9.541 165 H5'' G 32 H5" G 32 26.669 -22.297 -8.779 166 H4' G 32 H4' G 32 29.151 -22.479 -9.424 167 H3' G 32 H3' G 32 27.349 -20.189 -9.812 168 H2' G 32 H2' G 32 28.602 -19.051 -11.444 169 HO2' G 32 HO2' G 32 30.691 -20.071 -10.166 170 H1' G 32 H1' G 32 29.488 -21.139 -12.955 171 H8 G 32 H8 G 32 26.654 -19.043 -12.339 172 H1 G 32 H1 G 32 24.957 -24.016 -16.075 173 H21 G 32 H21 G 32 26.612 -25.544 -16.045 174 H22 G 32 H22 G 32 28.045 -25.255 -15.073 175 H5' G 33 H5' G 33 30.633 -17.988 -9.735 176 H5'' G 33 H5" G 33 30.604 -16.739 -8.506 177 H4' G 33 H4' G 33 30.831 -15.929 -10.886 178 H3' G 33 H3' G 33 28.595 -15.002 -9.101 179 H2' G 33 H2' G 33 27.997 -13.415 -10.773 180 HO2' G 33 HO2' G 33 30.244 -12.872 -11.399 181 H1' G 33 H1' G 33 28.173 -15.139 -12.875 182 H8 G 33 H8 G 33 26.824 -17.270 -10.182 183 H1 G 33 H1 G 33 22.572 -12.838 -12.175 184 H21 G 33 H21 G 33 23.693 -11.272 -13.351 185 H22 G 33 H22 G 33 25.415 -11.465 -13.628 186 H5' G 34 H5' G 34 28.857 -10.267 -7.773 187 H5'' G 34 H5" G 34 27.843 -11.657 -7.372 188 H4' G 34 H4' G 34 27.563 -10.286 -9.982 189 H3' G 34 H3' G 34 26.337 -9.393 -7.362 190 H2' G 34 H2' G 34 24.218 -9.379 -8.077 191 HO2' G 34 HO2' G 34 23.542 -9.457 -10.204 192 H1' G 34 H1' G 34 24.150 -11.709 -9.406 193 H8 G 34 H8 G 34 26.237 -10.928 -6.130 194 H1 G 34 H1 G 34 22.045 -15.782 -5.795 195 H21 G 34 H21 G 34 20.930 -15.922 -7.676 196 H22 G 34 H22 G 34 21.369 -14.909 -9.052 197 H5' A 35 H5' A 35 28.090 -4.248 -8.037 198 H5'' A 35 H5" A 35 27.028 -5.477 -7.367 199 H4' A 35 H4' A 35 25.870 -3.578 -8.489 200 H3' A 35 H3' A 35 25.305 -6.408 -9.152 201 H2' A 35 H2' A 35 24.252 -6.051 -11.180 202 HO2' A 35 HO2' A 35 23.130 -4.067 -10.019 203 H1' A 35 H1' A 35 25.656 -3.943 -12.167 204 H8 A 35 H8 A 35 25.955 -7.601 -11.243 205 H61 A 35 H61 A 35 30.561 -7.536 -15.493 206 H62 A 35 H62 A 35 29.546 -8.632 -14.550 207 H2 A 35 H2 A 35 29.585 -3.451 -14.606 208 H5' G 36 H5' G 36 22.714 -7.088 -9.784 209 H5'' G 36 H5" G 36 21.454 -6.241 -8.881 210 H4' G 36 H4' G 36 20.769 -8.332 -10.141 211 H3' G 36 H3' G 36 20.182 -7.986 -7.206 212 H2' G 36 H2' G 36 18.904 -10.029 -7.377 213 HO2' G 36 HO2' G 36 18.284 -9.383 -9.745 214 H1' G 36 H1' G 36 20.757 -11.427 -8.767 215 H8 G 36 H8 G 36 22.833 -9.342 -6.455 216 H1 G 36 H1 G 36 19.838 -14.271 -3.507 217 H21 G 36 H21 G 36 18.383 -15.161 -4.918 218 H22 G 36 H22 G 36 18.227 -14.513 -6.547 219 H5' C 37 H5' C 37 16.545 -8.916 -9.037 220 H5'' C 37 H5" C 37 15.150 -8.062 -8.409 221 H4' C 37 H4' C 37 14.918 -10.493 -8.275 222 H3' C 37 H3' C 37 15.086 -9.137 -5.586 223 H2' C 37 H2' C 37 14.333 -11.277 -4.718 224 HO2' C 37 HO2' C 37 13.658 -12.959 -6.005 225 H1' C 37 H1' C 37 16.150 -12.690 -6.193 226 H41 C 37 H41 C 37 19.105 -11.629 -0.709 227 H42 C 37 H42 C 37 19.930 -10.284 -1.458 228 H5 C 37 H5 C 37 19.365 -9.394 -3.604 229 H6 C 37 H6 C 37 17.902 -9.644 -5.529 230 H5' U 38 H5' U 38 11.448 -11.289 -5.805 231 H5'' U 38 H5" U 38 10.086 -10.363 -5.157 232 H4' U 38 H4' U 38 10.209 -12.552 -4.080 233 H3' U 38 H3' U 38 10.952 -10.224 -2.283 234 H2' U 38 H2' U 38 10.969 -11.720 -0.471 235 HO2' U 38 HO2' U 38 10.274 -13.893 -0.622 236 H1' U 38 H1' U 38 12.409 -13.645 -1.808 237 H3 U 38 H3 U 38 15.066 -11.719 1.348 238 H5 U 38 H5 U 38 15.509 -9.327 -2.056 239 H6 U 38 H6 U 38 13.581 -10.429 -3.032 240 H5' C 39 H5' C 39 8.662 -11.815 0.243 241 H5'' C 39 H5" C 39 7.434 -10.665 0.775 242 H4' C 39 H4' C 39 8.577 -11.361 2.698 243 H3' C 39 H3' C 39 9.774 -8.661 1.957 244 H2' C 39 H2' C 39 10.444 -8.688 4.243 245 HO2' C 39 HO2' C 39 9.296 -9.759 5.679 246 H1' C 39 H1' C 39 11.295 -11.314 3.991 247 H41 C 39 H41 C 39 16.123 -7.327 3.537 248 H42 C 39 H42 C 39 15.935 -7.165 1.790 249 H5 C 39 H5 C 39 13.999 -8.107 0.608 250 H6 C 39 H6 C 39 12.017 -9.537 0.869 251 H5' U 40 H5' U 40 7.422 -8.509 5.296 252 H5'' U 40 H5" U 40 6.600 -6.981 5.619 253 H4' U 40 H4' U 40 7.890 -7.658 7.532 254 H3' U 40 H3' U 40 9.050 -5.257 6.092 255 H2' U 40 H2' U 40 10.434 -5.009 8.062 256 HO2' U 40 HO2' U 40 8.900 -7.151 9.232 257 H1' U 40 H1' U 40 11.164 -7.625 8.065 258 H3 U 40 H3 U 40 14.702 -5.119 6.593 259 H5 U 40 H5 U 40 12.290 -5.585 3.198 260 H6 U 40 H6 U 40 10.566 -6.607 4.579 261 H5' C 41 H5' C 41 8.038 -4.308 10.004 262 H5'' C 41 H5" C 41 7.222 -2.761 10.256 263 H4' C 41 H4' C 41 9.123 -2.969 11.765 264 H3' C 41 H3' C 41 9.488 -0.930 9.574 265 H2' C 41 H2' C 41 11.522 -0.261 10.667 266 HO2' C 41 HO2' C 41 12.152 -1.012 12.689 267 H1' C 41 H1' C 41 12.446 -2.800 11.020 268 H41 C 41 H41 C 41 14.830 -1.407 5.395 269 H42 C 41 H42 C 41 13.472 -2.239 4.643 270 H5 C 41 H5 C 41 11.506 -2.822 5.812 271 H6 C 41 H6 C 41 10.489 -2.956 7.995 272 H5' U 42 H5' U 42 10.478 1.134 12.971 273 H5'' U 42 H5" U 42 9.708 2.722 13.014 274 H4' U 42 H4' U 42 12.093 2.997 13.227 275 H3' U 42 H3' U 42 11.065 3.833 10.508 276 H2' U 42 H2' U 42 13.240 4.843 10.190 277 HO2' U 42 HO2' U 42 13.438 5.401 12.582 278 H1' U 42 H1' U 42 14.552 2.601 11.028 279 H3 U 42 H3 U 42 14.968 2.696 6.471 280 H5 U 42 H5 U 42 11.276 0.872 7.159 281 H6 U 42 H6 U 42 11.410 1.541 9.488 282 H5' G 43 H5' G 43 12.963 7.280 11.943 283 H5'' G 43 H5" G 43 11.945 8.692 11.635 284 H4' G 43 H4' G 43 14.189 8.990 10.691 285 H3' G 43 H3' G 43 11.957 8.700 8.669 286 H2' G 43 H2' G 43 13.569 9.316 7.005 287 HO2' G 43 HO2' G 43 15.599 10.118 7.478 288 H1' G 43 H1' G 43 15.520 7.651 7.981 289 H8 G 43 H8 G 43 12.241 5.796 8.375 290 H1 G 43 H1 G 43 14.588 5.816 2.378 291 H21 G 43 H21 G 43 16.049 7.478 2.194 292 H22 G 43 H22 G 43 16.528 8.401 3.622 293 H5' C 44 H5' C 44 13.873 12.277 7.695 294 H5'' C 44 H5" C 44 12.726 13.555 7.279 295 H4' C 44 H4' C 44 14.321 13.211 5.479 296 H3' C 44 H3' C 44 11.519 12.291 4.777 297 H2' C 44 H2' C 44 12.353 12.076 2.522 298 HO2' C 44 HO2' C 44 13.846 14.008 2.782 299 H1' C 44 H1' C 44 14.628 10.778 3.285 300 H41 C 44 H41 C 44 10.775 6.032 2.136 301 H42 C 44 H42 C 44 10.083 6.081 3.759 302 H5 C 44 H5 C 44 10.546 7.921 5.286 303 H6 C 44 H6 C 44 11.900 9.919 5.599 304 H5' C 45 H5' C 45 12.519 15.119 1.735 305 H5'' C 45 H5" C 45 11.094 16.082 1.332 306 H4' C 45 H4' C 45 12.013 14.969 -0.635 307 H3' C 45 H3' C 45 9.305 13.896 0.209 308 H2' C 45 H2' C 45 9.324 12.738 -1.910 309 HO2' C 45 HO2' C 45 10.547 14.609 -2.980 310 H1' C 45 H1' C 45 11.903 11.862 -1.619 311 H41 C 45 H41 C 45 8.359 7.200 0.568 312 H42 C 45 H42 C 45 8.270 7.909 2.181 313 H5 C 45 H5 C 45 9.104 10.146 2.646 314 H6 C 45 H6 C 45 10.282 12.046 1.684 315 H5' C 46 H5' C 46 8.755 15.004 -3.816 316 H5'' C 46 H5" C 46 7.208 15.832 -4.011 317 H4' C 46 H4' C 46 7.340 13.919 -5.509 318 H3' C 46 H3' C 46 5.374 13.518 -3.228 319 HO3' C 46 HO3' C 46 4.800 15.239 -4.602 320 H2' C 46 H2' C 46 4.686 11.536 -4.344 321 HO2' C 46 HO2' C 46 4.865 12.585 -6.529 322 H1' C 46 H1' C 46 7.258 10.748 -5.037 323 H41 C 46 H41 C 46 5.231 7.570 -0.014 324 H42 C 46 H42 C 46 5.551 8.906 1.099 325 H5 C 46 H5 C 46 6.425 11.045 0.309 326 H6 C 46 H6 C 46 7.060 12.300 -1.684 327 H1 GLY 44 H1 GLY 44 34.081 -19.518 -0.560 328 H2 GLY 44 H2 GLY 44 34.123 -20.627 -1.767 329 H3 GLY 44 H3 GLY 44 33.032 -20.775 -0.553 330 HA2 GLY 44 HA2 GLY 44 33.085 -18.614 -2.562 331 HA3 GLY 44 HA3 GLY 44 31.941 -19.970 -2.538 332 H ILE 45 H ILE 45 30.345 -18.207 -2.547 333 HA ILE 45 HA ILE 45 29.545 -17.396 0.194 334 HB ILE 45 HB ILE 45 28.892 -15.155 -0.594 335 HG12 ILE 45 HG12 ILE 45 30.494 -15.758 -3.122 336 HG13 ILE 45 HG13 ILE 45 28.736 -15.634 -3.030 337 HG21 ILE 45 HG21 ILE 45 31.047 -15.594 0.608 338 HG22 ILE 45 HG22 ILE 45 31.877 -15.582 -0.966 339 HG23 ILE 45 HG23 ILE 45 31.045 -14.130 -0.376 340 HD11 ILE 45 HD11 ILE 45 28.976 -13.258 -2.257 341 HD12 ILE 45 HD12 ILE 45 30.727 -13.387 -2.553 342 HD13 ILE 45 HD13 ILE 45 29.585 -13.566 -3.893 343 H SER 46 H SER 46 27.289 -16.688 0.300 344 HA SER 46 HA SER 46 25.512 -18.032 -1.705 345 HB2 SER 46 HB2 SER 46 25.290 -18.199 1.321 346 HB3 SER 46 HB3 SER 46 24.237 -18.994 0.140 347 HG SER 46 HG SER 46 26.018 -20.220 -0.562 348 H TYR 47 H TYR 47 26.149 -15.072 -0.890 349 HA TYR 47 HA TYR 47 23.390 -14.095 -1.121 350 HB2 TYR 47 HB2 TYR 47 25.210 -13.148 1.141 351 HB3 TYR 47 HB3 TYR 47 23.606 -12.549 0.775 352 HD1 TYR 47 HD1 TYR 47 25.551 -15.250 2.335 353 HD2 TYR 47 HD2 TYR 47 21.587 -13.807 1.424 354 HE1 TYR 47 HE1 TYR 47 24.586 -16.914 3.914 355 HE2 TYR 47 HE2 TYR 47 20.626 -15.484 3.006 356 HH TYR 47 HH TYR 47 22.677 -17.770 4.843 357 H GLY 48 H GLY 48 23.279 -12.057 -2.053 358 HA2 GLY 48 HA2 GLY 48 25.807 -10.459 -2.388 359 HA3 GLY 48 HA3 GLY 48 24.602 -10.622 -3.656 360 H ARG 49 H ARG 49 22.858 -10.433 -0.894 361 HA ARG 49 HA ARG 49 21.411 -8.789 -0.048 362 HB2 ARG 49 HB2 ARG 49 24.160 -7.777 0.744 363 HB3 ARG 49 HB3 ARG 49 22.643 -7.449 1.571 364 HG2 ARG 49 HG2 ARG 49 24.126 -10.095 1.398 365 HG3 ARG 49 HG3 ARG 49 23.823 -9.083 2.806 366 HD2 ARG 49 HD2 ARG 49 21.274 -9.546 2.242 367 HD3 ARG 49 HD3 ARG 49 21.918 -10.921 1.340 368 HE ARG 49 HE ARG 49 23.074 -10.792 3.985 369 HH11 ARG 49 HH11 ARG 49 20.045 -11.978 2.431 370 HH12 ARG 49 HH12 ARG 49 19.689 -12.914 3.707 371 HH21 ARG 49 HH21 ARG 49 22.447 -11.882 5.652 372 HH22 ARG 49 HH22 ARG 49 20.964 -12.789 5.666 373 H LYS 50 H LYS 50 20.619 -7.986 -2.060 374 HA LYS 50 HA LYS 50 21.422 -5.637 -3.371 375 HB2 LYS 50 HB2 LYS 50 19.202 -5.528 -4.271 376 HB3 LYS 50 HB3 LYS 50 19.708 -7.201 -4.223 377 HG2 LYS 50 HG2 LYS 50 18.308 -7.603 -2.227 378 HG3 LYS 50 HG3 LYS 50 17.867 -5.900 -2.136 379 HD2 LYS 50 HD2 LYS 50 17.233 -7.655 -4.533 380 HD3 LYS 50 HD3 LYS 50 16.131 -7.425 -3.169 381 HE2 LYS 50 HE2 LYS 50 15.970 -5.040 -3.603 382 HE3 LYS 50 HE3 LYS 50 17.213 -5.144 -4.862 383 HZ1 LYS 50 HZ1 LYS 50 15.752 -6.563 -6.146 384 HZ2 LYS 50 HZ2 LYS 50 14.571 -6.506 -5.015 385 HZ3 LYS 50 HZ3 LYS 50 14.992 -5.146 -5.831 386 H LYS 51 H LYS 51 20.215 -3.654 -3.525 387 HA LYS 51 HA LYS 51 20.277 -1.798 -1.490 388 HB2 LYS 51 HB2 LYS 51 18.211 -1.917 -3.735 389 HB3 LYS 51 HB3 LYS 51 18.610 -0.517 -2.769 390 HG2 LYS 51 HG2 LYS 51 19.648 -0.198 -4.836 391 HG3 LYS 51 HG3 LYS 51 20.925 -0.514 -3.675 392 HD2 LYS 51 HD2 LYS 51 21.272 -1.508 -5.946 393 HD3 LYS 51 HD3 LYS 51 21.378 -2.678 -4.644 394 HE2 LYS 51 HE2 LYS 51 19.010 -3.383 -5.126 395 HE3 LYS 51 HE3 LYS 51 18.941 -2.219 -6.444 396 HZ1 LYS 51 HZ1 LYS 51 21.031 -4.343 -6.414 397 HZ2 LYS 51 HZ2 LYS 51 19.528 -4.644 -6.972 398 HZ3 LYS 51 HZ3 LYS 51 20.466 -3.488 -7.684 399 H ARG 52 H ARG 52 19.254 -1.495 0.368 400 HA ARG 52 HA ARG 52 17.208 -3.249 1.386 401 HB2 ARG 52 HB2 ARG 52 18.007 -0.524 2.475 402 HB3 ARG 52 HB3 ARG 52 17.277 -1.862 3.343 403 HG2 ARG 52 HG2 ARG 52 20.138 -1.762 2.303 404 HG3 ARG 52 HG3 ARG 52 19.594 -1.520 3.954 405 HD2 ARG 52 HD2 ARG 52 18.603 -3.928 3.753 406 HD3 ARG 52 HD3 ARG 52 19.695 -4.097 2.376 407 HE ARG 52 HE ARG 52 21.516 -3.298 4.070 408 HH11 ARG 52 HH11 ARG 52 18.823 -5.348 5.085 409 HH12 ARG 52 HH12 ARG 52 19.605 -5.821 6.523 410 HH21 ARG 52 HH21 ARG 52 22.506 -4.010 6.028 411 HH22 ARG 52 HH22 ARG 52 21.516 -4.903 7.118 412 H ARG 53 H ARG 53 15.015 -2.776 2.020 413 HA ARG 53 HA ARG 53 13.690 -0.305 1.150 414 HB2 ARG 53 HB2 ARG 53 12.256 -1.229 -0.514 415 HB3 ARG 53 HB3 ARG 53 13.879 -1.717 -0.939 416 HG2 ARG 53 HG2 ARG 53 12.997 -3.776 -1.199 417 HG3 ARG 53 HG3 ARG 53 13.105 -3.906 0.554 418 HD2 ARG 53 HD2 ARG 53 10.725 -2.830 0.579 419 HD3 ARG 53 HD3 ARG 53 10.683 -3.155 -1.147 420 HE ARG 53 HE ARG 53 10.275 -5.017 1.021 421 HH11 ARG 53 HH11 ARG 53 11.457 -5.043 -2.318 422 HH12 ARG 53 HH12 ARG 53 10.992 -6.718 -2.489 423 HH21 ARG 53 HH21 ARG 53 9.628 -6.961 0.614 424 HH22 ARG 53 HH22 ARG 53 9.932 -7.729 -0.927 425 H GLN 54 H GLN 54 11.328 -0.293 1.661 426 HA GLN 54 HA GLN 54 10.519 -2.205 3.812 427 HB2 GLN 54 HB2 GLN 54 9.541 -0.362 5.093 428 HB3 GLN 54 HB3 GLN 54 11.282 -0.195 4.935 429 HG2 GLN 54 HG2 GLN 54 10.984 1.518 3.167 430 HG3 GLN 54 HG3 GLN 54 9.233 1.333 3.255 431 HE21 GLN 54 HE21 GLN 54 10.993 4.076 5.565 432 HE22 GLN 54 HE22 GLN 54 11.662 3.434 4.200 433 H ARG 55 H ARG 55 8.177 -2.296 4.198 434 HA ARG 55 HA ARG 55 6.518 -1.290 1.919 435 HB2 ARG 55 HB2 ARG 55 7.191 -3.749 1.730 436 HB3 ARG 55 HB3 ARG 55 6.117 -4.057 3.099 437 HG2 ARG 55 HG2 ARG 55 4.198 -3.243 1.833 438 HG3 ARG 55 HG3 ARG 55 5.230 -2.641 0.533 439 HD2 ARG 55 HD2 ARG 55 4.921 -5.568 1.287 440 HD3 ARG 55 HD3 ARG 55 4.003 -4.763 0.028 441 HE ARG 55 HE ARG 55 6.328 -4.211 -0.983 442 HH11 ARG 55 HH11 ARG 55 5.933 -7.231 0.751 443 HH12 ARG 55 HH12 ARG 55 6.548 -8.180 -0.607 444 HH21 ARG 55 HH21 ARG 55 7.473 -5.440 -2.433 445 HH22 ARG 55 HH22 ARG 55 7.735 -7.137 -2.114 446 H ARG 56 H ARG 56 6.841 -1.575 5.300 447 HA ARG 56 HA ARG 56 5.653 -0.751 7.042 448 HB2 ARG 56 HB2 ARG 56 6.475 1.210 5.746 449 HB3 ARG 56 HB3 ARG 56 4.859 1.412 5.066 450 HG2 ARG 56 HG2 ARG 56 3.921 1.844 7.275 451 HG3 ARG 56 HG3 ARG 56 5.427 1.376 8.073 452 HD2 ARG 56 HD2 ARG 56 5.181 3.736 6.161 453 HD3 ARG 56 HD3 ARG 56 4.995 3.857 7.910 454 HE ARG 56 HE ARG 56 7.522 2.845 6.611 455 HH11 ARG 56 HH11 ARG 56 6.122 4.897 9.155 456 HH12 ARG 56 HH12 ARG 56 7.758 5.256 9.728 457 HH21 ARG 56 HH21 ARG 56 9.401 3.390 7.496 458 HH22 ARG 56 HH22 ARG 56 9.422 4.509 8.893 459 H ARG 57 H ARG 57 4.417 -2.736 6.711 460 HA ARG 57 HA ARG 57 1.792 -2.806 5.503 461 HB2 ARG 57 HB2 ARG 57 3.178 -4.664 7.491 462 HB3 ARG 57 HB3 ARG 57 1.688 -5.057 6.619 463 HG2 ARG 57 HG2 ARG 57 2.832 -4.968 4.464 464 HG3 ARG 57 HG3 ARG 57 4.303 -4.342 5.209 465 HD2 ARG 57 HD2 ARG 57 4.743 -6.586 4.794 466 HD3 ARG 57 HD3 ARG 57 4.516 -6.450 6.537 467 HE ARG 57 HE ARG 57 2.611 -7.815 6.386 468 HH11 ARG 57 HH11 ARG 57 3.788 -7.204 3.143 469 HH12 ARG 57 HH12 ARG 57 2.614 -8.282 2.430 470 HH21 ARG 57 HH21 ARG 57 1.369 -9.275 5.492 471 HH22 ARG 57 HH22 ARG 57 1.255 -9.475 3.752 472 H ALA 58 H ALA 58 -0.232 -3.004 6.445 473 HA ALA 58 HA ALA 58 -0.596 -1.855 9.183 474 HB1 ALA 58 HB1 ALA 58 -1.847 -0.848 6.588 475 HB2 ALA 58 HB2 ALA 58 -2.104 -0.177 8.215 476 HB3 ALA 58 HB3 ALA 58 -0.506 -0.069 7.459 477 H HIS 59 H HIS 59 -1.213 -4.579 7.774 478 HA HIS 59 HA HIS 59 -3.979 -4.898 8.848 479 HB2 HIS 59 HB2 HIS 59 -3.961 -4.422 6.351 480 HB3 HIS 59 HB3 HIS 59 -3.097 -5.941 6.131 481 HD2 HIS 59 HD2 HIS 59 -4.759 -7.750 5.322 482 HE1 HIS 59 HE1 HIS 59 -8.246 -6.643 7.518 483 HE2 HIS 59 HE2 HIS 59 -7.281 -8.310 5.851 484 H GLN 60 H GLN 60 -1.307 -5.645 9.848 485 HA GLN 60 HA GLN 60 -1.639 -8.547 10.290 486 HB2 GLN 60 HB2 GLN 60 -0.309 -8.256 8.196 487 HB3 GLN 60 HB3 GLN 60 0.891 -7.321 9.100 488 HG2 GLN 60 HG2 GLN 60 1.371 -9.294 10.514 489 HG3 GLN 60 HG3 GLN 60 0.125 -10.224 9.673 490 HE21 GLN 60 HE21 GLN 60 3.497 -11.021 8.171 491 HE22 GLN 60 HE22 GLN 60 2.849 -11.103 9.805 Start of MODEL 4 1 H5' G 16 H5' G 16 1.021 -1.540 -2.970 2 H5'' G 16 H5" G 16 2.549 -2.367 -3.304 3 H4' G 16 H4' G 16 2.052 -0.826 -5.100 4 H3' G 16 H3' G 16 4.341 0.064 -3.346 5 H2' G 16 H2' G 16 4.706 1.846 -4.884 6 HO2' G 16 HO2' G 16 3.644 2.020 -6.879 7 H1' G 16 H1' G 16 2.087 2.576 -5.062 8 H8 G 16 H8 G 16 2.409 1.502 -1.529 9 H1 G 16 H1 G 16 5.291 7.156 -2.701 10 H21 G 16 H21 G 16 5.592 7.351 -4.889 11 H22 G 16 H22 G 16 4.930 6.140 -5.994 12 HO5' G 16 HO5' G 16 2.378 -1.652 -1.093 13 H5' G 17 H5' G 17 5.811 0.429 -7.162 14 H5'' G 17 H5" G 17 7.397 -0.325 -7.292 15 H4' G 17 H4' G 17 7.513 1.910 -8.121 16 H3' G 17 H3' G 17 8.882 1.606 -5.437 17 H2' G 17 H2' G 17 9.856 3.756 -5.882 18 HO2' G 17 HO2' G 17 8.648 3.592 -8.505 19 H1' G 17 H1' G 17 7.464 4.863 -6.562 20 H8 G 17 H8 G 17 6.716 2.304 -3.879 21 H1 G 17 H1 G 17 9.268 7.815 -1.697 22 H21 G 17 H21 G 17 10.227 8.874 -3.389 23 H22 G 17 H22 G 17 10.064 8.255 -5.036 24 H5' G 18 H5' G 18 11.712 2.973 -8.040 25 H5'' G 18 H5" G 18 13.294 2.219 -7.840 26 H4' G 18 H4' G 18 13.369 4.685 -7.747 27 H3' G 18 H3' G 18 14.176 3.206 -5.241 28 H2' G 18 H2' G 18 14.845 5.355 -4.353 29 HO2' G 18 HO2' G 18 15.599 6.080 -6.597 30 H1' G 18 H1' G 18 12.615 6.682 -5.183 31 H8 G 18 H8 G 18 11.464 3.225 -4.122 32 H1 G 18 H1 G 18 12.219 7.455 0.692 33 H21 G 18 H21 G 18 13.570 9.075 -0.005 34 H22 G 18 H22 G 18 14.059 9.152 -1.700 35 H5' C 19 H5' C 19 17.527 5.791 -6.078 36 H5'' C 19 H5" C 19 19.028 4.931 -5.725 37 H4' C 19 H4' C 19 18.868 6.979 -4.418 38 H3' C 19 H3' C 19 18.603 4.468 -2.751 39 H2' C 19 H2' C 19 18.803 5.942 -0.835 40 HO2' C 19 HO2' C 19 20.347 7.436 -2.023 41 H1' C 19 H1' C 19 17.003 7.748 -1.812 42 H41 C 19 H41 C 19 13.452 3.955 1.624 43 H42 C 19 H42 C 19 13.339 2.741 0.343 44 H5 C 19 H5 C 19 14.727 2.857 -1.642 45 H6 C 19 H6 C 19 16.222 4.298 -2.894 46 H5' A 20 H5' A 20 21.855 6.632 -0.904 47 H5'' A 20 H5" A 20 23.070 5.453 -0.405 48 H4' A 20 H4' A 20 22.382 6.820 1.477 49 H3' A 20 H3' A 20 21.372 3.972 1.695 50 H2' A 20 H2' A 20 20.857 4.550 3.980 51 HO2' A 20 HO2' A 20 21.429 6.526 4.907 52 H1' A 20 H1' A 20 19.585 6.852 3.239 53 H8 A 20 H8 A 20 19.067 4.207 0.512 54 H61 A 20 H61 A 20 14.411 2.302 4.258 55 H62 A 20 H62 A 20 15.174 1.976 2.728 56 H2 A 20 H2 A 20 16.830 5.123 6.489 57 H5' G 21 H5' G 21 23.469 4.528 5.271 58 H5'' G 21 H5" G 21 24.513 3.125 5.526 59 H4' G 21 H4' G 21 23.278 3.427 7.502 60 H3' G 21 H3' G 21 22.003 1.137 5.966 61 H2' G 21 H2' G 21 20.883 0.698 8.066 62 HO2' G 21 HO2' G 21 21.257 1.962 9.927 63 H1' G 21 H1' G 21 20.018 3.272 8.235 64 H8 G 21 H8 G 21 20.434 2.515 4.548 65 H1 G 21 H1 G 21 15.432 -0.570 7.187 66 H21 G 21 H21 G 21 15.549 -0.387 9.389 67 H22 G 21 H22 G 21 16.837 0.562 10.135 68 H5' A 22 H5' A 22 22.957 -0.144 9.690 69 H5'' A 22 H5" A 22 24.252 -1.306 9.609 70 H4' A 22 H4' A 22 22.767 -2.063 11.332 71 H3' A 22 H3' A 22 22.427 -3.656 8.792 72 H2' A 22 H2' A 22 20.636 -4.864 9.703 73 HO2' A 22 HO2' A 22 21.593 -5.183 11.831 74 H1' A 22 H1' A 22 19.391 -2.805 10.993 75 H8 A 22 H8 A 22 20.666 -1.492 7.631 76 H61 A 22 H61 A 22 15.398 -3.762 5.298 77 H62 A 22 H62 A 22 16.623 -2.517 5.102 78 H2 A 22 H2 A 22 15.728 -5.249 9.400 79 H5' U 23 H5' U 23 26.177 -6.146 7.956 80 H5'' U 23 H5" U 23 25.107 -5.794 6.601 81 H4' U 23 H4' U 23 24.208 -7.250 9.123 82 H3' U 23 H3' U 23 25.812 -8.314 6.978 83 H2' U 23 H2' U 23 24.079 -8.397 5.462 84 HO2' U 23 HO2' U 23 24.080 -10.734 6.962 85 H1' U 23 H1' U 23 22.220 -8.884 7.811 86 H3 U 23 H3 U 23 18.774 -9.647 5.041 87 H5 U 23 H5 U 23 20.981 -6.771 2.924 88 H6 U 23 H6 U 23 22.559 -6.673 4.795 89 H5' U 25 H5' U 25 24.776 -8.427 11.009 90 H5'' U 25 H5" U 25 26.499 -8.069 11.226 91 H4' U 25 H4' U 25 25.056 -10.055 13.007 92 H3' U 25 H3' U 25 24.731 -7.140 12.909 93 H2' U 25 H2' U 25 25.641 -6.561 14.987 94 HO2' U 25 HO2' U 25 24.336 -8.421 15.995 95 H1' U 25 H1' U 25 27.583 -8.450 15.271 96 H3 U 25 H3 U 25 31.173 -6.534 13.310 97 H5 U 25 H5 U 25 27.963 -4.164 12.061 98 H6 U 25 H6 U 25 26.430 -5.767 13.011 99 H5' G 26 H5' G 26 22.171 -9.352 11.783 100 H5'' G 26 H5" G 26 21.818 -8.250 10.458 101 H4' G 26 H4' G 26 19.862 -9.004 12.558 102 H3' G 26 H3' G 26 20.185 -9.900 9.693 103 H2' G 26 H2' G 26 17.838 -10.145 9.581 104 HO2' G 26 HO2' G 26 16.469 -10.062 11.373 105 H1' G 26 H1' G 26 17.268 -7.779 10.856 106 H8 G 26 H8 G 26 20.197 -6.934 8.796 107 H1 G 26 H1 G 26 14.966 -7.946 5.199 108 H21 G 26 H21 G 26 13.542 -9.193 6.427 109 H22 G 26 H22 G 26 13.904 -9.495 8.125 110 H5' A 27 H5' A 27 17.262 -12.688 11.419 111 H5'' A 27 H5" A 27 17.906 -14.315 11.141 112 H4' A 27 H4' A 27 15.647 -14.283 10.345 113 H3' A 27 H3' A 27 17.655 -14.193 8.073 114 H2' A 27 H2' A 27 15.818 -14.617 6.639 115 HO2' A 27 HO2' A 27 13.787 -15.218 7.342 116 H1' A 27 H1' A 27 14.211 -12.741 7.841 117 H8 A 27 H8 A 27 17.709 -11.247 7.812 118 H61 A 27 H61 A 27 16.558 -10.245 1.726 119 H62 A 27 H62 A 27 17.632 -9.777 3.007 120 H2 A 27 H2 A 27 13.457 -12.849 3.224 121 H5' G 28 H5' G 28 15.349 -17.566 7.379 122 H5'' G 28 H5" G 28 16.255 -18.911 6.678 123 H4' G 28 H4' G 28 14.314 -18.188 5.323 124 H3' G 28 H3' G 28 17.004 -17.835 3.943 125 H2' G 28 H2' G 28 15.731 -17.368 1.997 126 HO2' G 28 HO2' G 28 13.467 -17.514 1.910 127 H1' G 28 H1' G 28 14.146 -15.551 3.234 128 H8 G 28 H8 G 28 17.450 -15.218 4.996 129 H1 G 28 H1 G 28 17.497 -12.956 -1.016 130 H21 G 28 H21 G 28 15.814 -13.924 -2.142 131 H22 G 28 H22 G 28 14.696 -14.961 -1.252 132 H5' C 29 H5' C 29 14.628 -19.869 1.406 133 H5'' C 29 H5" C 29 15.403 -21.292 0.724 134 H4' C 29 H4' C 29 14.463 -19.832 -1.014 135 H3' C 29 H3' C 29 17.474 -20.086 -0.962 136 H2' C 29 H2' C 29 17.412 -19.021 -3.125 137 HO2' C 29 HO2' C 29 15.641 -19.826 -4.187 138 H1' C 29 H1' C 29 15.603 -17.122 -2.371 139 H41 C 29 H41 C 29 20.990 -14.085 -1.650 140 H42 C 29 H42 C 29 21.105 -14.574 0.033 141 H5 C 29 H5 C 29 19.645 -16.275 0.978 142 H6 C 29 H6 C 29 17.704 -17.673 0.554 143 H5' C 30 H5' C 30 15.926 -21.910 -4.603 144 H5'' C 30 H5" C 30 16.954 -23.220 -5.202 145 H4' C 30 H4' C 30 16.678 -21.364 -6.838 146 H3' C 30 H3' C 30 19.466 -21.857 -5.765 147 H2' C 30 H2' C 30 20.245 -20.186 -7.279 148 HO2' C 30 HO2' C 30 18.515 -20.998 -8.938 149 H1' C 30 H1' C 30 18.100 -18.466 -6.909 150 H41 C 30 H41 C 30 22.687 -15.996 -3.537 151 H42 C 30 H42 C 30 22.470 -17.110 -2.179 152 H5 C 30 H5 C 30 20.830 -18.921 -2.284 153 H6 C 30 H6 C 30 19.219 -20.024 -3.727 154 H5' U 31 H5' U 31 20.239 -21.623 -9.861 155 H5'' U 31 H5" U 31 21.316 -22.944 -10.331 156 H4' U 31 H4' U 31 22.332 -20.762 -10.827 157 H3' U 31 H3' U 31 23.606 -22.429 -8.667 158 H2' U 31 H2' U 31 25.271 -20.835 -8.355 159 HO2' U 31 HO2' U 31 25.831 -19.256 -9.755 160 H1' U 31 H1' U 31 23.659 -18.581 -8.909 161 H3 U 31 H3 U 31 24.648 -17.566 -4.631 162 H5 U 31 H5 U 31 22.978 -21.385 -4.284 163 H6 U 31 H6 U 31 22.621 -21.412 -6.701 164 H5' G 32 H5' G 32 27.770 -23.706 -9.092 165 H5'' G 32 H5" G 32 27.054 -22.160 -8.593 166 H4' G 32 H4' G 32 29.553 -22.154 -8.843 167 H3' G 32 H3' G 32 27.752 -20.255 -10.240 168 H2' G 32 H2' G 32 29.424 -19.336 -11.644 169 HO2' G 32 HO2' G 32 31.061 -19.688 -9.712 170 H1' G 32 H1' G 32 30.580 -21.647 -12.419 171 H8 G 32 H8 G 32 27.402 -19.771 -12.552 172 H1 G 32 H1 G 32 27.206 -25.137 -16.120 173 H21 G 32 H21 G 32 28.961 -26.439 -15.566 174 H22 G 32 H22 G 32 30.089 -25.898 -14.334 175 H5' G 33 H5' G 33 31.060 -17.703 -9.298 176 H5'' G 33 H5" G 33 30.507 -16.356 -8.305 177 H4' G 33 H4' G 33 31.748 -15.569 -10.272 178 H3' G 33 H3' G 33 28.821 -14.837 -10.134 179 H2' G 33 H2' G 33 28.913 -13.839 -12.253 180 HO2' G 33 HO2' G 33 31.119 -12.863 -11.622 181 H1' G 33 H1' G 33 30.689 -15.571 -13.477 182 H8 G 33 H8 G 33 27.820 -17.140 -11.379 183 H1 G 33 H1 G 33 26.547 -16.122 -17.618 184 H21 G 33 H21 G 33 28.292 -15.029 -18.539 185 H22 G 33 H22 G 33 29.678 -14.612 -17.544 186 H5' G 34 H5' G 34 29.072 -11.126 -10.293 187 H5'' G 34 H5" G 34 28.845 -10.286 -8.761 188 H4' G 34 H4' G 34 27.177 -10.104 -10.875 189 H3' G 34 H3' G 34 26.376 -9.657 -7.976 190 H2' G 34 H2' G 34 24.193 -9.591 -8.552 191 HO2' G 34 HO2' G 34 23.412 -9.589 -10.701 192 H1' G 34 H1' G 34 24.089 -11.806 -10.071 193 H8 G 34 H8 G 34 26.656 -11.431 -7.115 194 H1 G 34 H1 G 34 21.927 -15.682 -6.225 195 H21 G 34 H21 G 34 20.684 -15.778 -8.005 196 H22 G 34 H22 G 34 20.942 -14.700 -9.377 197 H5' A 35 H5' A 35 28.074 -4.420 -8.178 198 H5'' A 35 H5" A 35 27.043 -5.713 -7.564 199 H4' A 35 H4' A 35 25.832 -3.639 -8.219 200 H3' A 35 H3' A 35 25.121 -6.336 -9.249 201 H2' A 35 H2' A 35 23.710 -5.607 -10.943 202 HO2' A 35 HO2' A 35 22.636 -4.006 -9.488 203 H1' A 35 H1' A 35 25.031 -3.389 -11.778 204 H8 A 35 H8 A 35 25.543 -7.184 -11.386 205 H61 A 35 H61 A 35 28.809 -6.437 -16.683 206 H62 A 35 H62 A 35 28.126 -7.674 -15.623 207 H2 A 35 H2 A 35 27.972 -2.518 -15.135 208 H5' G 36 H5' G 36 23.101 -7.492 -9.393 209 H5'' G 36 H5" G 36 21.791 -6.321 -9.210 210 H4' G 36 H4' G 36 20.836 -8.216 -10.219 211 H3' G 36 H3' G 36 20.188 -8.189 -7.273 212 H2' G 36 H2' G 36 18.897 -10.170 -7.646 213 HO2' G 36 HO2' G 36 18.329 -9.285 -9.974 214 H1' G 36 H1' G 36 20.721 -11.488 -9.109 215 H8 G 36 H8 G 36 22.912 -9.607 -6.815 216 H1 G 36 H1 G 36 19.740 -14.381 -3.808 217 H21 G 36 H21 G 36 18.188 -15.168 -5.158 218 H22 G 36 H22 G 36 18.003 -14.520 -6.788 219 H5' C 37 H5' C 37 16.581 -8.979 -9.163 220 H5'' C 37 H5" C 37 15.193 -8.152 -8.473 221 H4' C 37 H4' C 37 14.921 -10.580 -8.502 222 H3' C 37 H3' C 37 15.132 -9.380 -5.742 223 H2' C 37 H2' C 37 14.326 -11.552 -4.991 224 HO2' C 37 HO2' C 37 12.945 -11.897 -6.972 225 H1' C 37 H1' C 37 16.147 -12.900 -6.448 226 H41 C 37 H41 C 37 19.048 -11.779 -0.903 227 H42 C 37 H42 C 37 19.887 -10.476 -1.709 228 H5 C 37 H5 C 37 19.413 -9.682 -3.860 229 H6 C 37 H6 C 37 17.952 -9.905 -5.790 230 H5' U 38 H5' U 38 11.284 -11.203 -6.006 231 H5'' U 38 H5" U 38 9.999 -10.206 -5.310 232 H4' U 38 H4' U 38 10.029 -12.471 -4.342 233 H3' U 38 H3' U 38 10.695 -10.186 -2.476 234 H2' U 38 H2' U 38 10.809 -11.719 -0.682 235 HO2' U 38 HO2' U 38 8.956 -13.055 -1.750 236 H1' U 38 H1' U 38 12.251 -13.631 -2.002 237 H3 U 38 H3 U 38 14.865 -11.474 1.108 238 H5 U 38 H5 U 38 15.453 -9.463 -2.510 239 H6 U 38 H6 U 38 13.539 -10.611 -3.409 240 H5' C 39 H5' C 39 8.401 -11.902 0.124 241 H5'' C 39 H5" C 39 7.146 -10.777 0.650 242 H4' C 39 H4' C 39 8.362 -11.480 2.539 243 H3' C 39 H3' C 39 9.343 -8.661 1.927 244 H2' C 39 H2' C 39 10.073 -8.788 4.189 245 HO2' C 39 HO2' C 39 9.454 -10.305 5.614 246 H1' C 39 H1' C 39 11.138 -11.301 3.773 247 H41 C 39 H41 C 39 15.800 -7.113 3.170 248 H42 C 39 H42 C 39 15.566 -7.043 1.427 249 H5 C 39 H5 C 39 13.629 -8.048 0.326 250 H6 C 39 H6 C 39 11.665 -9.478 0.678 251 H5' U 40 H5' U 40 7.169 -8.821 5.448 252 H5'' U 40 H5" U 40 6.261 -7.350 5.806 253 H4' U 40 H4' U 40 7.622 -8.043 7.701 254 H3' U 40 H3' U 40 8.573 -5.489 6.385 255 H2' U 40 H2' U 40 9.980 -5.254 8.351 256 HO2' U 40 HO2' U 40 8.259 -6.348 9.771 257 H1' U 40 H1' U 40 10.871 -7.829 8.229 258 H3 U 40 H3 U 40 14.250 -5.038 6.832 259 H5 U 40 H5 U 40 11.998 -5.846 3.408 260 H6 U 40 H6 U 40 10.286 -6.885 4.760 261 H5' C 41 H5' C 41 7.978 -4.482 10.399 262 H5'' C 41 H5" C 41 7.268 -2.876 10.570 263 H4' C 41 H4' C 41 9.403 -3.133 11.784 264 H3' C 41 H3' C 41 9.401 -1.124 9.522 265 H2' C 41 H2' C 41 11.564 -0.439 10.370 266 HO2' C 41 HO2' C 41 10.862 -0.898 12.692 267 H1' C 41 H1' C 41 12.491 -2.996 10.638 268 H41 C 41 H41 C 41 14.390 -1.102 4.961 269 H42 C 41 H42 C 41 12.964 -1.784 4.213 270 H5 C 41 H5 C 41 11.142 -2.708 5.467 271 H6 C 41 H6 C 41 10.300 -3.091 7.740 272 H5' U 42 H5' U 42 10.660 1.099 12.980 273 H5'' U 42 H5" U 42 9.843 2.666 12.990 274 H4' U 42 H4' U 42 12.251 2.943 13.128 275 H3' U 42 H3' U 42 11.089 3.864 10.484 276 H2' U 42 H2' U 42 13.259 4.844 10.084 277 HO2' U 42 HO2' U 42 13.563 5.359 12.473 278 H1' U 42 H1' U 42 14.605 2.583 10.826 279 H3 U 42 H3 U 42 14.728 3.059 6.265 280 H5 U 42 H5 U 42 11.050 1.207 7.011 281 H6 U 42 H6 U 42 11.421 1.507 9.395 282 H5' G 43 H5' G 43 13.160 7.310 11.930 283 H5'' G 43 H5" G 43 12.111 8.717 11.727 284 H4' G 43 H4' G 43 14.293 9.094 10.703 285 H3' G 43 H3' G 43 12.014 8.848 8.728 286 H2' G 43 H2' G 43 13.577 9.569 7.066 287 HO2' G 43 HO2' G 43 15.575 10.435 7.524 288 H1' G 43 H1' G 43 15.609 7.936 7.951 289 H8 G 43 H8 G 43 12.366 5.986 8.247 290 H1 G 43 H1 G 43 14.807 6.265 2.281 291 H21 G 43 H21 G 43 16.320 7.848 2.192 292 H22 G 43 H22 G 43 16.786 8.747 3.643 293 H5' C 44 H5' C 44 13.841 12.533 7.846 294 H5'' C 44 H5" C 44 12.659 13.776 7.416 295 H4' C 44 H4' C 44 14.294 13.427 5.625 296 H3' C 44 H3' C 44 11.499 12.508 4.900 297 H2' C 44 H2' C 44 12.347 12.259 2.672 298 HO2' C 44 HO2' C 44 14.314 13.016 1.996 299 H1' C 44 H1' C 44 14.614 10.950 3.474 300 H41 C 44 H41 C 44 10.591 6.339 2.252 301 H42 C 44 H42 C 44 9.669 6.588 3.731 302 H5 C 44 H5 C 44 10.314 8.299 5.356 303 H6 C 44 H6 C 44 11.774 10.209 5.716 304 H5' C 45 H5' C 45 12.723 15.196 1.896 305 H5'' C 45 H5" C 45 11.389 16.194 1.310 306 H4' C 45 H4' C 45 12.469 14.961 -0.503 307 H3' C 45 H3' C 45 9.633 14.049 0.064 308 H2' C 45 H2' C 45 9.833 12.790 -1.988 309 HO2' C 45 HO2' C 45 11.292 14.550 -2.971 310 H1' C 45 H1' C 45 12.290 11.781 -1.353 311 H41 C 45 H41 C 45 8.223 7.507 0.681 312 H42 C 45 H42 C 45 7.985 8.327 2.229 313 H5 C 45 H5 C 45 8.969 10.505 2.681 314 H6 C 45 H6 C 45 10.374 12.257 1.754 315 H5' C 46 H5' C 46 9.600 14.873 -4.037 316 H5'' C 46 H5" C 46 8.150 15.781 -4.464 317 H4' C 46 H4' C 46 8.312 13.763 -5.811 318 H3' C 46 H3' C 46 6.074 13.655 -3.759 319 HO3' C 46 HO3' C 46 5.794 15.314 -5.295 320 H2' C 46 H2' C 46 5.370 11.653 -4.830 321 HO2' C 46 HO2' C 46 5.882 12.536 -7.037 322 H1' C 46 H1' C 46 7.937 10.646 -5.159 323 H41 C 46 H41 C 46 5.195 7.936 -0.206 324 H42 C 46 H42 C 46 5.492 9.319 0.854 325 H5 C 46 H5 C 46 6.580 11.346 0.035 326 H6 C 46 H6 C 46 7.506 12.424 -1.949 327 H1 GLY 44 H1 GLY 44 31.693 -1.336 -5.539 328 H2 GLY 44 H2 GLY 44 32.745 -1.567 -6.773 329 H3 GLY 44 H3 GLY 44 33.283 -1.001 -5.330 330 HA2 GLY 44 HA2 GLY 44 33.884 -3.312 -5.559 331 HA3 GLY 44 HA3 GLY 44 32.727 -3.071 -4.238 332 H ILE 45 H ILE 45 32.180 -5.305 -4.467 333 HA ILE 45 HA ILE 45 30.125 -5.898 -6.530 334 HB ILE 45 HB ILE 45 31.033 -8.182 -6.811 335 HG12 ILE 45 HG12 ILE 45 33.563 -7.177 -5.435 336 HG13 ILE 45 HG13 ILE 45 32.389 -8.279 -4.712 337 HG21 ILE 45 HG21 ILE 45 33.059 -6.092 -7.688 338 HG22 ILE 45 HG22 ILE 45 32.662 -7.629 -8.481 339 HG23 ILE 45 HG23 ILE 45 31.466 -6.335 -8.443 340 HD11 ILE 45 HD11 ILE 45 34.112 -8.849 -7.152 341 HD12 ILE 45 HD12 ILE 45 34.241 -9.567 -5.539 342 HD13 ILE 45 HD13 ILE 45 32.823 -9.920 -6.546 343 H SER 46 H SER 46 28.882 -7.887 -5.962 344 HA SER 46 HA SER 46 28.766 -8.520 -3.038 345 HB2 SER 46 HB2 SER 46 26.432 -7.696 -4.805 346 HB3 SER 46 HB3 SER 46 26.249 -8.525 -3.252 347 HG SER 46 HG SER 46 27.517 -6.010 -3.681 348 H TYR 47 H TYR 47 27.859 -10.536 -2.537 349 HA TYR 47 HA TYR 47 27.795 -12.545 -4.755 350 HB2 TYR 47 HB2 TYR 47 29.328 -13.919 -3.422 351 HB3 TYR 47 HB3 TYR 47 30.031 -12.389 -3.888 352 HD1 TYR 47 HD1 TYR 47 28.683 -14.347 -1.031 353 HD2 TYR 47 HD2 TYR 47 30.667 -10.710 -2.243 354 HE1 TYR 47 HE1 TYR 47 29.239 -13.860 1.345 355 HE2 TYR 47 HE2 TYR 47 31.220 -10.223 0.140 356 HH TYR 47 HH TYR 47 30.249 -12.414 2.807 357 H GLY 48 H GLY 48 25.789 -11.369 -2.545 358 HA2 GLY 48 HA2 GLY 48 24.066 -13.603 -2.433 359 HA3 GLY 48 HA3 GLY 48 25.002 -13.620 -0.942 360 H ARG 49 H ARG 49 24.124 -10.508 -2.337 361 HA ARG 49 HA ARG 49 21.709 -10.096 -0.759 362 HB2 ARG 49 HB2 ARG 49 24.295 -8.611 -0.080 363 HB3 ARG 49 HB3 ARG 49 22.706 -8.025 0.376 364 HG2 ARG 49 HG2 ARG 49 24.032 -10.550 1.402 365 HG3 ARG 49 HG3 ARG 49 23.735 -9.037 2.265 366 HD2 ARG 49 HD2 ARG 49 21.265 -9.396 1.960 367 HD3 ARG 49 HD3 ARG 49 21.607 -10.987 1.285 368 HE ARG 49 HE ARG 49 22.839 -10.470 3.900 369 HH11 ARG 49 HH11 ARG 49 19.974 -12.013 2.332 370 HH12 ARG 49 HH12 ARG 49 19.624 -12.887 3.665 371 HH21 ARG 49 HH21 ARG 49 22.273 -11.534 5.613 372 HH22 ARG 49 HH22 ARG 49 20.890 -12.580 5.641 373 H LYS 50 H LYS 50 20.870 -7.889 -1.069 374 HA LYS 50 HA LYS 50 21.829 -6.422 -3.483 375 HB2 LYS 50 HB2 LYS 50 19.546 -5.916 -4.153 376 HB3 LYS 50 HB3 LYS 50 19.856 -7.628 -4.222 377 HG2 LYS 50 HG2 LYS 50 18.638 -7.952 -2.071 378 HG3 LYS 50 HG3 LYS 50 18.363 -6.215 -1.943 379 HD2 LYS 50 HD2 LYS 50 17.337 -7.942 -4.226 380 HD3 LYS 50 HD3 LYS 50 16.409 -7.552 -2.769 381 HE2 LYS 50 HE2 LYS 50 16.267 -5.251 -3.297 382 HE3 LYS 50 HE3 LYS 50 17.520 -5.376 -4.541 383 HZ1 LYS 50 HZ1 LYS 50 14.854 -6.710 -4.775 384 HZ2 LYS 50 HZ2 LYS 50 15.294 -5.314 -5.521 385 HZ3 LYS 50 HZ3 LYS 50 16.059 -6.711 -5.875 386 H LYS 51 H LYS 51 20.538 -4.234 -3.511 387 HA LYS 51 HA LYS 51 21.435 -2.621 -1.318 388 HB2 LYS 51 HB2 LYS 51 19.199 -1.809 -3.199 389 HB3 LYS 51 HB3 LYS 51 20.406 -0.793 -2.428 390 HG2 LYS 51 HG2 LYS 51 20.757 -2.664 -4.788 391 HG3 LYS 51 HG3 LYS 51 20.860 -0.907 -4.774 392 HD2 LYS 51 HD2 LYS 51 22.917 -1.057 -3.348 393 HD3 LYS 51 HD3 LYS 51 22.867 -2.819 -3.479 394 HE2 LYS 51 HE2 LYS 51 23.178 -0.839 -5.775 395 HE3 LYS 51 HE3 LYS 51 24.453 -1.841 -5.078 396 HZ1 LYS 51 HZ1 LYS 51 23.205 -3.830 -5.836 397 HZ2 LYS 51 HZ2 LYS 51 22.067 -2.870 -6.520 398 HZ3 LYS 51 HZ3 LYS 51 23.591 -2.862 -7.089 399 H ARG 52 H ARG 52 20.188 -1.383 0.190 400 HA ARG 52 HA ARG 52 17.942 -2.739 1.487 401 HB2 ARG 52 HB2 ARG 52 19.497 -0.192 1.935 402 HB3 ARG 52 HB3 ARG 52 17.896 -0.320 2.633 403 HG2 ARG 52 HG2 ARG 52 19.617 -0.984 4.228 404 HG3 ARG 52 HG3 ARG 52 18.473 -2.282 3.910 405 HD2 ARG 52 HD2 ARG 52 20.109 -3.528 2.659 406 HD3 ARG 52 HD3 ARG 52 21.168 -2.119 2.533 407 HE ARG 52 HE ARG 52 21.954 -2.415 4.695 408 HH11 ARG 52 HH11 ARG 52 19.119 -4.600 4.515 409 HH12 ARG 52 HH12 ARG 52 19.633 -5.460 5.880 410 HH21 ARG 52 HH21 ARG 52 22.565 -3.699 6.361 411 HH22 ARG 52 HH22 ARG 52 21.408 -4.816 7.017 412 H ARG 53 H ARG 53 15.964 -1.426 2.024 413 HA ARG 53 HA ARG 53 14.593 -0.233 -0.333 414 HB2 ARG 53 HB2 ARG 53 12.923 -2.123 -0.310 415 HB3 ARG 53 HB3 ARG 53 14.519 -2.626 -0.827 416 HG2 ARG 53 HG2 ARG 53 14.951 -3.867 1.075 417 HG3 ARG 53 HG3 ARG 53 13.891 -2.930 2.121 418 HD2 ARG 53 HD2 ARG 53 12.758 -4.640 -0.101 419 HD3 ARG 53 HD3 ARG 53 13.205 -5.324 1.468 420 HE ARG 53 HE ARG 53 11.565 -3.082 1.991 421 HH11 ARG 53 HH11 ARG 53 11.144 -6.275 0.532 422 HH12 ARG 53 HH12 ARG 53 9.513 -6.375 1.215 423 HH21 ARG 53 HH21 ARG 53 9.478 -3.423 2.785 424 HH22 ARG 53 HH22 ARG 53 8.702 -4.967 2.379 425 H GLN 54 H GLN 54 12.046 -0.368 0.350 426 HA GLN 54 HA GLN 54 11.697 -0.058 3.291 427 HB2 GLN 54 HB2 GLN 54 11.856 2.237 2.487 428 HB3 GLN 54 HB3 GLN 54 10.557 1.961 1.315 429 HG2 GLN 54 HG2 GLN 54 8.933 1.598 3.085 430 HG3 GLN 54 HG3 GLN 54 10.198 1.505 4.315 431 HE21 GLN 54 HE21 GLN 54 10.782 5.052 4.326 432 HE22 GLN 54 HE22 GLN 54 11.450 3.541 4.787 433 H ARG 55 H ARG 55 9.860 -0.080 0.199 434 HA ARG 55 HA ARG 55 8.226 -2.371 1.210 435 HB2 ARG 55 HB2 ARG 55 6.253 -1.433 0.167 436 HB3 ARG 55 HB3 ARG 55 6.895 -0.390 1.432 437 HG2 ARG 55 HG2 ARG 55 7.950 1.056 -0.351 438 HG3 ARG 55 HG3 ARG 55 7.228 0.031 -1.575 439 HD2 ARG 55 HD2 ARG 55 5.793 1.947 -1.303 440 HD3 ARG 55 HD3 ARG 55 4.957 0.543 -0.655 441 HE ARG 55 HE ARG 55 4.926 1.563 1.416 442 HH11 ARG 55 HH11 ARG 55 7.310 3.316 -0.458 443 HH12 ARG 55 HH12 ARG 55 7.827 4.254 0.911 444 HH21 ARG 55 HH21 ARG 55 5.621 2.866 3.118 445 HH22 ARG 55 HH22 ARG 55 7.014 3.899 2.859 446 H ARG 56 H ARG 56 7.349 -3.733 -0.358 447 HA ARG 56 HA ARG 56 8.136 -3.691 -3.138 448 HB2 ARG 56 HB2 ARG 56 10.223 -4.521 -1.734 449 HB3 ARG 56 HB3 ARG 56 9.262 -5.963 -1.438 450 HG2 ARG 56 HG2 ARG 56 10.807 -6.374 -3.228 451 HG3 ARG 56 HG3 ARG 56 9.186 -6.371 -3.916 452 HD2 ARG 56 HD2 ARG 56 9.537 -4.045 -4.731 453 HD3 ARG 56 HD3 ARG 56 11.160 -4.048 -4.006 454 HE ARG 56 HE ARG 56 10.949 -6.324 -5.703 455 HH11 ARG 56 HH11 ARG 56 11.114 -2.835 -6.147 456 HH12 ARG 56 HH12 ARG 56 11.793 -3.004 -7.735 457 HH21 ARG 56 HH21 ARG 56 11.720 -6.488 -7.587 458 HH22 ARG 56 HH22 ARG 56 12.137 -5.094 -8.590 459 H ARG 57 H ARG 57 7.220 -5.573 -4.291 460 HA ARG 57 HA ARG 57 5.510 -7.463 -2.851 461 HB2 ARG 57 HB2 ARG 57 4.086 -5.404 -3.145 462 HB3 ARG 57 HB3 ARG 57 4.282 -5.539 -4.892 463 HG2 ARG 57 HG2 ARG 57 3.095 -7.679 -4.909 464 HG3 ARG 57 HG3 ARG 57 3.031 -7.713 -3.140 465 HD2 ARG 57 HD2 ARG 57 1.736 -5.576 -4.887 466 HD3 ARG 57 HD3 ARG 57 0.898 -7.011 -4.271 467 HE ARG 57 HE ARG 57 2.023 -5.783 -2.019 468 HH11 ARG 57 HH11 ARG 57 -0.405 -4.887 -4.380 469 HH12 ARG 57 HH12 ARG 57 -1.254 -3.864 -3.254 470 HH21 ARG 57 HH21 ARG 57 0.890 -4.470 -0.634 471 HH22 ARG 57 HH22 ARG 57 -0.532 -3.638 -1.188 472 H ALA 58 H ALA 58 5.084 -9.310 -4.016 473 HA ALA 58 HA ALA 58 5.628 -9.441 -6.915 474 HB1 ALA 58 HB1 ALA 58 6.932 -11.300 -4.872 475 HB2 ALA 58 HB2 ALA 58 7.030 -11.461 -6.640 476 HB3 ALA 58 HB3 ALA 58 7.766 -10.062 -5.837 477 H HIS 59 H HIS 59 4.742 -11.385 -7.898 478 HA HIS 59 HA HIS 59 2.832 -13.053 -6.404 479 HB2 HIS 59 HB2 HIS 59 1.541 -10.964 -6.755 480 HB3 HIS 59 HB3 HIS 59 1.850 -11.052 -8.487 481 HD2 HIS 59 HD2 HIS 59 0.036 -13.086 -5.691 482 HE1 HIS 59 HE1 HIS 59 -1.933 -13.948 -9.379 483 HE2 HIS 59 HE2 HIS 59 -1.973 -14.334 -6.861 484 H GLN 60 H GLN 60 3.983 -12.040 -9.643 485 HA GLN 60 HA GLN 60 4.240 -14.853 -10.512 486 HB2 GLN 60 HB2 GLN 60 1.927 -14.101 -11.112 487 HB3 GLN 60 HB3 GLN 60 2.620 -12.767 -12.043 488 HG2 GLN 60 HG2 GLN 60 3.735 -14.398 -13.552 489 HG3 GLN 60 HG3 GLN 60 3.139 -15.729 -12.557 490 HE21 GLN 60 HE21 GLN 60 0.337 -15.948 -14.731 491 HE22 GLN 60 HE22 GLN 60 1.663 -16.783 -13.930 Start of MODEL 5 1 H5' G 16 H5' G 16 1.231 -1.689 -2.448 2 H5'' G 16 H5" G 16 2.718 -2.473 -2.993 3 H4' G 16 H4' G 16 2.006 -0.873 -4.642 4 H3' G 16 H3' G 16 4.469 0.015 -3.134 5 H2' G 16 H2' G 16 4.596 1.856 -4.676 6 HO2' G 16 HO2' G 16 3.688 0.399 -6.501 7 H1' G 16 H1' G 16 1.976 2.523 -4.496 8 H8 G 16 H8 G 16 2.821 1.293 -1.068 9 H1 G 16 H1 G 16 5.213 7.145 -2.309 10 H21 G 16 H21 G 16 5.280 7.434 -4.504 11 H22 G 16 H22 G 16 4.536 6.249 -5.583 12 HO5' G 16 HO5' G 16 2.781 -1.876 -0.747 13 H5' G 17 H5' G 17 5.590 0.607 -7.210 14 H5'' G 17 H5" G 17 7.151 -0.189 -7.438 15 H4' G 17 H4' G 17 7.319 2.078 -8.211 16 H3' G 17 H3' G 17 8.742 1.660 -5.572 17 H2' G 17 H2' G 17 9.739 3.810 -5.977 18 HO2' G 17 HO2' G 17 9.509 4.937 -7.897 19 H1' G 17 H1' G 17 7.335 4.964 -6.580 20 H8 G 17 H8 G 17 6.676 2.320 -3.936 21 H1 G 17 H1 G 17 9.133 7.844 -1.685 22 H21 G 17 H21 G 17 10.023 8.969 -3.378 23 H22 G 17 H22 G 17 9.846 8.374 -5.031 24 H5' G 18 H5' G 18 11.544 3.081 -8.268 25 H5'' G 18 H5" G 18 13.126 2.319 -8.091 26 H4' G 18 H4' G 18 13.241 4.773 -7.977 27 H3' G 18 H3' G 18 13.995 3.296 -5.450 28 H2' G 18 H2' G 18 14.708 5.437 -4.585 29 HO2' G 18 HO2' G 18 15.480 6.133 -6.830 30 H1' G 18 H1' G 18 12.493 6.783 -5.422 31 H8 G 18 H8 G 18 11.329 3.325 -4.355 32 H1 G 18 H1 G 18 12.208 7.506 0.481 33 H21 G 18 H21 G 18 13.498 9.160 -0.241 34 H22 G 18 H22 G 18 13.934 9.263 -1.949 35 H5' C 19 H5' C 19 17.390 5.790 -6.241 36 H5'' C 19 H5" C 19 18.875 4.906 -5.873 37 H4' C 19 H4' C 19 18.724 6.965 -4.572 38 H3' C 19 H3' C 19 18.438 4.457 -2.904 39 H2' C 19 H2' C 19 18.640 5.935 -0.987 40 HO2' C 19 HO2' C 19 20.191 7.421 -2.175 41 H1' C 19 H1' C 19 16.844 7.741 -1.968 42 H41 C 19 H41 C 19 13.352 3.887 1.483 43 H42 C 19 H42 C 19 13.250 2.678 0.194 44 H5 C 19 H5 C 19 14.593 2.833 -1.811 45 H6 C 19 H6 C 19 16.061 4.301 -3.068 46 H5' A 20 H5' A 20 21.688 6.595 -1.026 47 H5'' A 20 H5" A 20 22.902 5.412 -0.534 48 H4' A 20 H4' A 20 22.213 6.784 1.343 49 H3' A 20 H3' A 20 21.265 3.913 1.584 50 H2' A 20 H2' A 20 20.717 4.499 3.863 51 HO2' A 20 HO2' A 20 22.609 6.042 4.061 52 H1' A 20 H1' A 20 19.399 6.760 3.131 53 H8 A 20 H8 A 20 18.931 4.210 0.323 54 H61 A 20 H61 A 20 14.377 2.002 4.004 55 H62 A 20 H62 A 20 15.064 1.896 2.378 56 H2 A 20 H2 A 20 16.714 4.783 6.347 57 H5' G 21 H5' G 21 23.436 4.450 5.189 58 H5'' G 21 H5" G 21 24.411 2.999 5.433 59 H4' G 21 H4' G 21 23.124 3.372 7.382 60 H3' G 21 H3' G 21 21.854 1.067 5.858 61 H2' G 21 H2' G 21 20.723 0.674 7.948 62 HO2' G 21 HO2' G 21 21.082 1.985 9.786 63 H1' G 21 H1' G 21 19.868 3.253 8.039 64 H8 G 21 H8 G 21 20.366 2.295 4.382 65 H1 G 21 H1 G 21 15.259 -0.527 7.115 66 H21 G 21 H21 G 21 15.373 -0.270 9.307 67 H22 G 21 H22 G 21 16.653 0.721 10.010 68 H5' A 22 H5' A 22 22.773 -0.205 9.604 69 H5'' A 22 H5" A 22 24.186 -1.215 9.471 70 H4' A 22 H4' A 22 22.954 -2.218 11.216 71 H3' A 22 H3' A 22 22.415 -3.677 8.643 72 H2' A 22 H2' A 22 20.702 -4.937 9.508 73 HO2' A 22 HO2' A 22 20.311 -5.237 11.736 74 H1' A 22 H1' A 22 19.538 -3.056 11.150 75 H8 A 22 H8 A 22 20.543 -1.461 7.799 76 H61 A 22 H61 A 22 15.228 -3.683 5.613 77 H62 A 22 H62 A 22 16.397 -2.395 5.436 78 H2 A 22 H2 A 22 15.747 -5.377 9.626 79 H5' U 23 H5' U 23 26.139 -6.047 7.393 80 H5'' U 23 H5" U 23 24.894 -5.769 6.176 81 H4' U 23 H4' U 23 24.389 -7.191 8.824 82 H3' U 23 H3' U 23 25.750 -8.306 6.580 83 H2' U 23 H2' U 23 23.873 -8.287 5.196 84 HO2' U 23 HO2' U 23 24.039 -10.664 6.616 85 H1' U 23 H1' U 23 22.232 -8.878 7.687 86 H3 U 23 H3 U 23 18.595 -9.572 5.163 87 H5 U 23 H5 U 23 20.588 -6.556 3.022 88 H6 U 23 H6 U 23 22.297 -6.513 4.776 89 H5' U 25 H5' U 25 24.485 -8.455 10.584 90 H5'' U 25 H5" U 25 26.148 -7.911 10.873 91 H4' U 25 H4' U 25 24.841 -9.995 12.651 92 H3' U 25 H3' U 25 23.575 -7.639 12.436 93 H2' U 25 H2' U 25 25.323 -6.182 12.553 94 HO2' U 25 HO2' U 25 24.003 -6.016 14.648 95 H1' U 25 H1' U 25 26.956 -7.478 14.660 96 H3 U 25 H3 U 25 30.446 -7.234 10.995 97 H5 U 25 H5 U 25 28.749 -3.612 12.198 98 H6 U 25 H6 U 25 27.063 -4.844 13.437 99 H5' G 26 H5' G 26 21.823 -9.352 12.183 100 H5'' G 26 H5" G 26 21.307 -7.646 12.271 101 H4' G 26 H4' G 26 19.181 -9.344 13.055 102 H3' G 26 H3' G 26 20.128 -9.943 10.220 103 H2' G 26 H2' G 26 17.849 -10.389 9.816 104 HO2' G 26 HO2' G 26 16.297 -10.595 11.400 105 H1' G 26 H1' G 26 16.988 -8.150 11.194 106 H8 G 26 H8 G 26 20.023 -7.034 9.318 107 H1 G 26 H1 G 26 14.871 -7.996 5.570 108 H21 G 26 H21 G 26 13.421 -9.279 6.751 109 H22 G 26 H22 G 26 13.774 -9.647 8.437 110 H5' A 27 H5' A 27 17.559 -13.071 11.625 111 H5'' A 27 H5" A 27 18.213 -14.651 11.176 112 H4' A 27 H4' A 27 15.911 -14.527 10.498 113 H3' A 27 H3' A 27 17.798 -14.331 8.126 114 H2' A 27 H2' A 27 15.832 -14.692 6.806 115 HO2' A 27 HO2' A 27 14.840 -16.196 8.493 116 H1' A 27 H1' A 27 14.350 -12.856 8.193 117 H8 A 27 H8 A 27 17.838 -11.369 8.005 118 H61 A 27 H61 A 27 16.472 -10.341 1.956 119 H62 A 27 H62 A 27 17.560 -9.847 3.206 120 H2 A 27 H2 A 27 13.386 -12.895 3.574 121 H5' G 28 H5' G 28 15.446 -17.695 7.316 122 H5'' G 28 H5" G 28 16.361 -18.967 6.508 123 H4' G 28 H4' G 28 14.342 -18.160 5.281 124 H3' G 28 H3' G 28 16.992 -17.838 3.825 125 H2' G 28 H2' G 28 15.662 -17.305 1.932 126 HO2' G 28 HO2' G 28 13.385 -17.391 1.930 127 H1' G 28 H1' G 28 14.154 -15.482 3.259 128 H8 G 28 H8 G 28 17.469 -15.201 4.937 129 H1 G 28 H1 G 28 17.559 -13.015 -1.099 130 H21 G 28 H21 G 28 15.875 -13.987 -2.221 131 H22 G 28 H22 G 28 14.748 -15.010 -1.327 132 H5' C 29 H5' C 29 14.519 -19.711 1.310 133 H5'' C 29 H5" C 29 15.210 -21.158 0.594 134 H4' C 29 H4' C 29 14.287 -19.609 -1.090 135 H3' C 29 H3' C 29 17.263 -20.122 -1.143 136 H2' C 29 H2' C 29 17.240 -19.016 -3.289 137 HO2' C 29 HO2' C 29 15.272 -19.803 -4.167 138 H1' C 29 H1' C 29 15.627 -16.979 -2.475 139 H41 C 29 H41 C 29 21.086 -14.169 -1.716 140 H42 C 29 H42 C 29 21.131 -14.641 -0.027 141 H5 C 29 H5 C 29 19.636 -16.308 0.892 142 H6 C 29 H6 C 29 17.660 -17.644 0.451 143 H5' C 30 H5' C 30 15.562 -21.780 -4.745 144 H5'' C 30 H5" C 30 16.427 -23.218 -5.308 145 H4' C 30 H4' C 30 16.457 -21.378 -6.973 146 H3' C 30 H3' C 30 19.118 -22.178 -5.761 147 H2' C 30 H2' C 30 20.169 -20.625 -7.183 148 HO2' C 30 HO2' C 30 18.997 -21.136 -9.124 149 H1' C 30 H1' C 30 18.194 -18.678 -7.035 150 H41 C 30 H41 C 30 22.715 -16.479 -3.403 151 H42 C 30 H42 C 30 22.331 -17.549 -2.046 152 H5 C 30 H5 C 30 20.583 -19.250 -2.236 153 H6 C 30 H6 C 30 18.971 -20.245 -3.754 154 H5' U 31 H5' U 31 22.054 -23.906 -9.652 155 H5'' U 31 H5" U 31 22.278 -23.412 -7.978 156 H4' U 31 H4' U 31 22.378 -21.665 -10.368 157 H3' U 31 H3' U 31 24.300 -22.752 -8.355 158 H2' U 31 H2' U 31 25.466 -20.791 -8.075 159 HO2' U 31 HO2' U 31 25.763 -19.275 -9.547 160 H1' U 31 H1' U 31 23.356 -18.991 -8.437 161 H3 U 31 H3 U 31 24.765 -18.264 -4.176 162 H5 U 31 H5 U 31 22.745 -21.914 -3.927 163 H6 U 31 H6 U 31 22.412 -21.867 -6.337 164 H5' G 32 H5' G 32 27.909 -23.833 -8.457 165 H5'' G 32 H5" G 32 27.098 -22.290 -8.131 166 H4' G 32 H4' G 32 29.553 -22.183 -7.844 167 H3' G 32 H3' G 32 28.153 -20.449 -9.824 168 H2' G 32 H2' G 32 30.160 -19.625 -10.800 169 HO2' G 32 HO2' G 32 31.218 -19.816 -8.480 170 H1' G 32 H1' G 32 31.447 -21.982 -11.052 171 H8 G 32 H8 G 32 28.456 -20.151 -12.177 172 H1 G 32 H1 G 32 29.131 -25.788 -15.230 173 H21 G 32 H21 G 32 30.636 -27.041 -14.111 174 H22 G 32 H22 G 32 31.393 -26.399 -12.661 175 H5' G 33 H5' G 33 31.192 -17.846 -8.253 176 H5'' G 33 H5" G 33 30.469 -16.356 -7.659 177 H4' G 33 H4' G 33 32.269 -15.934 -9.301 178 H3' G 33 H3' G 33 29.480 -15.039 -10.014 179 H2' G 33 H2' G 33 30.124 -14.441 -12.181 180 HO2' G 33 HO2' G 33 32.174 -13.417 -11.231 181 H1' G 33 H1' G 33 32.030 -16.395 -12.657 182 H8 G 33 H8 G 33 28.575 -17.421 -11.169 183 H1 G 33 H1 G 33 29.084 -17.581 -17.593 184 H21 G 33 H21 G 33 31.127 -16.823 -18.172 185 H22 G 33 H22 G 33 32.250 -16.310 -16.922 186 H5' G 34 H5' G 34 28.712 -10.616 -7.904 187 H5'' G 34 H5" G 34 27.655 -11.987 -7.556 188 H4' G 34 H4' G 34 27.502 -10.597 -10.165 189 H3' G 34 H3' G 34 26.379 -9.555 -7.564 190 H2' G 34 H2' G 34 24.248 -9.430 -8.188 191 HO2' G 34 HO2' G 34 23.477 -9.431 -10.277 192 H1' G 34 H1' G 34 23.969 -11.742 -9.544 193 H8 G 34 H8 G 34 25.928 -10.927 -6.234 194 H1 G 34 H1 G 34 22.173 -16.135 -6.107 195 H21 G 34 H21 G 34 21.060 -16.256 -8.005 196 H22 G 34 H22 G 34 21.361 -15.109 -9.314 197 H5' A 35 H5' A 35 28.369 -4.566 -8.531 198 H5'' A 35 H5" A 35 27.263 -5.722 -7.796 199 H4' A 35 H4' A 35 26.190 -3.787 -8.948 200 H3' A 35 H3' A 35 25.409 -6.593 -9.413 201 H2' A 35 H2' A 35 24.383 -6.339 -11.464 202 HO2' A 35 HO2' A 35 23.351 -4.238 -10.428 203 H1' A 35 H1' A 35 25.828 -4.327 -12.607 204 H8 A 35 H8 A 35 25.988 -7.940 -11.553 205 H61 A 35 H61 A 35 30.556 -8.244 -15.832 206 H62 A 35 H62 A 35 29.491 -9.253 -14.847 207 H2 A 35 H2 A 35 29.785 -4.086 -15.077 208 H5' G 36 H5' G 36 22.558 -6.872 -9.917 209 H5'' G 36 H5" G 36 21.361 -6.130 -8.856 210 H4' G 36 H4' G 36 20.684 -8.195 -10.208 211 H3' G 36 H3' G 36 20.196 -8.034 -7.242 212 H2' G 36 H2' G 36 18.942 -10.073 -7.521 213 HO2' G 36 HO2' G 36 18.346 -10.918 -9.486 214 H1' G 36 H1' G 36 20.800 -11.330 -9.052 215 H8 G 36 H8 G 36 22.863 -9.387 -6.626 216 H1 G 36 H1 G 36 19.899 -14.447 -3.888 217 H21 G 36 H21 G 36 18.391 -15.242 -5.267 218 H22 G 36 H22 G 36 18.232 -14.592 -6.901 219 H5' C 37 H5' C 37 16.590 -8.978 -9.171 220 H5'' C 37 H5" C 37 15.171 -8.215 -8.466 221 H4' C 37 H4' C 37 14.971 -10.657 -8.552 222 H3' C 37 H3' C 37 15.128 -9.488 -5.772 223 H2' C 37 H2' C 37 14.399 -11.696 -5.044 224 HO2' C 37 HO2' C 37 13.071 -12.039 -7.089 225 H1' C 37 H1' C 37 16.283 -12.961 -6.507 226 H41 C 37 H41 C 37 19.212 -11.857 -1.003 227 H42 C 37 H42 C 37 19.995 -10.503 -1.775 228 H5 C 37 H5 C 37 19.365 -9.593 -3.860 229 H6 C 37 H6 C 37 17.898 -9.835 -5.773 230 H5' U 38 H5' U 38 11.499 -11.708 -5.795 231 H5'' U 38 H5" U 38 10.199 -10.658 -5.216 232 H4' U 38 H4' U 38 10.113 -12.741 -4.017 233 H3' U 38 H3' U 38 11.119 -10.432 -2.322 234 H2' U 38 H2' U 38 10.917 -11.841 -0.446 235 HO2' U 38 HO2' U 38 8.966 -13.038 -1.453 236 H1' U 38 H1' U 38 12.266 -13.899 -1.608 237 H3 U 38 H3 U 38 14.840 -11.484 1.386 238 H5 U 38 H5 U 38 15.589 -9.821 -2.387 239 H6 U 38 H6 U 38 13.716 -11.090 -3.256 240 H5' C 39 H5' C 39 8.509 -11.715 0.189 241 H5'' C 39 H5" C 39 7.372 -10.437 0.623 242 H4' C 39 H4' C 39 8.329 -11.335 2.614 243 H3' C 39 H3' C 39 9.619 -8.646 2.048 244 H2' C 39 H2' C 39 10.159 -8.757 4.387 245 HO2' C 39 HO2' C 39 9.343 -10.240 5.765 246 H1' C 39 H1' C 39 11.125 -11.315 4.044 247 H41 C 39 H41 C 39 15.809 -7.133 3.531 248 H42 C 39 H42 C 39 15.642 -7.074 1.781 249 H5 C 39 H5 C 39 13.758 -8.131 0.613 250 H6 C 39 H6 C 39 11.798 -9.582 0.911 251 H5' U 40 H5' U 40 7.093 -8.598 5.367 252 H5'' U 40 H5" U 40 6.162 -7.119 5.684 253 H4' U 40 H4' U 40 7.447 -7.823 7.673 254 H3' U 40 H3' U 40 8.436 -5.285 6.351 255 H2' U 40 H2' U 40 9.857 -5.020 8.268 256 HO2' U 40 HO2' U 40 9.702 -6.268 10.112 257 H1' U 40 H1' U 40 10.694 -7.636 8.244 258 H3 U 40 H3 U 40 14.198 -5.002 6.926 259 H5 U 40 H5 U 40 11.939 -5.601 3.433 260 H6 U 40 H6 U 40 10.218 -6.683 4.747 261 H5' C 41 H5' C 41 7.774 -4.355 10.341 262 H5'' C 41 H5" C 41 7.052 -2.763 10.572 263 H4' C 41 H4' C 41 9.139 -3.017 11.829 264 H3' C 41 H3' C 41 9.253 -0.994 9.582 265 H2' C 41 H2' C 41 11.389 -0.337 10.516 266 HO2' C 41 HO2' C 41 10.592 -0.838 12.809 267 H1' C 41 H1' C 41 12.292 -2.896 10.764 268 H41 C 41 H41 C 41 14.270 -1.107 5.093 269 H42 C 41 H42 C 41 12.836 -1.771 4.325 270 H5 C 41 H5 C 41 10.900 -2.468 5.612 271 H6 C 41 H6 C 41 10.080 -2.868 7.867 272 H5' U 42 H5' U 42 10.515 1.186 13.005 273 H5'' U 42 H5" U 42 9.717 2.762 13.013 274 H4' U 42 H4' U 42 12.125 3.019 13.161 275 H3' U 42 H3' U 42 10.988 3.924 10.502 276 H2' U 42 H2' U 42 13.173 4.907 10.132 277 HO2' U 42 HO2' U 42 13.422 5.390 12.554 278 H1' U 42 H1' U 42 14.496 2.646 10.911 279 H3 U 42 H3 U 42 14.811 2.977 6.354 280 H5 U 42 H5 U 42 11.133 1.115 7.010 281 H6 U 42 H6 U 42 11.349 1.581 9.392 282 H5' G 43 H5' G 43 13.114 7.276 11.874 283 H5'' G 43 H5" G 43 12.156 8.736 11.615 284 H4' G 43 H4' G 43 14.375 8.920 10.610 285 H3' G 43 H3' G 43 12.089 8.821 8.628 286 H2' G 43 H2' G 43 13.733 9.428 6.970 287 HO2' G 43 HO2' G 43 14.913 10.864 8.606 288 H1' G 43 H1' G 43 15.625 7.666 7.887 289 H8 G 43 H8 G 43 12.319 5.866 8.171 290 H1 G 43 H1 G 43 14.688 6.104 2.180 291 H21 G 43 H21 G 43 16.193 7.704 2.065 292 H22 G 43 H22 G 43 16.688 8.585 3.516 293 H5' C 44 H5' C 44 14.079 12.466 7.673 294 H5'' C 44 H5" C 44 12.886 13.719 7.319 295 H4' C 44 H4' C 44 14.420 13.395 5.444 296 H3' C 44 H3' C 44 11.592 12.474 4.865 297 H2' C 44 H2' C 44 12.310 12.279 2.589 298 HO2' C 44 HO2' C 44 14.220 13.082 1.812 299 H1' C 44 H1' C 44 14.648 10.996 3.239 300 H41 C 44 H41 C 44 10.738 6.286 2.107 301 H42 C 44 H42 C 44 9.967 6.387 3.680 302 H5 C 44 H5 C 44 10.540 8.168 5.264 303 H6 C 44 H6 C 44 11.950 10.126 5.595 304 H5' C 45 H5' C 45 12.600 15.257 1.867 305 H5'' C 45 H5" C 45 11.221 16.263 1.414 306 H4' C 45 H4' C 45 12.141 15.102 -0.527 307 H3' C 45 H3' C 45 9.405 14.085 0.288 308 H2' C 45 H2' C 45 9.427 12.892 -1.792 309 HO2' C 45 HO2' C 45 10.981 13.182 -3.378 310 H1' C 45 H1' C 45 11.994 11.971 -1.444 311 H41 C 45 H41 C 45 8.258 7.455 0.698 312 H42 C 45 H42 C 45 8.083 8.213 2.284 313 H5 C 45 H5 C 45 8.987 10.425 2.749 314 H6 C 45 H6 C 45 10.265 12.265 1.800 315 H5' C 46 H5' C 46 9.078 15.098 -3.731 316 H5'' C 46 H5" C 46 7.545 15.897 -4.088 317 H4' C 46 H4' C 46 7.857 13.916 -5.491 318 H3' C 46 H3' C 46 5.635 13.691 -3.439 319 HO3' C 46 HO3' C 46 5.368 13.953 -6.233 320 H2' C 46 H2' C 46 5.026 11.642 -4.478 321 HO2' C 46 HO2' C 46 5.822 10.998 -6.508 322 H1' C 46 H1' C 46 7.646 10.763 -4.851 323 H41 C 46 H41 C 46 5.180 7.876 0.134 324 H42 C 46 H42 C 46 5.408 9.269 1.198 325 H5 C 46 H5 C 46 6.360 11.365 0.368 326 H6 C 46 H6 C 46 7.169 12.505 -1.631 327 H1 GLY 44 H1 GLY 44 35.788 -17.138 7.787 328 H2 GLY 44 H2 GLY 44 36.886 -15.953 8.050 329 H3 GLY 44 H3 GLY 44 37.368 -17.392 7.429 330 HA2 GLY 44 HA2 GLY 44 37.322 -15.743 5.688 331 HA3 GLY 44 HA3 GLY 44 36.118 -17.015 5.409 332 H ILE 45 H ILE 45 35.023 -15.468 4.058 333 HA ILE 45 HA ILE 45 33.132 -13.709 5.522 334 HB ILE 45 HB ILE 45 33.357 -11.953 3.803 335 HG12 ILE 45 HG12 ILE 45 35.895 -13.383 2.896 336 HG13 ILE 45 HG13 ILE 45 34.378 -13.353 1.996 337 HG21 ILE 45 HG21 ILE 45 35.997 -12.394 5.241 338 HG22 ILE 45 HG22 ILE 45 35.256 -10.852 4.767 339 HG23 ILE 45 HG23 ILE 45 34.504 -11.831 6.026 340 HD11 ILE 45 HD11 ILE 45 36.133 -10.950 2.629 341 HD12 ILE 45 HD12 ILE 45 35.857 -11.710 1.055 342 HD13 ILE 45 HD13 ILE 45 34.526 -10.859 1.863 343 H SER 46 H SER 46 31.302 -13.025 4.125 344 HA SER 46 HA SER 46 30.562 -14.945 1.966 345 HB2 SER 46 HB2 SER 46 28.898 -14.366 4.454 346 HB3 SER 46 HB3 SER 46 28.362 -15.299 3.046 347 HG SER 46 HG SER 46 29.115 -16.643 4.751 348 H TYR 47 H TYR 47 28.763 -14.275 0.690 349 HA TYR 47 HA TYR 47 27.658 -11.565 0.930 350 HB2 TYR 47 HB2 TYR 47 29.694 -10.977 -0.157 351 HB3 TYR 47 HB3 TYR 47 29.657 -12.399 -1.187 352 HD1 TYR 47 HD1 TYR 47 27.549 -9.323 -0.495 353 HD2 TYR 47 HD2 TYR 47 29.068 -12.134 -3.404 354 HE1 TYR 47 HE1 TYR 47 26.324 -8.121 -2.306 355 HE2 TYR 47 HE2 TYR 47 27.909 -10.891 -5.208 356 HH TYR 47 HH TYR 47 25.829 -8.049 -4.561 357 H GLY 48 H GLY 48 25.893 -11.203 -0.457 358 HA2 GLY 48 HA2 GLY 48 24.676 -12.568 -2.454 359 HA3 GLY 48 HA3 GLY 48 24.299 -13.604 -1.068 360 H ARG 49 H ARG 49 24.275 -10.104 -1.935 361 HA ARG 49 HA ARG 49 21.641 -9.683 -0.624 362 HB2 ARG 49 HB2 ARG 49 24.228 -8.269 0.172 363 HB3 ARG 49 HB3 ARG 49 22.630 -7.715 0.644 364 HG2 ARG 49 HG2 ARG 49 23.903 -10.348 1.480 365 HG3 ARG 49 HG3 ARG 49 23.694 -8.898 2.458 366 HD2 ARG 49 HD2 ARG 49 21.197 -9.112 2.145 367 HD3 ARG 49 HD3 ARG 49 21.467 -10.664 1.360 368 HE ARG 49 HE ARG 49 22.678 -10.319 4.035 369 HH11 ARG 49 HH11 ARG 49 19.947 -11.899 2.263 370 HH12 ARG 49 HH12 ARG 49 19.614 -12.873 3.527 371 HH21 ARG 49 HH21 ARG 49 22.127 -11.513 5.624 372 HH22 ARG 49 HH22 ARG 49 20.798 -12.629 5.551 373 H LYS 50 H LYS 50 20.882 -7.444 -0.846 374 HA LYS 50 HA LYS 50 21.739 -6.008 -3.309 375 HB2 LYS 50 HB2 LYS 50 19.473 -5.903 -4.144 376 HB3 LYS 50 HB3 LYS 50 19.986 -7.564 -4.042 377 HG2 LYS 50 HG2 LYS 50 18.536 -8.019 -2.178 378 HG3 LYS 50 HG3 LYS 50 18.412 -6.320 -1.750 379 HD2 LYS 50 HD2 LYS 50 17.184 -5.932 -3.947 380 HD3 LYS 50 HD3 LYS 50 17.064 -7.698 -4.098 381 HE2 LYS 50 HE2 LYS 50 15.872 -7.798 -1.930 382 HE3 LYS 50 HE3 LYS 50 16.149 -6.073 -1.681 383 HZ1 LYS 50 HZ1 LYS 50 14.433 -7.210 -3.854 384 HZ2 LYS 50 HZ2 LYS 50 13.915 -6.446 -2.519 385 HZ3 LYS 50 HZ3 LYS 50 14.770 -5.628 -3.646 386 H LYS 51 H LYS 51 20.117 -4.091 -3.584 387 HA LYS 51 HA LYS 51 20.352 -2.179 -1.423 388 HB2 LYS 51 HB2 LYS 51 18.710 -2.238 -3.999 389 HB3 LYS 51 HB3 LYS 51 18.707 -0.883 -2.882 390 HG2 LYS 51 HG2 LYS 51 20.147 -0.410 -4.743 391 HG3 LYS 51 HG3 LYS 51 21.083 -0.469 -3.251 392 HD2 LYS 51 HD2 LYS 51 22.082 -2.569 -3.844 393 HD3 LYS 51 HD3 LYS 51 20.933 -2.820 -5.182 394 HE2 LYS 51 HE2 LYS 51 21.881 -0.971 -6.424 395 HE3 LYS 51 HE3 LYS 51 22.938 -0.532 -5.073 396 HZ1 LYS 51 HZ1 LYS 51 23.078 -3.183 -6.427 397 HZ2 LYS 51 HZ2 LYS 51 24.028 -1.907 -6.846 398 HZ3 LYS 51 HZ3 LYS 51 24.140 -2.572 -5.357 399 H ARG 52 H ARG 52 18.814 -1.429 -0.007 400 HA ARG 52 HA ARG 52 16.714 -3.380 0.778 401 HB2 ARG 52 HB2 ARG 52 17.775 -0.931 2.241 402 HB3 ARG 52 HB3 ARG 52 16.752 -2.209 2.907 403 HG2 ARG 52 HG2 ARG 52 18.595 -3.859 2.637 404 HG3 ARG 52 HG3 ARG 52 19.643 -2.590 1.955 405 HD2 ARG 52 HD2 ARG 52 19.354 -1.252 4.018 406 HD3 ARG 52 HD3 ARG 52 18.355 -2.526 4.696 407 HE ARG 52 HE ARG 52 21.266 -2.377 4.561 408 HH11 ARG 52 HH11 ARG 52 18.627 -4.694 5.135 409 HH12 ARG 52 HH12 ARG 52 19.515 -5.517 6.331 410 HH21 ARG 52 HH21 ARG 52 22.341 -3.493 6.122 411 HH22 ARG 52 HH22 ARG 52 21.496 -4.728 6.985 412 H ARG 53 H ARG 53 14.585 -2.606 1.542 413 HA ARG 53 HA ARG 53 13.507 -0.114 0.381 414 HB2 ARG 53 HB2 ARG 53 11.992 -1.144 -1.171 415 HB3 ARG 53 HB3 ARG 53 13.598 -1.748 -1.513 416 HG2 ARG 53 HG2 ARG 53 12.575 -3.764 -1.580 417 HG3 ARG 53 HG3 ARG 53 12.766 -3.729 0.169 418 HD2 ARG 53 HD2 ARG 53 10.408 -2.580 0.185 419 HD3 ARG 53 HD3 ARG 53 10.284 -3.102 -1.488 420 HE ARG 53 HE ARG 53 10.068 -4.718 0.931 421 HH11 ARG 53 HH11 ARG 53 10.739 -5.091 -2.543 422 HH12 ARG 53 HH12 ARG 53 10.338 -6.807 -2.407 423 HH21 ARG 53 HH21 ARG 53 9.519 -6.795 0.820 424 HH22 ARG 53 HH22 ARG 53 9.814 -7.697 -0.670 425 H GLN 54 H GLN 54 11.105 0.084 0.738 426 HA GLN 54 HA GLN 54 10.129 -1.332 3.173 427 HB2 GLN 54 HB2 GLN 54 9.345 0.865 4.078 428 HB3 GLN 54 HB3 GLN 54 11.086 0.640 4.080 429 HG2 GLN 54 HG2 GLN 54 11.419 2.176 2.291 430 HG3 GLN 54 HG3 GLN 54 9.721 2.120 1.804 431 HE21 GLN 54 HE21 GLN 54 10.902 4.577 4.828 432 HE22 GLN 54 HE22 GLN 54 11.696 3.095 4.730 433 H ARG 55 H ARG 55 7.867 -0.880 3.652 434 HA ARG 55 HA ARG 55 6.035 -0.342 1.368 435 HB2 ARG 55 HB2 ARG 55 6.291 -2.970 2.899 436 HB3 ARG 55 HB3 ARG 55 4.819 -2.527 2.035 437 HG2 ARG 55 HG2 ARG 55 6.025 -2.355 -0.088 438 HG3 ARG 55 HG3 ARG 55 7.541 -2.819 0.718 439 HD2 ARG 55 HD2 ARG 55 6.624 -4.938 1.376 440 HD3 ARG 55 HD3 ARG 55 5.025 -4.533 0.732 441 HE ARG 55 HE ARG 55 6.652 -4.282 -1.466 442 HH11 ARG 55 HH11 ARG 55 6.189 -6.978 0.788 443 HH12 ARG 55 HH12 ARG 55 6.514 -8.143 -0.508 444 HH21 ARG 55 HH21 ARG 55 7.058 -5.937 -2.971 445 HH22 ARG 55 HH22 ARG 55 7.003 -7.601 -2.403 446 H ARG 56 H ARG 56 3.701 -1.152 2.657 447 HA ARG 56 HA ARG 56 3.459 0.824 4.912 448 HB2 ARG 56 HB2 ARG 56 1.514 0.371 2.608 449 HB3 ARG 56 HB3 ARG 56 1.369 1.592 3.874 450 HG2 ARG 56 HG2 ARG 56 3.548 1.504 1.747 451 HG3 ARG 56 HG3 ARG 56 2.121 2.533 1.722 452 HD2 ARG 56 HD2 ARG 56 2.851 3.822 3.580 453 HD3 ARG 56 HD3 ARG 56 4.090 2.660 4.026 454 HE ARG 56 HE ARG 56 4.191 4.313 1.519 455 HH11 ARG 56 HH11 ARG 56 6.038 2.557 3.969 456 HH12 ARG 56 HH12 ARG 56 7.479 3.488 3.579 457 HH21 ARG 56 HH21 ARG 56 6.156 5.232 1.016 458 HH22 ARG 56 HH22 ARG 56 7.577 4.761 1.930 459 H ARG 57 H ARG 57 3.669 -2.114 5.052 460 HA ARG 57 HA ARG 57 1.051 -3.203 5.769 461 HB2 ARG 57 HB2 ARG 57 3.887 -4.274 6.074 462 HB3 ARG 57 HB3 ARG 57 2.423 -5.196 6.430 463 HG2 ARG 57 HG2 ARG 57 1.667 -4.957 4.078 464 HG3 ARG 57 HG3 ARG 57 3.116 -4.016 3.703 465 HD2 ARG 57 HD2 ARG 57 3.532 -6.225 2.957 466 HD3 ARG 57 HD3 ARG 57 4.526 -5.952 4.398 467 HE ARG 57 HE ARG 57 2.069 -7.156 5.205 468 HH11 ARG 57 HH11 ARG 57 4.947 -8.050 3.418 469 HH12 ARG 57 HH12 ARG 57 4.764 -9.750 3.796 470 HH21 ARG 57 HH21 ARG 57 1.908 -9.331 5.677 471 HH22 ARG 57 HH22 ARG 57 3.087 -10.444 5.051 472 H ALA 58 H ALA 58 2.957 -1.116 7.527 473 HA ALA 58 HA ALA 58 3.045 -2.205 10.098 474 HB1 ALA 58 HB1 ALA 58 3.398 0.128 10.811 475 HB2 ALA 58 HB2 ALA 58 4.298 -0.231 9.328 476 HB3 ALA 58 HB3 ALA 58 2.789 0.712 9.247 477 H HIS 59 H HIS 59 0.163 -1.171 8.499 478 HA HIS 59 HA HIS 59 -1.408 -1.293 11.041 479 HB2 HIS 59 HB2 HIS 59 -2.605 0.741 10.389 480 HB3 HIS 59 HB3 HIS 59 -0.888 1.052 10.571 481 HD2 HIS 59 HD2 HIS 59 0.489 1.819 8.425 482 HE1 HIS 59 HE1 HIS 59 -2.749 1.960 5.652 483 HE2 HIS 59 HE2 HIS 59 -0.301 2.561 6.023 484 H GLN 60 H GLN 60 -1.107 -2.839 8.203 485 HA GLN 60 HA GLN 60 -3.964 -3.499 7.921 486 HB2 GLN 60 HB2 GLN 60 -4.013 -2.966 5.529 487 HB3 GLN 60 HB3 GLN 60 -3.784 -1.532 6.525 488 HG2 GLN 60 HG2 GLN 60 -1.322 -1.621 6.021 489 HG3 GLN 60 HG3 GLN 60 -1.616 -2.964 4.918 490 HE21 GLN 60 HE21 GLN 60 -1.606 0.454 3.167 491 HE22 GLN 60 HE22 GLN 60 -0.563 -0.181 4.453 Start of MODEL 6 1 H5' G 16 H5' G 16 1.393 -1.489 -1.964 2 H5'' G 16 H5" G 16 2.865 -2.297 -2.523 3 H4' G 16 H4' G 16 2.158 -0.596 -4.101 4 H3' G 16 H3' G 16 4.711 0.140 -2.649 5 H2' G 16 H2' G 16 4.869 1.949 -4.271 6 HO2' G 16 HO2' G 16 3.806 0.544 -6.019 7 H1' G 16 H1' G 16 2.296 2.727 -3.920 8 H8 G 16 H8 G 16 3.506 1.458 -0.550 9 H1 G 16 H1 G 16 5.376 7.455 -2.007 10 H21 G 16 H21 G 16 5.318 7.690 -4.211 11 H22 G 16 H22 G 16 4.566 6.449 -5.219 12 HO5' G 16 HO5' G 16 2.953 -1.782 -0.276 13 H5' G 17 H5' G 17 5.641 0.518 -6.842 14 H5'' G 17 H5" G 17 7.216 -0.234 -7.111 15 H4' G 17 H4' G 17 7.212 1.998 -8.023 16 H3' G 17 H3' G 17 8.893 1.718 -5.521 17 H2' G 17 H2' G 17 9.752 3.914 -6.062 18 HO2' G 17 HO2' G 17 9.581 3.476 -8.489 19 H1' G 17 H1' G 17 7.281 4.966 -6.479 20 H8 G 17 H8 G 17 6.919 2.344 -3.748 21 H1 G 17 H1 G 17 9.264 8.005 -1.746 22 H21 G 17 H21 G 17 10.028 9.122 -3.495 23 H22 G 17 H22 G 17 9.780 8.499 -5.130 24 H5' G 18 H5' G 18 11.576 3.201 -8.387 25 H5'' G 18 H5" G 18 13.153 2.426 -8.227 26 H4' G 18 H4' G 18 13.274 4.887 -8.064 27 H3' G 18 H3' G 18 14.037 3.343 -5.584 28 H2' G 18 H2' G 18 14.743 5.434 -4.646 29 HO2' G 18 HO2' G 18 15.009 7.299 -5.819 30 H1' G 18 H1' G 18 12.530 6.830 -5.473 31 H8 G 18 H8 G 18 11.445 3.329 -4.431 32 H1 G 18 H1 G 18 12.297 7.487 0.429 33 H21 G 18 H21 G 18 13.506 9.189 -0.305 34 H22 G 18 H22 G 18 13.889 9.335 -2.023 35 H5' C 19 H5' C 19 17.319 5.928 -6.320 36 H5'' C 19 H5" C 19 18.857 5.116 -6.004 37 H4' C 19 H4' C 19 18.642 7.124 -4.641 38 H3' C 19 H3' C 19 18.471 4.569 -3.029 39 H2' C 19 H2' C 19 18.620 6.008 -1.079 40 HO2' C 19 HO2' C 19 20.101 7.587 -2.235 41 H1' C 19 H1' C 19 16.744 7.755 -2.006 42 H41 C 19 H41 C 19 13.444 3.691 1.378 43 H42 C 19 H42 C 19 13.368 2.511 0.062 44 H5 C 19 H5 C 19 14.692 2.760 -1.953 45 H6 C 19 H6 C 19 16.097 4.310 -3.185 46 H5' A 20 H5' A 20 21.634 6.807 -1.102 47 H5'' A 20 H5" A 20 22.884 5.667 -0.596 48 H4' A 20 H4' A 20 22.080 7.017 1.270 49 H3' A 20 H3' A 20 21.336 4.087 1.494 50 H2' A 20 H2' A 20 20.683 4.627 3.758 51 HO2' A 20 HO2' A 20 22.447 6.281 4.039 52 H1' A 20 H1' A 20 19.231 6.795 3.001 53 H8 A 20 H8 A 20 18.995 4.230 0.177 54 H61 A 20 H61 A 20 14.534 1.692 3.780 55 H62 A 20 H62 A 20 15.242 1.652 2.158 56 H2 A 20 H2 A 20 16.618 4.648 6.150 57 H5' G 21 H5' G 21 23.527 4.792 5.182 58 H5'' G 21 H5" G 21 24.561 3.379 5.416 59 H4' G 21 H4' G 21 23.232 3.758 7.378 60 H3' G 21 H3' G 21 22.240 1.294 5.900 61 H2' G 21 H2' G 21 21.031 0.859 7.932 62 HO2' G 21 HO2' G 21 21.214 2.179 9.775 63 H1' G 21 H1' G 21 19.994 3.382 7.979 64 H8 G 21 H8 G 21 20.484 2.503 4.316 65 H1 G 21 H1 G 21 15.599 -0.623 7.151 66 H21 G 21 H21 G 21 15.788 -0.402 9.353 67 H22 G 21 H22 G 21 17.062 0.615 10.028 68 H5' A 22 H5' A 22 23.048 0.120 9.750 69 H5'' A 22 H5" A 22 24.271 -1.129 9.764 70 H4' A 22 H4' A 22 22.569 -1.783 11.313 71 H3' A 22 H3' A 22 22.373 -3.398 8.759 72 H2' A 22 H2' A 22 20.548 -4.586 9.688 73 HO2' A 22 HO2' A 22 21.523 -4.665 11.888 74 H1' A 22 H1' A 22 19.269 -2.422 10.752 75 H8 A 22 H8 A 22 20.835 -1.424 7.401 76 H61 A 22 H61 A 22 15.716 -3.896 4.893 77 H62 A 22 H62 A 22 16.961 -2.670 4.678 78 H2 A 22 H2 A 22 15.842 -5.143 9.073 79 H5' U 23 H5' U 23 26.012 -6.085 8.006 80 H5'' U 23 H5" U 23 24.905 -5.888 6.647 81 H4' U 23 H4' U 23 24.172 -7.350 9.219 82 H3' U 23 H3' U 23 25.851 -8.335 7.110 83 H2' U 23 H2' U 23 24.153 -8.557 5.571 84 HO2' U 23 HO2' U 23 24.257 -10.870 7.121 85 H1' U 23 H1' U 23 22.277 -9.170 7.879 86 H3 U 23 H3 U 23 18.835 -9.961 5.118 87 H5 U 23 H5 U 23 21.073 -7.148 2.946 88 H6 U 23 H6 U 23 22.624 -7.001 4.836 89 H5' U 25 H5' U 25 24.752 -8.476 11.133 90 H5'' U 25 H5" U 25 26.440 -7.978 11.350 91 H4' U 25 H4' U 25 25.138 -10.038 13.157 92 H3' U 25 H3' U 25 24.602 -7.162 13.008 93 H2' U 25 H2' U 25 25.502 -6.454 15.047 94 HO2' U 25 HO2' U 25 24.332 -8.367 16.129 95 H1' U 25 H1' U 25 27.566 -8.200 15.379 96 H3 U 25 H3 U 25 31.009 -6.137 13.304 97 H5 U 25 H5 U 25 27.643 -4.023 12.007 98 H6 U 25 H6 U 25 26.223 -5.681 13.039 99 H5' G 26 H5' G 26 22.221 -9.581 11.940 100 H5'' G 26 H5" G 26 21.709 -8.537 10.620 101 H4' G 26 H4' G 26 19.957 -9.503 12.810 102 H3' G 26 H3' G 26 20.222 -10.272 9.907 103 H2' G 26 H2' G 26 17.882 -10.667 9.841 104 HO2' G 26 HO2' G 26 17.974 -11.491 12.220 105 H1' G 26 H1' G 26 17.147 -8.407 11.150 106 H8 G 26 H8 G 26 20.113 -7.311 9.213 107 H1 G 26 H1 G 26 15.005 -8.392 5.449 108 H21 G 26 H21 G 26 13.568 -9.682 6.610 109 H22 G 26 H22 G 26 13.898 -10.042 8.306 110 H5' A 27 H5' A 27 17.604 -13.352 11.524 111 H5'' A 27 H5" A 27 18.315 -14.909 11.080 112 H4' A 27 H4' A 27 16.001 -14.854 10.389 113 H3' A 27 H3' A 27 17.941 -14.661 8.072 114 H2' A 27 H2' A 27 16.044 -15.046 6.678 115 HO2' A 27 HO2' A 27 14.064 -15.722 7.419 116 H1' A 27 H1' A 27 14.458 -13.244 8.019 117 H8 A 27 H8 A 27 17.905 -11.680 7.911 118 H61 A 27 H61 A 27 16.572 -10.476 1.909 119 H62 A 27 H62 A 27 17.701 -10.101 3.163 120 H2 A 27 H2 A 27 13.518 -13.163 3.406 121 H5' G 28 H5' G 28 15.557 -18.045 7.392 122 H5'' G 28 H5" G 28 16.422 -19.373 6.612 123 H4' G 28 H4' G 28 14.418 -18.633 5.370 124 H3' G 28 H3' G 28 17.037 -18.221 3.880 125 H2' G 28 H2' G 28 15.687 -17.684 2.005 126 HO2' G 28 HO2' G 28 13.413 -17.822 2.014 127 H1' G 28 H1' G 28 14.161 -15.906 3.355 128 H8 G 28 H8 G 28 17.495 -15.678 5.051 129 H1 G 28 H1 G 28 17.477 -13.087 -0.820 130 H21 G 28 H21 G 28 15.793 -14.009 -1.990 131 H22 G 28 H22 G 28 14.679 -15.095 -1.152 132 H5' C 29 H5' C 29 14.610 -20.103 1.333 133 H5'' C 29 H5" C 29 15.353 -21.501 0.571 134 H4' C 29 H4' C 29 14.414 -19.943 -1.080 135 H3' C 29 H3' C 29 17.421 -20.246 -1.081 136 H2' C 29 H2' C 29 17.350 -19.086 -3.190 137 HO2' C 29 HO2' C 29 15.562 -19.815 -4.273 138 H1' C 29 H1' C 29 15.565 -17.204 -2.332 139 H41 C 29 H41 C 29 20.990 -14.227 -1.548 140 H42 C 29 H42 C 29 21.154 -14.864 0.087 141 H5 C 29 H5 C 29 19.690 -16.566 0.969 142 H6 C 29 H6 C 29 17.735 -17.934 0.508 143 H5' C 30 H5' C 30 15.765 -21.908 -4.750 144 H5'' C 30 H5" C 30 16.748 -23.227 -5.403 145 H4' C 30 H4' C 30 16.496 -21.349 -6.999 146 H3' C 30 H3' C 30 19.296 -21.859 -5.950 147 H2' C 30 H2' C 30 20.063 -20.182 -7.458 148 HO2' C 30 HO2' C 30 18.337 -20.977 -9.117 149 H1' C 30 H1' C 30 17.927 -18.461 -7.049 150 H41 C 30 H41 C 30 22.554 -16.089 -3.650 151 H42 C 30 H42 C 30 22.415 -17.295 -2.372 152 H5 C 30 H5 C 30 20.733 -19.061 -2.474 153 H6 C 30 H6 C 30 19.101 -20.115 -3.926 154 H5' U 31 H5' U 31 20.004 -21.721 -10.051 155 H5'' U 31 H5" U 31 21.058 -23.067 -10.505 156 H4' U 31 H4' U 31 22.114 -20.953 -11.085 157 H3' U 31 H3' U 31 23.384 -22.473 -8.804 158 H2' U 31 H2' U 31 25.092 -20.841 -8.703 159 HO2' U 31 HO2' U 31 25.117 -20.800 -11.181 160 H1' U 31 H1' U 31 23.453 -18.651 -9.302 161 H3 U 31 H3 U 31 24.400 -17.453 -5.053 162 H5 U 31 H5 U 31 22.892 -21.320 -4.573 163 H6 U 31 H6 U 31 22.450 -21.413 -6.971 164 H5' G 32 H5' G 32 27.511 -23.816 -9.114 165 H5'' G 32 H5" G 32 26.761 -22.323 -8.509 166 H4' G 32 H4' G 32 29.285 -22.336 -8.762 167 H3' G 32 H3' G 32 27.458 -20.231 -9.707 168 H2' G 32 H2' G 32 28.930 -19.180 -11.217 169 HO2' G 32 HO2' G 32 30.774 -19.803 -9.473 170 H1' G 32 H1' G 32 30.166 -21.341 -12.307 171 H8 G 32 H8 G 32 27.072 -19.466 -12.300 172 H1 G 32 H1 G 32 26.528 -24.757 -15.940 173 H21 G 32 H21 G 32 28.271 -26.118 -15.504 174 H22 G 32 H22 G 32 29.472 -25.639 -14.316 175 H5' G 33 H5' G 33 30.746 -17.757 -8.989 176 H5'' G 33 H5" G 33 30.271 -16.371 -8.015 177 H4' G 33 H4' G 33 31.198 -15.766 -10.231 178 H3' G 33 H3' G 33 28.361 -14.932 -9.624 179 H2' G 33 H2' G 33 28.237 -13.889 -11.743 180 HO2' G 33 HO2' G 33 30.588 -13.110 -11.453 181 H1' G 33 H1' G 33 29.614 -15.799 -13.182 182 H8 G 33 H8 G 33 27.139 -17.165 -10.551 183 H1 G 33 H1 G 33 24.623 -15.888 -16.353 184 H21 G 33 H21 G 33 26.228 -14.961 -17.639 185 H22 G 33 H22 G 33 27.830 -14.693 -16.970 186 H5' G 34 H5' G 34 28.749 -11.478 -10.400 187 H5'' G 34 H5" G 34 28.863 -10.345 -9.058 188 H4' G 34 H4' G 34 27.008 -10.060 -10.857 189 H3' G 34 H3' G 34 26.349 -9.668 -7.913 190 H2' G 34 H2' G 34 24.153 -9.473 -8.389 191 HO2' G 34 HO2' G 34 23.279 -9.317 -10.467 192 H1' G 34 H1' G 34 23.873 -11.624 -9.968 193 H8 G 34 H8 G 34 26.475 -11.387 -6.999 194 H1 G 34 H1 G 34 21.753 -15.678 -6.290 195 H21 G 34 H21 G 34 20.462 -15.658 -8.029 196 H22 G 34 H22 G 34 20.696 -14.511 -9.348 197 H5' A 35 H5' A 35 28.139 -4.506 -7.943 198 H5'' A 35 H5" A 35 27.042 -5.782 -7.427 199 H4' A 35 H4' A 35 25.933 -3.628 -8.030 200 H3' A 35 H3' A 35 25.129 -6.250 -9.166 201 H2' A 35 H2' A 35 23.874 -5.417 -10.942 202 HO2' A 35 HO2' A 35 23.054 -3.282 -11.038 203 H1' A 35 H1' A 35 25.362 -3.263 -11.671 204 H8 A 35 H8 A 35 25.531 -7.066 -11.343 205 H61 A 35 H61 A 35 29.507 -6.508 -16.156 206 H62 A 35 H62 A 35 28.569 -7.697 -15.246 207 H2 A 35 H2 A 35 28.877 -2.571 -14.559 208 H5' G 36 H5' G 36 22.711 -6.990 -9.649 209 H5'' G 36 H5" G 36 21.500 -6.198 -8.638 210 H4' G 36 H4' G 36 20.716 -8.159 -10.028 211 H3' G 36 H3' G 36 20.265 -8.049 -7.052 212 H2' G 36 H2' G 36 18.915 -10.029 -7.339 213 HO2' G 36 HO2' G 36 18.275 -9.170 -9.663 214 H1' G 36 H1' G 36 20.668 -11.370 -8.883 215 H8 G 36 H8 G 36 22.943 -9.557 -6.613 216 H1 G 36 H1 G 36 19.743 -14.332 -3.625 217 H21 G 36 H21 G 36 18.178 -15.088 -4.992 218 H22 G 36 H22 G 36 17.992 -14.394 -6.601 219 H5' C 37 H5' C 37 16.571 -8.825 -8.908 220 H5'' C 37 H5" C 37 15.205 -8.031 -8.144 221 H4' C 37 H4' C 37 15.019 -10.502 -8.237 222 H3' C 37 H3' C 37 15.126 -9.240 -5.497 223 H2' C 37 H2' C 37 14.383 -11.423 -4.714 224 HO2' C 37 HO2' C 37 13.046 -11.855 -6.707 225 H1' C 37 H1' C 37 16.250 -12.750 -6.142 226 H41 C 37 H41 C 37 19.020 -11.709 -0.559 227 H42 C 37 H42 C 37 19.851 -10.341 -1.272 228 H5 C 37 H5 C 37 19.405 -9.488 -3.446 229 H6 C 37 H6 C 37 17.996 -9.716 -5.419 230 H5' U 38 H5' U 38 11.400 -11.189 -5.887 231 H5'' U 38 H5" U 38 10.047 -10.271 -5.215 232 H4' U 38 H4' U 38 10.163 -12.512 -4.219 233 H3' U 38 H3' U 38 10.840 -10.216 -2.367 234 H2' U 38 H2' U 38 10.871 -11.751 -0.571 235 HO2' U 38 HO2' U 38 10.210 -13.921 -0.754 236 H1' U 38 H1' U 38 12.372 -13.624 -1.911 237 H3 U 38 H3 U 38 14.969 -11.617 1.260 238 H5 U 38 H5 U 38 15.421 -9.290 -2.192 239 H6 U 38 H6 U 38 13.535 -10.439 -3.161 240 H5' C 39 H5' C 39 8.433 -11.892 0.153 241 H5'' C 39 H5" C 39 7.220 -10.711 0.669 242 H4' C 39 H4' C 39 8.347 -11.414 2.604 243 H3' C 39 H3' C 39 9.626 -8.763 1.860 244 H2' C 39 H2' C 39 10.254 -8.794 4.163 245 HO2' C 39 HO2' C 39 9.331 -10.042 5.632 246 H1' C 39 H1' C 39 11.090 -11.416 3.886 247 H41 C 39 H41 C 39 15.934 -7.413 3.405 248 H42 C 39 H42 C 39 15.695 -7.220 1.671 249 H5 C 39 H5 C 39 13.734 -8.123 0.521 250 H6 C 39 H6 C 39 11.763 -9.554 0.793 251 H5' U 40 H5' U 40 7.279 -8.592 5.223 252 H5'' U 40 H5" U 40 6.543 -7.045 5.669 253 H4' U 40 H4' U 40 7.894 -8.081 7.499 254 H3' U 40 H3' U 40 8.822 -5.423 6.403 255 H2' U 40 H2' U 40 10.400 -5.385 8.246 256 HO2' U 40 HO2' U 40 8.760 -6.599 9.681 257 H1' U 40 H1' U 40 11.232 -7.948 7.852 258 H3 U 40 H3 U 40 14.588 -5.177 6.413 259 H5 U 40 H5 U 40 12.107 -5.700 3.083 260 H6 U 40 H6 U 40 10.455 -6.755 4.501 261 H5' C 41 H5' C 41 8.507 -4.851 10.567 262 H5'' C 41 H5" C 41 7.660 -3.337 10.899 263 H4' C 41 H4' C 41 9.801 -3.362 12.040 264 H3' C 41 H3' C 41 9.655 -1.436 9.708 265 H2' C 41 H2' C 41 11.750 -0.549 10.519 266 HO2' C 41 HO2' C 41 11.087 -0.991 12.866 267 H1' C 41 H1' C 41 12.871 -3.018 10.868 268 H41 C 41 H41 C 41 14.638 -1.417 5.097 269 H42 C 41 H42 C 41 13.228 -2.177 4.370 270 H5 C 41 H5 C 41 11.333 -2.889 5.733 271 H6 C 41 H6 C 41 10.569 -3.203 8.023 272 H5' U 42 H5' U 42 10.762 1.034 12.850 273 H5'' U 42 H5" U 42 9.809 2.519 12.796 274 H4' U 42 H4' U 42 12.131 3.069 12.796 275 H3' U 42 H3' U 42 10.929 3.485 10.047 276 H2' U 42 H2' U 42 12.953 4.713 9.576 277 HO2' U 42 HO2' U 42 13.650 4.343 12.358 278 H1' U 42 H1' U 42 14.527 2.715 10.574 279 H3 U 42 H3 U 42 14.831 2.638 6.022 280 H5 U 42 H5 U 42 11.284 0.591 6.826 281 H6 U 42 H6 U 42 11.462 1.263 9.166 282 H5' G 43 H5' G 43 12.484 7.093 11.547 283 H5'' G 43 H5" G 43 11.465 8.499 11.207 284 H4' G 43 H4' G 43 13.819 8.867 10.539 285 H3' G 43 H3' G 43 11.745 8.786 8.348 286 H2' G 43 H2' G 43 13.453 9.397 6.800 287 HO2' G 43 HO2' G 43 15.464 10.155 7.389 288 H1' G 43 H1' G 43 15.334 7.668 7.777 289 H8 G 43 H8 G 43 12.028 5.828 7.965 290 H1 G 43 H1 G 43 14.695 5.910 2.114 291 H21 G 43 H21 G 43 16.125 7.589 2.002 292 H22 G 43 H22 G 43 16.535 8.521 3.448 293 H5' C 44 H5' C 44 13.834 12.340 7.679 294 H5'' C 44 H5" C 44 12.762 13.682 7.263 295 H4' C 44 H4' C 44 14.416 13.309 5.507 296 H3' C 44 H3' C 44 11.582 12.602 4.713 297 H2' C 44 H2' C 44 12.437 12.322 2.475 298 HO2' C 44 HO2' C 44 14.039 14.165 2.785 299 H1' C 44 H1' C 44 14.642 10.910 3.253 300 H41 C 44 H41 C 44 10.869 6.150 2.093 301 H42 C 44 H42 C 44 10.116 6.237 3.686 302 H5 C 44 H5 C 44 10.468 8.144 5.162 303 H6 C 44 H6 C 44 11.788 10.162 5.469 304 H5' C 45 H5' C 45 12.846 15.382 1.667 305 H5'' C 45 H5" C 45 11.488 16.441 1.268 306 H4' C 45 H4' C 45 12.298 15.270 -0.715 307 H3' C 45 H3' C 45 9.561 14.350 0.201 308 H2' C 45 H2' C 45 9.455 13.142 -1.864 309 HO2' C 45 HO2' C 45 10.920 13.396 -3.534 310 H1' C 45 H1' C 45 12.023 12.166 -1.653 311 H41 C 45 H41 C 45 8.505 7.598 0.710 312 H42 C 45 H42 C 45 8.356 8.388 2.280 313 H5 C 45 H5 C 45 9.186 10.642 2.664 314 H6 C 45 H6 C 45 10.366 12.505 1.630 315 H5' C 46 H5' C 46 9.087 15.366 -3.821 316 H5'' C 46 H5" C 46 7.555 16.197 -4.105 317 H4' C 46 H4' C 46 7.726 14.202 -5.500 318 H3' C 46 H3' C 46 5.653 14.016 -3.298 319 HO3' C 46 HO3' C 46 4.265 14.600 -5.026 320 H2' C 46 H2' C 46 4.951 11.960 -4.278 321 HO2' C 46 HO2' C 46 5.241 12.814 -6.543 322 H1' C 46 H1' C 46 7.514 11.048 -4.812 323 H41 C 46 H41 C 46 5.489 8.254 0.417 324 H42 C 46 H42 C 46 5.681 9.703 1.411 325 H5 C 46 H5 C 46 6.506 11.798 0.463 326 H6 C 46 H6 C 46 7.178 12.889 -1.610 327 H1 GLY 44 H1 GLY 44 32.098 3.095 -4.049 328 H2 GLY 44 H2 GLY 44 33.137 2.936 -5.304 329 H3 GLY 44 H3 GLY 44 33.641 2.611 -3.778 330 HA2 GLY 44 HA2 GLY 44 33.287 0.555 -4.964 331 HA3 GLY 44 HA3 GLY 44 32.150 0.731 -3.614 332 H ILE 45 H ILE 45 31.033 -0.927 -4.989 333 HA ILE 45 HA ILE 45 29.200 0.356 -6.994 334 HB ILE 45 HB ILE 45 30.216 -2.502 -7.141 335 HG12 ILE 45 HG12 ILE 45 31.218 -0.066 -8.687 336 HG13 ILE 45 HG13 ILE 45 32.137 -1.000 -7.503 337 HG21 ILE 45 HG21 ILE 45 28.790 -0.764 -9.213 338 HG22 ILE 45 HG22 ILE 45 29.249 -2.471 -9.405 339 HG23 ILE 45 HG23 ILE 45 28.014 -2.036 -8.253 340 HD11 ILE 45 HD11 ILE 45 31.275 -1.949 -10.247 341 HD12 ILE 45 HD12 ILE 45 32.907 -1.661 -9.638 342 HD13 ILE 45 HD13 ILE 45 31.958 -3.013 -8.989 343 H SER 46 H SER 46 29.497 -1.816 -4.231 344 HA SER 46 HA SER 46 26.608 -1.636 -3.754 345 HB2 SER 46 HB2 SER 46 26.301 -4.040 -3.446 346 HB3 SER 46 HB3 SER 46 26.784 -3.693 -5.110 347 HG SER 46 HG SER 46 28.878 -4.375 -4.624 348 H TYR 47 H TYR 47 26.033 -2.497 -1.579 349 HA TYR 47 HA TYR 47 28.259 -2.591 0.390 350 HB2 TYR 47 HB2 TYR 47 27.344 -0.213 -0.080 351 HB3 TYR 47 HB3 TYR 47 25.886 -0.732 0.746 352 HD1 TYR 47 HD1 TYR 47 25.786 -0.367 3.103 353 HD2 TYR 47 HD2 TYR 47 29.631 -0.602 1.154 354 HE1 TYR 47 HE1 TYR 47 26.903 0.256 5.233 355 HE2 TYR 47 HE2 TYR 47 30.749 0.016 3.299 356 HH TYR 47 HH TYR 47 28.891 0.651 6.299 357 H GLY 48 H GLY 48 26.003 -4.431 -0.702 358 HA2 GLY 48 HA2 GLY 48 25.491 -5.998 1.591 359 HA3 GLY 48 HA3 GLY 48 24.076 -4.969 1.319 360 H ARG 49 H ARG 49 23.358 -7.415 1.116 361 HA ARG 49 HA ARG 49 23.871 -8.957 -1.218 362 HB2 ARG 49 HB2 ARG 49 21.208 -8.836 0.253 363 HB3 ARG 49 HB3 ARG 49 21.850 -10.162 -0.727 364 HG2 ARG 49 HG2 ARG 49 23.685 -10.471 0.976 365 HG3 ARG 49 HG3 ARG 49 22.900 -9.219 1.972 366 HD2 ARG 49 HD2 ARG 49 20.753 -10.610 1.759 367 HD3 ARG 49 HD3 ARG 49 21.775 -11.917 1.136 368 HE ARG 49 HE ARG 49 22.984 -11.099 3.529 369 HH11 ARG 49 HH11 ARG 49 19.866 -12.574 2.623 370 HH12 ARG 49 HH12 ARG 49 19.536 -13.095 4.132 371 HH21 ARG 49 HH21 ARG 49 22.494 -11.732 5.567 372 HH22 ARG 49 HH22 ARG 49 21.019 -12.584 5.896 373 H LYS 50 H LYS 50 21.537 -6.400 -0.711 374 HA LYS 50 HA LYS 50 21.530 -5.664 -3.493 375 HB2 LYS 50 HB2 LYS 50 19.158 -5.727 -3.911 376 HB3 LYS 50 HB3 LYS 50 19.755 -7.346 -3.663 377 HG2 LYS 50 HG2 LYS 50 18.760 -7.466 -1.448 378 HG3 LYS 50 HG3 LYS 50 18.371 -5.746 -1.457 379 HD2 LYS 50 HD2 LYS 50 17.109 -7.850 -3.264 380 HD3 LYS 50 HD3 LYS 50 16.384 -7.095 -1.832 381 HE2 LYS 50 HE2 LYS 50 16.760 -4.842 -3.043 382 HE3 LYS 50 HE3 LYS 50 17.077 -5.795 -4.496 383 HZ1 LYS 50 HZ1 LYS 50 14.760 -5.116 -4.376 384 HZ2 LYS 50 HZ2 LYS 50 14.784 -6.734 -4.275 385 HZ3 LYS 50 HZ3 LYS 50 14.551 -5.848 -2.932 386 H LYS 51 H LYS 51 19.892 -3.804 -3.756 387 HA LYS 51 HA LYS 51 20.392 -1.643 -1.898 388 HB2 LYS 51 HB2 LYS 51 18.298 -1.865 -4.119 389 HB3 LYS 51 HB3 LYS 51 18.823 -0.403 -3.297 390 HG2 LYS 51 HG2 LYS 51 19.989 -0.255 -5.273 391 HG3 LYS 51 HG3 LYS 51 21.206 -0.960 -4.211 392 HD2 LYS 51 HD2 LYS 51 20.731 -3.212 -5.214 393 HD3 LYS 51 HD3 LYS 51 19.472 -2.486 -6.224 394 HE2 LYS 51 HE2 LYS 51 21.166 -1.154 -7.396 395 HE3 LYS 51 HE3 LYS 51 22.420 -1.708 -6.275 396 HZ1 LYS 51 HZ1 LYS 51 22.061 -3.978 -7.061 397 HZ2 LYS 51 HZ2 LYS 51 20.913 -3.475 -8.124 398 HZ3 LYS 51 HZ3 LYS 51 22.474 -3.031 -8.323 399 H ARG 52 H ARG 52 19.471 -1.459 0.059 400 HA ARG 52 HA ARG 52 17.409 -3.149 1.095 401 HB2 ARG 52 HB2 ARG 52 18.250 -0.414 2.135 402 HB3 ARG 52 HB3 ARG 52 17.448 -1.684 3.040 403 HG2 ARG 52 HG2 ARG 52 20.319 -1.783 2.024 404 HG3 ARG 52 HG3 ARG 52 19.781 -1.417 3.656 405 HD2 ARG 52 HD2 ARG 52 18.649 -3.774 3.570 406 HD3 ARG 52 HD3 ARG 52 19.762 -4.082 2.231 407 HE ARG 52 HE ARG 52 21.540 -3.204 4.001 408 HH11 ARG 52 HH11 ARG 52 18.853 -5.361 4.810 409 HH12 ARG 52 HH12 ARG 52 19.564 -5.841 6.281 410 HH21 ARG 52 HH21 ARG 52 22.426 -3.918 6.002 411 HH22 ARG 52 HH22 ARG 52 21.398 -4.848 7.019 412 H ARG 53 H ARG 53 15.184 -2.733 1.654 413 HA ARG 53 HA ARG 53 13.839 -0.391 0.417 414 HB2 ARG 53 HB2 ARG 53 12.591 -1.616 -1.177 415 HB3 ARG 53 HB3 ARG 53 14.244 -2.150 -1.363 416 HG2 ARG 53 HG2 ARG 53 13.364 -4.235 -1.355 417 HG3 ARG 53 HG3 ARG 53 13.339 -4.067 0.399 418 HD2 ARG 53 HD2 ARG 53 10.967 -3.045 0.073 419 HD3 ARG 53 HD3 ARG 53 11.058 -3.610 -1.584 420 HE ARG 53 HE ARG 53 10.697 -5.189 0.877 421 HH11 ARG 53 HH11 ARG 53 11.382 -5.564 -2.584 422 HH12 ARG 53 HH12 ARG 53 10.637 -7.147 -2.564 423 HH21 ARG 53 HH21 ARG 53 9.665 -7.042 0.667 424 HH22 ARG 53 HH22 ARG 53 9.727 -7.936 -0.844 425 H GLN 54 H GLN 54 11.530 -0.270 0.767 426 HA GLN 54 HA GLN 54 10.327 -2.115 2.730 427 HB2 GLN 54 HB2 GLN 54 9.366 -0.309 4.073 428 HB3 GLN 54 HB3 GLN 54 11.119 -0.354 4.190 429 HG2 GLN 54 HG2 GLN 54 11.307 1.577 2.667 430 HG3 GLN 54 HG3 GLN 54 9.560 1.622 2.449 431 HE21 GLN 54 HE21 GLN 54 11.034 3.991 5.179 432 HE22 GLN 54 HE22 GLN 54 11.648 3.600 3.703 433 H ARG 55 H ARG 55 8.175 -2.505 2.344 434 HA ARG 55 HA ARG 55 6.853 -1.337 -0.036 435 HB2 ARG 55 HB2 ARG 55 6.198 -3.473 2.003 436 HB3 ARG 55 HB3 ARG 55 4.866 -2.685 1.175 437 HG2 ARG 55 HG2 ARG 55 5.518 -4.756 0.061 438 HG3 ARG 55 HG3 ARG 55 5.659 -3.349 -0.999 439 HD2 ARG 55 HD2 ARG 55 8.087 -3.339 -0.766 440 HD3 ARG 55 HD3 ARG 55 8.007 -4.569 0.496 441 HE ARG 55 HE ARG 55 7.753 -6.234 -1.092 442 HH11 ARG 55 HH11 ARG 55 7.244 -3.174 -2.804 443 HH12 ARG 55 HH12 ARG 55 7.312 -3.943 -4.340 444 HH21 ARG 55 HH21 ARG 55 8.028 -7.104 -3.095 445 HH22 ARG 55 HH22 ARG 55 7.750 -6.114 -4.510 446 H ARG 56 H ARG 56 6.652 -0.947 3.441 447 HA ARG 56 HA ARG 56 5.721 0.519 4.850 448 HB2 ARG 56 HB2 ARG 56 7.202 1.922 3.287 449 HB3 ARG 56 HB3 ARG 56 5.700 2.576 2.630 450 HG2 ARG 56 HG2 ARG 56 5.090 3.453 4.849 451 HG3 ARG 56 HG3 ARG 56 6.477 2.624 5.587 452 HD2 ARG 56 HD2 ARG 56 8.020 4.015 4.188 453 HD3 ARG 56 HD3 ARG 56 6.624 4.835 3.495 454 HE ARG 56 HE ARG 56 6.368 6.085 5.427 455 HH11 ARG 56 HH11 ARG 56 8.718 3.531 6.280 456 HH12 ARG 56 HH12 ARG 56 9.019 4.362 7.817 457 HH21 ARG 56 HH21 ARG 56 6.956 6.942 7.421 458 HH22 ARG 56 HH22 ARG 56 8.150 6.062 8.376 459 H ARG 57 H ARG 57 3.731 -0.017 2.070 460 HA ARG 57 HA ARG 57 1.285 0.493 3.747 461 HB2 ARG 57 HB2 ARG 57 1.598 0.872 0.741 462 HB3 ARG 57 HB3 ARG 57 0.112 1.103 1.664 463 HG2 ARG 57 HG2 ARG 57 1.184 2.951 2.945 464 HG3 ARG 57 HG3 ARG 57 2.647 2.757 1.961 465 HD2 ARG 57 HD2 ARG 57 1.172 3.104 -0.095 466 HD3 ARG 57 HD3 ARG 57 -0.130 3.570 1.015 467 HE ARG 57 HE ARG 57 2.161 5.109 1.670 468 HH11 ARG 57 HH11 ARG 57 -0.035 4.872 -1.047 469 HH12 ARG 57 HH12 ARG 57 0.307 6.494 -1.584 470 HH21 ARG 57 HH21 ARG 57 2.551 7.167 0.935 471 HH22 ARG 57 HH22 ARG 57 1.707 7.769 -0.460 472 H ALA 58 H ALA 58 3.016 -2.023 2.780 473 HA ALA 58 HA ALA 58 0.723 -3.847 2.654 474 HB1 ALA 58 HB1 ALA 58 2.824 -3.838 0.437 475 HB2 ALA 58 HB2 ALA 58 1.467 -4.966 0.605 476 HB3 ALA 58 HB3 ALA 58 1.147 -3.262 0.262 477 H HIS 59 H HIS 59 1.633 -6.195 2.487 478 HA HIS 59 HA HIS 59 4.101 -6.609 4.102 479 HB2 HIS 59 HB2 HIS 59 1.295 -7.548 4.841 480 HB3 HIS 59 HB3 HIS 59 2.769 -8.137 5.595 481 HD2 HIS 59 HD2 HIS 59 0.408 -5.135 5.618 482 HE1 HIS 59 HE1 HIS 59 3.369 -4.377 8.595 483 HE2 HIS 59 HE2 HIS 59 1.154 -3.586 7.620 484 H GLN 60 H GLN 60 4.658 -8.905 4.287 485 HA GLN 60 HA GLN 60 4.615 -10.454 1.923 486 HB2 GLN 60 HB2 GLN 60 5.540 -12.245 3.280 487 HB3 GLN 60 HB3 GLN 60 6.331 -10.710 3.612 488 HG2 GLN 60 HG2 GLN 60 5.028 -10.462 5.703 489 HG3 GLN 60 HG3 GLN 60 4.219 -11.999 5.393 490 HE21 GLN 60 HE21 GLN 60 7.463 -12.250 7.559 491 HE22 GLN 60 HE22 GLN 60 6.319 -10.917 7.517 Start of MODEL 7 1 H5' G 16 H5' G 16 1.228 -1.260 -1.859 2 H5'' G 16 H5" G 16 2.620 -2.168 -2.465 3 H4' G 16 H4' G 16 1.933 -0.576 -4.128 4 H3' G 16 H3' G 16 4.512 0.188 -2.757 5 H2' G 16 H2' G 16 4.691 2.003 -4.310 6 HO2' G 16 HO2' G 16 3.634 0.594 -6.090 7 H1' G 16 H1' G 16 2.115 2.821 -4.053 8 H8 G 16 H8 G 16 3.065 1.607 -0.626 9 H1 G 16 H1 G 16 5.432 7.421 -2.091 10 H21 G 16 H21 G 16 5.459 7.642 -4.290 11 H22 G 16 H22 G 16 4.687 6.432 -5.322 12 HO5' G 16 HO5' G 16 2.785 -1.419 -0.209 13 H5' G 17 H5' G 17 5.632 0.665 -6.688 14 H5'' G 17 H5" G 17 7.181 -0.145 -6.949 15 H4' G 17 H4' G 17 7.402 2.149 -7.589 16 H3' G 17 H3' G 17 8.753 1.689 -4.911 17 H2' G 17 H2' G 17 9.804 3.810 -5.356 18 HO2' G 17 HO2' G 17 9.656 4.879 -7.285 19 H1' G 17 H1' G 17 7.401 4.966 -5.965 20 H8 G 17 H8 G 17 6.777 2.365 -3.256 21 H1 G 17 H1 G 17 9.319 7.927 -1.181 22 H21 G 17 H21 G 17 10.168 9.011 -2.932 23 H22 G 17 H22 G 17 9.915 8.378 -4.560 24 H5' G 18 H5' G 18 11.519 2.909 -7.784 25 H5'' G 18 H5" G 18 13.115 2.177 -7.611 26 H4' G 18 H4' G 18 13.174 4.650 -7.753 27 H3' G 18 H3' G 18 14.181 3.360 -5.222 28 H2' G 18 H2' G 18 14.845 5.547 -4.474 29 HO2' G 18 HO2' G 18 15.467 6.155 -6.805 30 H1' G 18 H1' G 18 12.571 6.830 -5.246 31 H8 G 18 H8 G 18 11.450 3.447 -3.973 32 H1 G 18 H1 G 18 12.584 7.815 0.632 33 H21 G 18 H21 G 18 13.872 9.402 -0.178 34 H22 G 18 H22 G 18 14.290 9.437 -1.895 35 H5' C 19 H5' C 19 17.474 5.912 -6.245 36 H5'' C 19 H5" C 19 18.981 5.028 -5.978 37 H4' C 19 H4' C 19 18.921 7.040 -4.607 38 H3' C 19 H3' C 19 18.628 4.501 -2.993 39 H2' C 19 H2' C 19 18.880 5.895 -1.047 40 HO2' C 19 HO2' C 19 19.500 8.030 -1.122 41 H1' C 19 H1' C 19 17.112 7.789 -1.948 42 H41 C 19 H41 C 19 13.690 3.891 1.540 43 H42 C 19 H42 C 19 13.623 2.661 0.274 44 H5 C 19 H5 C 19 14.808 2.903 -1.818 45 H6 C 19 H6 C 19 16.273 4.370 -3.082 46 H5' A 20 H5' A 20 21.838 6.596 -1.156 47 H5'' A 20 H5" A 20 23.077 5.454 -0.625 48 H4' A 20 H4' A 20 22.331 6.827 1.224 49 H3' A 20 H3' A 20 21.378 3.963 1.498 50 H2' A 20 H2' A 20 20.817 4.599 3.772 51 HO2' A 20 HO2' A 20 22.686 6.194 3.919 52 H1' A 20 H1' A 20 19.453 6.787 2.945 53 H8 A 20 H8 A 20 19.196 4.111 0.215 54 H61 A 20 H61 A 20 14.577 1.859 3.825 55 H62 A 20 H62 A 20 15.431 1.559 2.312 56 H2 A 20 H2 A 20 16.705 4.848 6.108 57 H5' G 21 H5' G 21 23.372 4.664 5.113 58 H5'' G 21 H5" G 21 24.437 3.299 5.441 59 H4' G 21 H4' G 21 23.134 3.672 7.370 60 H3' G 21 H3' G 21 21.986 1.248 5.927 61 H2' G 21 H2' G 21 20.824 0.889 8.013 62 HO2' G 21 HO2' G 21 22.669 1.938 9.335 63 H1' G 21 H1' G 21 19.858 3.418 8.006 64 H8 G 21 H8 G 21 20.426 2.489 4.357 65 H1 G 21 H1 G 21 15.401 -0.539 7.041 66 H21 G 21 H21 G 21 15.491 -0.301 9.235 67 H22 G 21 H22 G 21 16.740 0.713 9.958 68 H5' A 22 H5' A 22 22.689 -0.010 9.619 69 H5'' A 22 H5" A 22 24.004 -1.149 9.642 70 H4' A 22 H4' A 22 22.437 -1.967 11.205 71 H3' A 22 H3' A 22 22.127 -3.509 8.626 72 H2' A 22 H2' A 22 20.348 -4.739 9.565 73 HO2' A 22 HO2' A 22 21.373 -4.967 11.710 74 H1' A 22 H1' A 22 19.097 -2.652 10.804 75 H8 A 22 H8 A 22 20.498 -1.423 7.465 76 H61 A 22 H61 A 22 15.283 -3.783 5.012 77 H62 A 22 H62 A 22 16.473 -2.508 4.835 78 H2 A 22 H2 A 22 15.562 -5.236 9.117 79 H5' U 23 H5' U 23 25.823 -6.010 7.664 80 H5'' U 23 H5" U 23 24.636 -5.788 6.379 81 H4' U 23 H4' U 23 24.045 -7.263 8.984 82 H3' U 23 H3' U 23 25.633 -8.251 6.838 83 H2' U 23 H2' U 23 23.872 -8.311 5.317 84 HO2' U 23 HO2' U 23 24.057 -10.727 6.694 85 H1' U 23 H1' U 23 22.096 -9.092 7.657 86 H3 U 23 H3 U 23 18.542 -9.784 4.996 87 H5 U 23 H5 U 23 20.580 -6.726 2.971 88 H6 U 23 H6 U 23 22.246 -6.715 4.762 89 H5' U 25 H5' U 25 24.527 -8.423 10.854 90 H5'' U 25 H5" U 25 26.237 -7.983 11.033 91 H4' U 25 H4' U 25 24.906 -9.990 12.877 92 H3' U 25 H3' U 25 24.478 -7.091 12.732 93 H2' U 25 H2' U 25 25.421 -6.436 14.772 94 HO2' U 25 HO2' U 25 24.200 -8.320 15.849 95 H1' U 25 H1' U 25 27.426 -8.259 15.056 96 H3 U 25 H3 U 25 30.913 -6.260 13.004 97 H5 U 25 H5 U 25 27.603 -4.035 11.747 98 H6 U 25 H6 U 25 26.141 -5.670 12.756 99 H5' G 26 H5' G 26 21.997 -9.419 11.717 100 H5'' G 26 H5" G 26 21.459 -8.375 10.409 101 H4' G 26 H4' G 26 19.759 -9.288 12.662 102 H3' G 26 H3' G 26 19.945 -10.139 9.774 103 H2' G 26 H2' G 26 17.603 -10.488 9.754 104 HO2' G 26 HO2' G 26 17.731 -11.244 12.166 105 H1' G 26 H1' G 26 16.923 -8.186 11.016 106 H8 G 26 H8 G 26 19.883 -7.174 9.039 107 H1 G 26 H1 G 26 14.750 -8.264 5.318 108 H21 G 26 H21 G 26 13.362 -9.610 6.473 109 H22 G 26 H22 G 26 13.682 -9.936 8.178 110 H5' A 27 H5' A 27 17.239 -13.076 11.383 111 H5'' A 27 H5" A 27 17.947 -14.659 11.037 112 H4' A 27 H4' A 27 15.691 -14.650 10.245 113 H3' A 27 H3' A 27 17.691 -14.461 7.971 114 H2' A 27 H2' A 27 15.825 -14.929 6.553 115 HO2' A 27 HO2' A 27 14.789 -16.440 8.192 116 H1' A 27 H1' A 27 14.177 -13.137 7.801 117 H8 A 27 H8 A 27 17.557 -11.470 7.782 118 H61 A 27 H61 A 27 16.408 -10.410 1.702 119 H62 A 27 H62 A 27 17.421 -9.897 3.010 120 H2 A 27 H2 A 27 13.481 -13.265 3.108 121 H5' G 28 H5' G 28 15.534 -18.009 7.237 122 H5'' G 28 H5" G 28 16.526 -19.246 6.463 123 H4' G 28 H4' G 28 14.488 -18.526 5.185 124 H3' G 28 H3' G 28 17.163 -18.145 3.799 125 H2' G 28 H2' G 28 15.873 -17.654 1.857 126 HO2' G 28 HO2' G 28 13.624 -17.840 1.763 127 H1' G 28 H1' G 28 14.257 -15.889 3.139 128 H8 G 28 H8 G 28 17.582 -15.469 4.827 129 H1 G 28 H1 G 28 17.360 -13.025 -1.111 130 H21 G 28 H21 G 28 15.692 -14.028 -2.227 131 H22 G 28 H22 G 28 14.645 -15.152 -1.354 132 H5' C 29 H5' C 29 14.699 -20.226 1.321 133 H5'' C 29 H5" C 29 15.472 -21.600 0.545 134 H4' C 29 H4' C 29 14.399 -20.072 -1.073 135 H3' C 29 H3' C 29 17.402 -20.363 -1.203 136 H2' C 29 H2' C 29 17.265 -19.179 -3.297 137 HO2' C 29 HO2' C 29 15.341 -20.103 -4.162 138 H1' C 29 H1' C 29 15.505 -17.300 -2.387 139 H41 C 29 H41 C 29 20.836 -14.190 -1.591 140 H42 C 29 H42 C 29 21.026 -14.847 0.032 141 H5 C 29 H5 C 29 19.629 -16.609 0.889 142 H6 C 29 H6 C 29 17.713 -18.019 0.424 143 H5' C 30 H5' C 30 15.806 -22.120 -4.859 144 H5'' C 30 H5" C 30 16.828 -23.449 -5.433 145 H4' C 30 H4' C 30 16.690 -21.616 -7.077 146 H3' C 30 H3' C 30 19.412 -22.008 -5.796 147 H2' C 30 H2' C 30 20.235 -20.361 -7.316 148 HO2' C 30 HO2' C 30 18.696 -21.238 -9.080 149 H1' C 30 H1' C 30 18.049 -18.687 -7.076 150 H41 C 30 H41 C 30 22.419 -16.219 -3.390 151 H42 C 30 H42 C 30 22.273 -17.467 -2.151 152 H5 C 30 H5 C 30 20.649 -19.277 -2.361 153 H6 C 30 H6 C 30 19.100 -20.341 -3.898 154 H5' U 31 H5' U 31 20.503 -22.000 -9.811 155 H5'' U 31 H5" U 31 21.674 -23.296 -10.089 156 H4' U 31 H4' U 31 22.665 -21.148 -10.651 157 H3' U 31 H3' U 31 23.777 -22.372 -8.119 158 H2' U 31 H2' U 31 25.413 -20.633 -8.141 159 HO2' U 31 HO2' U 31 25.839 -19.343 -9.868 160 H1' U 31 H1' U 31 23.614 -18.652 -8.861 161 H3 U 31 H3 U 31 24.544 -17.464 -4.594 162 H5 U 31 H5 U 31 23.003 -21.320 -4.136 163 H6 U 31 H6 U 31 22.603 -21.416 -6.537 164 H5' G 32 H5' G 32 27.812 -23.570 -7.598 165 H5'' G 32 H5" G 32 26.992 -22.009 -7.460 166 H4' G 32 H4' G 32 29.410 -21.781 -7.232 167 H3' G 32 H3' G 32 28.193 -20.475 -9.664 168 H2' G 32 H2' G 32 30.334 -19.798 -10.396 169 HO2' G 32 HO2' G 32 31.068 -19.259 -8.153 170 H1' G 32 H1' G 32 31.673 -22.091 -9.873 171 H8 G 32 H8 G 32 28.033 -21.757 -11.341 172 H1 G 32 H1 G 32 32.448 -24.628 -15.059 173 H21 G 32 H21 G 32 34.439 -24.553 -14.002 174 H22 G 32 H22 G 32 34.553 -23.798 -12.420 175 H5' G 33 H5' G 33 30.842 -17.359 -7.699 176 H5'' G 33 H5" G 33 29.812 -15.936 -7.580 177 H4' G 33 H4' G 33 31.926 -15.327 -8.564 178 H3' G 33 H3' G 33 29.426 -14.923 -10.009 179 H2' G 33 H2' G 33 30.019 -15.380 -12.126 180 HO2' G 33 HO2' G 33 31.717 -13.456 -11.597 181 H1' G 33 H1' G 33 32.683 -16.366 -11.874 182 H8 G 33 H8 G 33 29.009 -17.637 -11.385 183 H1 G 33 H1 G 33 32.704 -20.657 -15.734 184 H21 G 33 H21 G 33 34.833 -19.955 -15.479 185 H22 G 33 H22 G 33 35.205 -18.741 -14.266 186 H5' G 34 H5' G 34 28.690 -10.328 -8.166 187 H5'' G 34 H5" G 34 27.720 -11.710 -7.661 188 H4' G 34 H4' G 34 27.273 -10.363 -10.272 189 H3' G 34 H3' G 34 26.192 -9.444 -7.598 190 H2' G 34 H2' G 34 24.044 -9.383 -8.240 191 HO2' G 34 HO2' G 34 23.306 -9.523 -10.380 192 H1' G 34 H1' G 34 23.891 -11.708 -9.591 193 H8 G 34 H8 G 34 26.066 -11.009 -6.365 194 H1 G 34 H1 G 34 21.770 -15.778 -6.002 195 H21 G 34 H21 G 34 20.608 -15.853 -7.860 196 H22 G 34 H22 G 34 20.925 -14.729 -9.183 197 H5' A 35 H5' A 35 27.989 -4.384 -8.334 198 H5'' A 35 H5" A 35 26.966 -5.640 -7.641 199 H4' A 35 H4' A 35 25.748 -3.677 -8.580 200 H3' A 35 H3' A 35 25.104 -6.475 -9.323 201 H2' A 35 H2' A 35 23.858 -6.006 -11.209 202 HO2' A 35 HO2' A 35 22.932 -4.037 -9.811 203 H1' A 35 H1' A 35 25.182 -3.850 -12.207 204 H8 A 35 H8 A 35 25.690 -7.566 -11.400 205 H61 A 35 H61 A 35 29.428 -7.291 -16.423 206 H62 A 35 H62 A 35 28.645 -8.429 -15.322 207 H2 A 35 H2 A 35 28.470 -3.251 -15.321 208 H5' G 36 H5' G 36 22.700 -7.270 -9.647 209 H5'' G 36 H5" G 36 21.447 -6.187 -9.028 210 H4' G 36 H4' G 36 20.480 -8.171 -10.088 211 H3' G 36 H3' G 36 20.102 -8.048 -7.093 212 H2' G 36 H2' G 36 18.713 -9.982 -7.359 213 HO2' G 36 HO2' G 36 18.028 -10.771 -9.319 214 H1' G 36 H1' G 36 20.462 -11.349 -8.891 215 H8 G 36 H8 G 36 22.699 -9.462 -6.570 216 H1 G 36 H1 G 36 19.552 -14.321 -3.679 217 H21 G 36 H21 G 36 18.051 -15.131 -5.067 218 H22 G 36 H22 G 36 17.887 -14.472 -6.694 219 H5' C 37 H5' C 37 16.484 -8.677 -8.987 220 H5'' C 37 H5" C 37 15.050 -7.944 -8.283 221 H4' C 37 H4' C 37 14.894 -10.425 -8.567 222 H3' C 37 H3' C 37 14.698 -9.239 -5.810 223 H2' C 37 H2' C 37 14.125 -11.413 -5.000 224 HO2' C 37 HO2' C 37 13.625 -13.148 -6.307 225 H1' C 37 H1' C 37 16.101 -12.708 -6.345 226 H41 C 37 H41 C 37 18.960 -11.654 -0.921 227 H42 C 37 H42 C 37 19.883 -10.427 -1.757 228 H5 C 37 H5 C 37 19.093 -9.283 -3.719 229 H6 C 37 H6 C 37 17.678 -9.578 -5.644 230 H5' U 38 H5' U 38 11.260 -11.536 -6.126 231 H5'' U 38 H5" U 38 9.839 -10.658 -5.545 232 H4' U 38 H4' U 38 10.051 -12.740 -4.355 233 H3' U 38 H3' U 38 10.726 -10.350 -2.600 234 H2' U 38 H2' U 38 10.774 -11.877 -0.778 235 HO2' U 38 HO2' U 38 8.947 -13.238 -1.839 236 H1' U 38 H1' U 38 12.275 -13.746 -2.087 237 H3 U 38 H3 U 38 14.867 -11.651 1.017 238 H5 U 38 H5 U 38 15.104 -9.232 -2.391 239 H6 U 38 H6 U 38 13.272 -10.475 -3.357 240 H5' C 39 H5' C 39 8.425 -12.125 -0.042 241 H5'' C 39 H5" C 39 7.200 -11.010 0.561 242 H4' C 39 H4' C 39 8.453 -11.856 2.390 243 H3' C 39 H3' C 39 9.371 -9.000 1.886 244 H2' C 39 H2' C 39 10.141 -9.194 4.157 245 HO2' C 39 HO2' C 39 8.465 -10.518 5.076 246 H1' C 39 H1' C 39 11.251 -11.663 3.606 247 H41 C 39 H41 C 39 15.666 -7.209 3.251 248 H42 C 39 H42 C 39 15.391 -6.970 1.526 249 H5 C 39 H5 C 39 13.515 -8.034 0.352 250 H6 C 39 H6 C 39 11.679 -9.648 0.596 251 H5' U 40 H5' U 40 7.169 -9.134 5.569 252 H5'' U 40 H5" U 40 6.335 -7.601 5.853 253 H4' U 40 H4' U 40 7.806 -8.241 7.732 254 H3' U 40 H3' U 40 8.718 -5.764 6.236 255 H2' U 40 H2' U 40 10.159 -5.420 8.146 256 HO2' U 40 HO2' U 40 8.605 -6.385 9.741 257 H1' U 40 H1' U 40 11.080 -7.985 8.031 258 H3 U 40 H3 U 40 14.229 -5.054 6.415 259 H5 U 40 H5 U 40 11.743 -5.827 3.132 260 H6 U 40 H6 U 40 10.257 -7.099 4.582 261 H5' C 41 H5' C 41 7.979 -4.559 10.220 262 H5'' C 41 H5" C 41 7.217 -2.967 10.283 263 H4' C 41 H4' C 41 9.262 -3.095 11.658 264 H3' C 41 H3' C 41 9.396 -1.226 9.286 265 H2' C 41 H2' C 41 11.471 -0.443 10.219 266 HO2' C 41 HO2' C 41 12.224 -1.043 12.247 267 H1' C 41 H1' C 41 12.435 -2.971 10.693 268 H41 C 41 H41 C 41 14.445 -1.051 5.053 269 H42 C 41 H42 C 41 12.993 -1.550 4.239 270 H5 C 41 H5 C 41 11.211 -2.732 5.474 271 H6 C 41 H6 C 41 10.378 -3.237 7.701 272 H5' U 42 H5' U 42 10.465 1.086 12.601 273 H5'' U 42 H5" U 42 9.673 2.664 12.587 274 H4' U 42 H4' U 42 12.094 2.885 12.795 275 H3' U 42 H3' U 42 10.993 3.876 10.154 276 H2' U 42 H2' U 42 13.199 4.811 9.797 277 HO2' U 42 HO2' U 42 13.471 5.266 12.208 278 H1' U 42 H1' U 42 14.480 2.514 10.526 279 H3 U 42 H3 U 42 14.779 2.907 5.984 280 H5 U 42 H5 U 42 11.125 0.993 6.631 281 H6 U 42 H6 U 42 11.335 1.462 9.014 282 H5' G 43 H5' G 43 13.202 7.231 11.778 283 H5'' G 43 H5" G 43 12.228 8.690 11.563 284 H4' G 43 H4' G 43 14.492 8.962 10.656 285 H3' G 43 H3' G 43 12.253 8.981 8.628 286 H2' G 43 H2' G 43 13.899 9.615 6.999 287 HO2' G 43 HO2' G 43 15.965 10.283 7.512 288 H1' G 43 H1' G 43 15.774 7.796 7.840 289 H8 G 43 H8 G 43 12.412 6.070 8.105 290 H1 G 43 H1 G 43 14.930 6.162 2.178 291 H21 G 43 H21 G 43 16.419 7.783 2.050 292 H22 G 43 H22 G 43 16.876 8.704 3.489 293 H5' C 44 H5' C 44 14.402 12.555 7.830 294 H5'' C 44 H5" C 44 13.292 13.897 7.528 295 H4' C 44 H4' C 44 14.785 13.621 5.639 296 H3' C 44 H3' C 44 11.954 12.751 5.008 297 H2' C 44 H2' C 44 12.676 12.576 2.735 298 HO2' C 44 HO2' C 44 14.617 13.346 1.978 299 H1' C 44 H1' C 44 14.984 11.238 3.349 300 H41 C 44 H41 C 44 11.012 6.574 2.312 301 H42 C 44 H42 C 44 10.378 6.635 3.965 302 H5 C 44 H5 C 44 10.875 8.482 5.445 303 H6 C 44 H6 C 44 12.274 10.449 5.716 304 H5' C 45 H5' C 45 12.989 15.484 1.989 305 H5'' C 45 H5" C 45 11.613 16.477 1.503 306 H4' C 45 H4' C 45 12.562 15.247 -0.385 307 H3' C 45 H3' C 45 9.776 14.334 0.384 308 H2' C 45 H2' C 45 9.829 13.066 -1.672 309 HO2' C 45 HO2' C 45 11.192 14.824 -2.773 310 H1' C 45 H1' C 45 12.337 12.077 -1.227 311 H41 C 45 H41 C 45 8.516 7.718 1.119 312 H42 C 45 H42 C 45 8.348 8.580 2.654 313 H5 C 45 H5 C 45 9.259 10.788 3.003 314 H6 C 45 H6 C 45 10.575 12.557 1.981 315 H5' C 46 H5' C 46 9.468 15.231 -3.742 316 H5'' C 46 H5" C 46 7.952 16.083 -4.052 317 H4' C 46 H4' C 46 8.131 14.071 -5.428 318 H3' C 46 H3' C 46 5.992 13.955 -3.280 319 HO3' C 46 HO3' C 46 5.617 14.194 -6.065 320 H2' C 46 H2' C 46 5.268 11.916 -4.268 321 HO2' C 46 HO2' C 46 5.956 11.223 -6.323 322 H1' C 46 H1' C 46 7.840 10.945 -4.742 323 H41 C 46 H41 C 46 5.469 8.210 0.375 324 H42 C 46 H42 C 46 5.778 9.612 1.408 325 H5 C 46 H5 C 46 6.771 11.657 0.514 326 H6 C 46 H6 C 46 7.544 12.741 -1.529 327 H1 GLY 44 H1 GLY 44 24.896 -0.105 4.376 328 H2 GLY 44 H2 GLY 44 25.275 1.384 3.780 329 H3 GLY 44 H3 GLY 44 25.873 0.901 5.230 330 HA2 GLY 44 HA2 GLY 44 27.561 0.814 3.502 331 HA3 GLY 44 HA3 GLY 44 27.227 -0.771 4.229 332 H ILE 45 H ILE 45 28.029 0.373 1.400 333 HA ILE 45 HA ILE 45 26.081 -0.625 -0.472 334 HB ILE 45 HB ILE 45 29.102 -0.380 -0.763 335 HG12 ILE 45 HG12 ILE 45 28.262 1.803 -0.160 336 HG13 ILE 45 HG13 ILE 45 28.694 1.791 -1.853 337 HG21 ILE 45 HG21 ILE 45 26.914 -0.615 -2.873 338 HG22 ILE 45 HG22 ILE 45 28.592 -0.142 -3.211 339 HG23 ILE 45 HG23 ILE 45 28.254 -1.742 -2.565 340 HD11 ILE 45 HD11 ILE 45 26.280 1.614 -2.475 341 HD12 ILE 45 HD12 ILE 45 25.851 1.653 -0.747 342 HD13 ILE 45 HD13 ILE 45 26.634 3.049 -1.500 343 H SER 46 H SER 46 25.922 -2.612 -1.514 344 HA SER 46 HA SER 46 27.443 -4.934 -0.439 345 HB2 SER 46 HB2 SER 46 25.314 -6.158 -0.111 346 HB3 SER 46 HB3 SER 46 25.474 -4.754 0.948 347 HG SER 46 HG SER 46 23.920 -4.903 -1.451 348 H TYR 47 H TYR 47 27.102 -6.911 -1.614 349 HA TYR 47 HA TYR 47 26.657 -6.546 -4.552 350 HB2 TYR 47 HB2 TYR 47 29.024 -7.855 -3.155 351 HB3 TYR 47 HB3 TYR 47 28.799 -7.712 -4.889 352 HD1 TYR 47 HD1 TYR 47 29.979 -6.036 -1.880 353 HD2 TYR 47 HD2 TYR 47 28.800 -5.433 -5.985 354 HE1 TYR 47 HE1 TYR 47 31.084 -3.806 -1.866 355 HE2 TYR 47 HE2 TYR 47 29.914 -3.196 -5.972 356 HH TYR 47 HH TYR 47 31.597 -1.925 -3.071 357 H GLY 48 H GLY 48 25.193 -8.008 -2.262 358 HA2 GLY 48 HA2 GLY 48 24.436 -10.424 -3.691 359 HA3 GLY 48 HA3 GLY 48 25.433 -10.763 -2.275 360 H ARG 49 H ARG 49 23.116 -8.095 -2.446 361 HA ARG 49 HA ARG 49 21.032 -9.402 -0.842 362 HB2 ARG 49 HB2 ARG 49 22.749 -7.136 0.244 363 HB3 ARG 49 HB3 ARG 49 21.128 -7.462 0.831 364 HG2 ARG 49 HG2 ARG 49 23.495 -9.364 1.039 365 HG3 ARG 49 HG3 ARG 49 22.773 -8.400 2.318 366 HD2 ARG 49 HD2 ARG 49 20.558 -9.683 1.754 367 HD3 ARG 49 HD3 ARG 49 21.612 -10.832 0.923 368 HE ARG 49 HE ARG 49 22.714 -10.400 3.491 369 HH11 ARG 49 HH11 ARG 49 19.783 -12.034 2.190 370 HH12 ARG 49 HH12 ARG 49 19.628 -12.987 3.501 371 HH21 ARG 49 HH21 ARG 49 22.357 -11.555 5.251 372 HH22 ARG 49 HH22 ARG 49 21.030 -12.677 5.346 373 H LYS 50 H LYS 50 19.114 -8.047 -0.644 374 HA LYS 50 HA LYS 50 18.547 -6.637 -3.098 375 HB2 LYS 50 HB2 LYS 50 16.954 -8.093 -1.885 376 HB3 LYS 50 HB3 LYS 50 16.914 -6.962 -0.538 377 HG2 LYS 50 HG2 LYS 50 14.902 -6.714 -1.842 378 HG3 LYS 50 HG3 LYS 50 15.852 -5.255 -2.006 379 HD2 LYS 50 HD2 LYS 50 16.730 -6.354 -4.238 380 HD3 LYS 50 HD3 LYS 50 15.380 -7.468 -4.040 381 HE2 LYS 50 HE2 LYS 50 13.860 -5.440 -3.888 382 HE3 LYS 50 HE3 LYS 50 15.255 -4.420 -4.272 383 HZ1 LYS 50 HZ1 LYS 50 14.025 -4.922 -6.277 384 HZ2 LYS 50 HZ2 LYS 50 15.441 -5.731 -6.405 385 HZ3 LYS 50 HZ3 LYS 50 14.043 -6.519 -5.966 386 H LYS 51 H LYS 51 17.732 -4.575 -3.326 387 HA LYS 51 HA LYS 51 19.299 -2.416 -2.454 388 HB2 LYS 51 HB2 LYS 51 16.581 -2.326 -3.825 389 HB3 LYS 51 HB3 LYS 51 17.840 -1.100 -3.909 390 HG2 LYS 51 HG2 LYS 51 17.996 -3.887 -5.123 391 HG3 LYS 51 HG3 LYS 51 17.688 -2.377 -5.967 392 HD2 LYS 51 HD2 LYS 51 19.921 -1.525 -5.293 393 HD3 LYS 51 HD3 LYS 51 20.292 -3.076 -4.518 394 HE2 LYS 51 HE2 LYS 51 19.435 -2.855 -7.431 395 HE3 LYS 51 HE3 LYS 51 21.123 -2.670 -6.946 396 HZ1 LYS 51 HZ1 LYS 51 19.564 -5.113 -6.257 397 HZ2 LYS 51 HZ2 LYS 51 20.466 -4.965 -7.606 398 HZ3 LYS 51 HZ3 LYS 51 21.203 -4.875 -6.163 399 H ARG 52 H ARG 52 17.917 -3.495 -0.059 400 HA ARG 52 HA ARG 52 16.679 -2.828 1.817 401 HB2 ARG 52 HB2 ARG 52 18.357 -0.370 1.186 402 HB3 ARG 52 HB3 ARG 52 17.651 -0.737 2.741 403 HG2 ARG 52 HG2 ARG 52 19.854 -2.338 1.376 404 HG3 ARG 52 HG3 ARG 52 20.014 -1.209 2.722 405 HD2 ARG 52 HD2 ARG 52 18.308 -2.773 3.929 406 HD3 ARG 52 HD3 ARG 52 18.788 -3.972 2.715 407 HE ARG 52 HE ARG 52 21.119 -2.816 3.968 408 HH11 ARG 52 HH11 ARG 52 18.505 -5.042 4.769 409 HH12 ARG 52 HH12 ARG 52 19.308 -5.674 6.131 410 HH21 ARG 52 HH21 ARG 52 22.156 -3.711 5.874 411 HH22 ARG 52 HH22 ARG 52 21.194 -4.765 6.835 412 H ARG 53 H ARG 53 14.675 -2.865 0.383 413 HA ARG 53 HA ARG 53 13.386 -0.592 -0.633 414 HB2 ARG 53 HB2 ARG 53 11.393 -1.895 -0.755 415 HB3 ARG 53 HB3 ARG 53 12.756 -2.934 -1.084 416 HG2 ARG 53 HG2 ARG 53 11.270 -4.229 0.162 417 HG3 ARG 53 HG3 ARG 53 12.545 -3.833 1.312 418 HD2 ARG 53 HD2 ARG 53 11.142 -2.366 2.524 419 HD3 ARG 53 HD3 ARG 53 10.040 -2.139 1.151 420 HE ARG 53 HE ARG 53 9.665 -4.768 1.751 421 HH11 ARG 53 HH11 ARG 53 9.435 -1.876 3.888 422 HH12 ARG 53 HH12 ARG 53 8.373 -2.810 4.944 423 HH21 ARG 53 HH21 ARG 53 8.161 -5.587 3.159 424 HH22 ARG 53 HH22 ARG 53 7.706 -4.614 4.572 425 H GLN 54 H GLN 54 11.597 0.730 0.039 426 HA GLN 54 HA GLN 54 11.521 1.354 2.936 427 HB2 GLN 54 HB2 GLN 54 11.475 3.236 1.497 428 HB3 GLN 54 HB3 GLN 54 10.169 2.583 0.513 429 HG2 GLN 54 HG2 GLN 54 9.449 4.416 2.036 430 HG3 GLN 54 HG3 GLN 54 8.556 2.930 2.276 431 HE21 GLN 54 HE21 GLN 54 11.294 4.104 5.184 432 HE22 GLN 54 HE22 GLN 54 11.481 4.688 3.639 433 H ARG 55 H ARG 55 8.989 0.581 0.509 434 HA ARG 55 HA ARG 55 7.538 -1.146 2.483 435 HB2 ARG 55 HB2 ARG 55 6.527 1.243 0.901 436 HB3 ARG 55 HB3 ARG 55 5.434 -0.079 1.316 437 HG2 ARG 55 HG2 ARG 55 5.892 0.171 3.689 438 HG3 ARG 55 HG3 ARG 55 7.061 1.457 3.385 439 HD2 ARG 55 HD2 ARG 55 4.139 1.616 2.524 440 HD3 ARG 55 HD3 ARG 55 4.687 2.156 4.104 441 HE ARG 55 HE ARG 55 5.056 3.511 1.542 442 HH11 ARG 55 HH11 ARG 55 6.334 3.323 4.811 443 HH12 ARG 55 HH12 ARG 55 6.884 4.970 4.792 444 HH21 ARG 55 HH21 ARG 55 5.886 5.599 1.562 445 HH22 ARG 55 HH22 ARG 55 6.669 6.195 2.996 446 H ARG 56 H ARG 56 6.091 -2.599 1.566 447 HA ARG 56 HA ARG 56 5.869 -3.126 -1.297 448 HB2 ARG 56 HB2 ARG 56 7.090 -5.163 0.621 449 HB3 ARG 56 HB3 ARG 56 6.448 -5.590 -0.954 450 HG2 ARG 56 HG2 ARG 56 8.846 -3.772 -0.498 451 HG3 ARG 56 HG3 ARG 56 8.920 -5.484 -0.882 452 HD2 ARG 56 HD2 ARG 56 7.921 -5.155 -3.045 453 HD3 ARG 56 HD3 ARG 56 7.532 -3.484 -2.686 454 HE ARG 56 HE ARG 56 10.252 -4.589 -3.199 455 HH11 ARG 56 HH11 ARG 56 8.242 -1.645 -2.962 456 HH12 ARG 56 HH12 ARG 56 9.550 -0.714 -3.714 457 HH21 ARG 56 HH21 ARG 56 11.756 -3.156 -4.131 458 HH22 ARG 56 HH22 ARG 56 11.286 -1.463 -4.276 459 H ARG 57 H ARG 57 3.929 -4.194 -1.708 460 HA ARG 57 HA ARG 57 2.516 -5.774 0.271 461 HB2 ARG 57 HB2 ARG 57 1.987 -3.299 0.883 462 HB3 ARG 57 HB3 ARG 57 1.076 -3.244 -0.626 463 HG2 ARG 57 HG2 ARG 57 -0.422 -5.033 0.212 464 HG3 ARG 57 HG3 ARG 57 0.576 -5.194 1.665 465 HD2 ARG 57 HD2 ARG 57 -1.393 -3.886 2.204 466 HD3 ARG 57 HD3 ARG 57 0.032 -2.863 2.299 467 HE ARG 57 HE ARG 57 -0.726 -1.585 0.513 468 HH11 ARG 57 HH11 ARG 57 -2.810 -4.399 0.701 469 HH12 ARG 57 HH12 ARG 57 -3.950 -3.738 -0.437 470 HH21 ARG 57 HH21 ARG 57 -2.212 -0.816 -0.940 471 HH22 ARG 57 HH22 ARG 57 -3.618 -1.761 -1.330 472 H ALA 58 H ALA 58 0.737 -6.914 -0.621 473 HA ALA 58 HA ALA 58 0.660 -7.364 -3.476 474 HB1 ALA 58 HB1 ALA 58 -1.281 -8.154 -1.256 475 HB2 ALA 58 HB2 ALA 58 -1.228 -8.842 -2.893 476 HB3 ALA 58 HB3 ALA 58 0.132 -9.097 -1.786 477 H HIS 59 H HIS 59 -1.433 -7.216 -4.718 478 HA HIS 59 HA HIS 59 -3.246 -4.984 -4.073 479 HB2 HIS 59 HB2 HIS 59 -2.799 -3.780 -6.147 480 HB3 HIS 59 HB3 HIS 59 -1.353 -3.851 -5.158 481 HD2 HIS 59 HD2 HIS 59 0.746 -5.243 -6.097 482 HE1 HIS 59 HE1 HIS 59 -0.860 -6.136 -9.949 483 HE2 HIS 59 HE2 HIS 59 1.244 -6.179 -8.513 484 H GLN 60 H GLN 60 -4.909 -4.710 -5.840 485 HA GLN 60 HA GLN 60 -5.604 -7.104 -7.389 486 HB2 GLN 60 HB2 GLN 60 -6.457 -7.650 -5.148 487 HB3 GLN 60 HB3 GLN 60 -7.277 -6.093 -5.050 488 HG2 GLN 60 HG2 GLN 60 -8.867 -7.868 -5.512 489 HG3 GLN 60 HG3 GLN 60 -8.812 -6.747 -6.861 490 HE21 GLN 60 HE21 GLN 60 -7.485 -9.201 -9.165 491 HE22 GLN 60 HE22 GLN 60 -7.527 -7.460 -8.818 Start of MODEL 8 1 H5' G 16 H5' G 16 1.385 -2.465 -2.889 2 H5'' G 16 H5" G 16 3.009 -2.959 -3.370 3 H4' G 16 H4' G 16 2.106 -1.154 -4.768 4 H3' G 16 H3' G 16 4.501 -0.302 -3.121 5 H2' G 16 H2' G 16 4.537 1.614 -4.568 6 HO2' G 16 HO2' G 16 3.180 1.837 -6.362 7 H1' G 16 H1' G 16 1.854 2.070 -4.254 8 H8 G 16 H8 G 16 2.992 0.740 -0.944 9 H1 G 16 H1 G 16 4.976 6.771 -2.081 10 H21 G 16 H21 G 16 4.910 7.127 -4.269 11 H22 G 16 H22 G 16 4.156 5.943 -5.343 12 HO5' G 16 HO5' G 16 2.295 -1.315 -1.140 13 H5' G 17 H5' G 17 5.508 0.440 -7.278 14 H5'' G 17 H5" G 17 7.089 -0.312 -7.553 15 H4' G 17 H4' G 17 7.142 1.932 -8.424 16 H3' G 17 H3' G 17 8.723 1.599 -5.859 17 H2' G 17 H2' G 17 9.568 3.813 -6.255 18 HO2' G 17 HO2' G 17 9.595 3.535 -8.679 19 H1' G 17 H1' G 17 7.119 4.868 -6.755 20 H8 G 17 H8 G 17 6.577 2.147 -4.144 21 H1 G 17 H1 G 17 8.970 7.674 -1.835 22 H21 G 17 H21 G 17 9.754 8.877 -3.527 23 H22 G 17 H22 G 17 9.537 8.320 -5.189 24 H5' G 18 H5' G 18 11.626 3.108 -8.634 25 H5'' G 18 H5" G 18 13.182 2.329 -8.337 26 H4' G 18 H4' G 18 13.290 4.783 -8.238 27 H3' G 18 H3' G 18 13.903 3.388 -5.621 28 H2' G 18 H2' G 18 14.594 5.576 -4.844 29 HO2' G 18 HO2' G 18 15.376 6.158 -7.153 30 H1' G 18 H1' G 18 12.374 6.835 -5.765 31 H8 G 18 H8 G 18 11.241 3.375 -4.725 32 H1 G 18 H1 G 18 12.176 7.424 0.208 33 H21 G 18 H21 G 18 13.396 9.133 -0.492 34 H22 G 18 H22 G 18 13.796 9.296 -2.205 35 H5' C 19 H5' C 19 17.128 5.987 -6.262 36 H5'' C 19 H5" C 19 18.665 5.199 -5.919 37 H4' C 19 H4' C 19 18.453 7.245 -4.629 38 H3' C 19 H3' C 19 18.260 4.741 -2.942 39 H2' C 19 H2' C 19 18.473 6.229 -1.041 40 HO2' C 19 HO2' C 19 19.972 7.745 -2.209 41 H1' C 19 H1' C 19 16.602 7.977 -1.997 42 H41 C 19 H41 C 19 13.458 3.947 1.633 43 H42 C 19 H42 C 19 13.297 2.774 0.320 44 H5 C 19 H5 C 19 14.454 3.034 -1.784 45 H6 C 19 H6 C 19 15.777 4.568 -3.116 46 H5' A 20 H5' A 20 21.615 6.825 -1.238 47 H5'' A 20 H5" A 20 22.841 5.640 -0.781 48 H4' A 20 H4' A 20 22.190 7.052 1.100 49 H3' A 20 H3' A 20 21.346 4.159 1.411 50 H2' A 20 H2' A 20 20.794 4.755 3.682 51 HO2' A 20 HO2' A 20 22.642 6.342 3.861 52 H1' A 20 H1' A 20 19.406 6.975 2.957 53 H8 A 20 H8 A 20 18.892 4.444 0.157 54 H61 A 20 H61 A 20 14.585 2.043 4.003 55 H62 A 20 H62 A 20 15.187 2.000 2.340 56 H2 A 20 H2 A 20 16.966 4.835 6.294 57 H5' G 21 H5' G 21 23.669 4.833 5.038 58 H5'' G 21 H5" G 21 24.687 3.400 5.226 59 H4' G 21 H4' G 21 23.472 3.792 7.242 60 H3' G 21 H3' G 21 22.341 1.356 5.809 61 H2' G 21 H2' G 21 21.217 0.953 7.904 62 HO2' G 21 HO2' G 21 23.081 2.004 9.201 63 H1' G 21 H1' G 21 20.228 3.470 7.998 64 H8 G 21 H8 G 21 20.613 2.667 4.313 65 H1 G 21 H1 G 21 15.721 -0.437 7.141 66 H21 G 21 H21 G 21 15.974 -0.354 9.334 67 H22 G 21 H22 G 21 17.296 0.580 10.035 68 H5' A 22 H5' A 22 23.147 0.063 9.593 69 H5'' A 22 H5" A 22 24.375 -1.177 9.554 70 H4' A 22 H4' A 22 22.698 -1.882 11.103 71 H3' A 22 H3' A 22 22.465 -3.418 8.508 72 H2' A 22 H2' A 22 20.628 -4.613 9.400 73 HO2' A 22 HO2' A 22 21.597 -4.822 11.585 74 H1' A 22 H1' A 22 19.390 -2.484 10.589 75 H8 A 22 H8 A 22 20.892 -1.380 7.244 76 H61 A 22 H61 A 22 15.612 -3.564 4.787 77 H62 A 22 H62 A 22 16.885 -2.367 4.601 78 H2 A 22 H2 A 22 15.822 -4.999 8.908 79 H5' U 23 H5' U 23 26.018 -6.191 7.660 80 H5'' U 23 H5" U 23 24.841 -6.006 6.360 81 H4' U 23 H4' U 23 24.236 -7.391 9.006 82 H3' U 23 H3' U 23 25.786 -8.474 6.878 83 H2' U 23 H2' U 23 24.013 -8.522 5.367 84 HO2' U 23 HO2' U 23 24.158 -10.911 6.791 85 H1' U 23 H1' U 23 22.232 -9.214 7.733 86 H3 U 23 H3 U 23 18.649 -9.893 5.116 87 H5 U 23 H5 U 23 20.783 -6.995 2.956 88 H6 U 23 H6 U 23 22.429 -6.930 4.767 89 H5' U 25 H5' U 25 24.738 -8.402 10.839 90 H5'' U 25 H5" U 25 26.434 -8.216 11.327 91 H4' U 25 H4' U 25 24.484 -10.049 12.772 92 H3' U 25 H3' U 25 24.294 -7.216 12.695 93 H2' U 25 H2' U 25 26.281 -6.923 13.909 94 HO2' U 25 HO2' U 25 24.160 -6.450 15.302 95 H1' U 25 H1' U 25 25.446 -9.425 15.425 96 H3 U 25 H3 U 25 29.455 -10.946 17.145 97 H5 U 25 H5 U 25 29.917 -6.818 16.661 98 H6 U 25 H6 U 25 27.822 -6.750 15.436 99 H5' G 26 H5' G 26 21.964 -9.393 11.958 100 H5'' G 26 H5" G 26 21.450 -8.311 10.672 101 H4' G 26 H4' G 26 19.690 -9.272 12.858 102 H3' G 26 H3' G 26 19.997 -10.124 9.978 103 H2' G 26 H2' G 26 17.658 -10.509 9.875 104 HO2' G 26 HO2' G 26 17.687 -11.276 12.268 105 H1' G 26 H1' G 26 16.910 -8.208 11.096 106 H8 G 26 H8 G 26 19.943 -7.197 9.197 107 H1 G 26 H1 G 26 14.833 -8.179 5.389 108 H21 G 26 H21 G 26 13.342 -9.398 6.554 109 H22 G 26 H22 G 26 13.650 -9.770 8.251 110 H5' A 27 H5' A 27 17.354 -13.163 11.601 111 H5'' A 27 H5" A 27 18.041 -14.729 11.153 112 H4' A 27 H4' A 27 15.748 -14.648 10.438 113 H3' A 27 H3' A 27 17.660 -14.381 8.099 114 H2' A 27 H2' A 27 15.730 -14.806 6.750 115 HO2' A 27 HO2' A 27 13.725 -15.391 7.594 116 H1' A 27 H1' A 27 14.190 -12.990 8.127 117 H8 A 27 H8 A 27 17.676 -11.505 7.960 118 H61 A 27 H61 A 27 16.362 -10.450 1.918 119 H62 A 27 H62 A 27 17.478 -10.020 3.170 120 H2 A 27 H2 A 27 13.208 -12.940 3.527 121 H5' G 28 H5' G 28 15.348 -17.630 7.303 122 H5'' G 28 H5" G 28 16.192 -18.961 6.513 123 H4' G 28 H4' G 28 14.199 -18.109 5.292 124 H3' G 28 H3' G 28 16.855 -17.935 3.819 125 H2' G 28 H2' G 28 15.551 -17.353 1.914 126 HO2' G 28 HO2' G 28 13.640 -18.792 2.777 127 H1' G 28 H1' G 28 14.090 -15.475 3.185 128 H8 G 28 H8 G 28 17.384 -15.224 4.906 129 H1 G 28 H1 G 28 17.579 -13.060 -1.141 130 H21 G 28 H21 G 28 15.890 -13.986 -2.281 131 H22 G 28 H22 G 28 14.741 -15.006 -1.409 132 H5' C 29 H5' C 29 14.399 -19.713 1.217 133 H5'' C 29 H5" C 29 15.078 -21.193 0.551 134 H4' C 29 H4' C 29 14.366 -19.625 -1.200 135 H3' C 29 H3' C 29 17.337 -20.139 -1.001 136 H2' C 29 H2' C 29 17.462 -19.048 -3.147 137 HO2' C 29 HO2' C 29 15.750 -19.568 -4.379 138 H1' C 29 H1' C 29 15.749 -17.034 -2.459 139 H41 C 29 H41 C 29 21.208 -14.222 -1.525 140 H42 C 29 H42 C 29 21.287 -14.812 0.132 141 H5 C 29 H5 C 29 19.734 -16.445 1.005 142 H6 C 29 H6 C 29 17.739 -17.746 0.509 143 H5' C 30 H5' C 30 15.740 -21.760 -4.705 144 H5'' C 30 H5" C 30 16.676 -23.119 -5.351 145 H4' C 30 H4' C 30 16.556 -21.169 -6.907 146 H3' C 30 H3' C 30 19.300 -21.883 -5.837 147 H2' C 30 H2' C 30 20.184 -20.231 -7.294 148 HO2' C 30 HO2' C 30 18.993 -19.224 -8.927 149 H1' C 30 H1' C 30 18.182 -18.376 -6.796 150 H41 C 30 H41 C 30 22.871 -16.384 -3.283 151 H42 C 30 H42 C 30 22.616 -17.596 -2.019 152 H5 C 30 H5 C 30 20.861 -19.289 -2.224 153 H6 C 30 H6 C 30 19.187 -20.205 -3.727 154 H5' U 31 H5' U 31 20.015 -21.506 -9.829 155 H5'' U 31 H5" U 31 21.011 -22.837 -10.422 156 H4' U 31 H4' U 31 22.147 -20.728 -10.830 157 H3' U 31 H3' U 31 23.371 -22.482 -8.697 158 H2' U 31 H2' U 31 25.188 -20.969 -8.552 159 HO2' U 31 HO2' U 31 25.090 -20.711 -11.020 160 H1' U 31 H1' U 31 23.649 -18.656 -8.858 161 H3 U 31 H3 U 31 24.770 -18.004 -4.528 162 H5 U 31 H5 U 31 22.914 -21.746 -4.416 163 H6 U 31 H6 U 31 22.491 -21.577 -6.807 164 H5' G 32 H5' G 32 27.517 -23.938 -9.405 165 H5'' G 32 H5" G 32 26.872 -22.458 -8.659 166 H4' G 32 H4' G 32 29.376 -22.546 -9.235 167 H3' G 32 H3' G 32 27.485 -20.346 -9.714 168 H2' G 32 H2' G 32 28.743 -19.153 -11.275 169 HO2' G 32 HO2' G 32 30.969 -19.476 -11.671 170 H1' G 32 H1' G 32 29.767 -21.217 -12.758 171 H8 G 32 H8 G 32 26.875 -19.189 -12.294 172 H1 G 32 H1 G 32 25.408 -24.301 -15.938 173 H21 G 32 H21 G 32 27.094 -25.793 -15.805 174 H22 G 32 H22 G 32 28.485 -25.443 -14.793 175 H5' G 33 H5' G 33 30.694 -18.088 -9.407 176 H5'' G 33 H5" G 33 30.577 -16.802 -8.225 177 H4' G 33 H4' G 33 30.950 -16.071 -10.622 178 H3' G 33 H3' G 33 28.628 -15.083 -8.984 179 H2' G 33 H2' G 33 28.128 -13.544 -10.726 180 HO2' G 33 HO2' G 33 30.414 -13.035 -11.239 181 H1' G 33 H1' G 33 28.394 -15.328 -12.768 182 H8 G 33 H8 G 33 26.910 -17.379 -10.084 183 H1 G 33 H1 G 33 22.789 -12.943 -12.323 184 H21 G 33 H21 G 33 23.964 -11.437 -13.527 185 H22 G 33 H22 G 33 25.691 -11.662 -13.743 186 H5' G 34 H5' G 34 28.961 -10.307 -7.707 187 H5'' G 34 H5" G 34 27.875 -11.619 -7.247 188 H4' G 34 H4' G 34 27.676 -10.291 -9.892 189 H3' G 34 H3' G 34 26.413 -9.357 -7.305 190 H2' G 34 H2' G 34 24.308 -9.279 -8.087 191 HO2' G 34 HO2' G 34 23.724 -9.496 -10.285 192 H1' G 34 H1' G 34 24.219 -11.636 -9.364 193 H8 G 34 H8 G 34 26.181 -10.805 -6.023 194 H1 G 34 H1 G 34 22.220 -15.861 -5.881 195 H21 G 34 H21 G 34 21.164 -16.011 -7.790 196 H22 G 34 H22 G 34 21.610 -14.981 -9.158 197 H5' A 35 H5' A 35 28.110 -4.289 -7.751 198 H5'' A 35 H5" A 35 26.994 -5.557 -7.263 199 H4' A 35 H4' A 35 25.991 -3.589 -8.461 200 H3' A 35 H3' A 35 25.434 -6.397 -9.229 201 H2' A 35 H2' A 35 24.517 -5.943 -11.303 202 HO2' A 35 HO2' A 35 23.380 -3.971 -10.193 203 H1' A 35 H1' A 35 26.104 -3.908 -12.137 204 H8 A 35 H8 A 35 26.162 -7.579 -11.219 205 H61 A 35 H61 A 35 31.154 -7.709 -15.004 206 H62 A 35 H62 A 35 29.999 -8.755 -14.174 207 H2 A 35 H2 A 35 30.276 -3.583 -14.190 208 H5' G 36 H5' G 36 23.122 -7.389 -9.470 209 H5'' G 36 H5" G 36 21.790 -6.234 -9.520 210 H4' G 36 H4' G 36 20.821 -8.285 -10.128 211 H3' G 36 H3' G 36 20.315 -7.944 -7.155 212 H2' G 36 H2' G 36 19.017 -9.937 -7.332 213 HO2' G 36 HO2' G 36 18.324 -10.808 -9.218 214 H1' G 36 H1' G 36 20.856 -11.316 -8.776 215 H8 G 36 H8 G 36 22.916 -9.254 -6.401 216 H1 G 36 H1 G 36 19.988 -14.325 -3.634 217 H21 G 36 H21 G 36 18.572 -15.202 -5.094 218 H22 G 36 H22 G 36 18.430 -14.522 -6.713 219 H5' C 37 H5' C 37 16.686 -8.753 -9.100 220 H5'' C 37 H5" C 37 15.264 -7.995 -8.389 221 H4' C 37 H4' C 37 15.106 -10.459 -8.592 222 H3' C 37 H3' C 37 14.989 -9.329 -5.800 223 H2' C 37 H2' C 37 14.399 -11.574 -5.099 224 HO2' C 37 HO2' C 37 13.182 -11.956 -7.223 225 H1' C 37 H1' C 37 16.371 -12.777 -6.511 226 H41 C 37 H41 C 37 19.164 -11.806 -0.970 227 H42 C 37 H42 C 37 19.999 -10.463 -1.718 228 H5 C 37 H5 C 37 19.314 -9.404 -3.738 229 H6 C 37 H6 C 37 17.881 -9.629 -5.670 230 H5' U 38 H5' U 38 11.493 -11.897 -5.950 231 H5'' U 38 H5" U 38 10.124 -10.891 -5.458 232 H4' U 38 H4' U 38 10.108 -12.901 -4.156 233 H3' U 38 H3' U 38 10.934 -10.460 -2.541 234 H2' U 38 H2' U 38 10.809 -11.821 -0.611 235 HO2' U 38 HO2' U 38 8.897 -13.104 -1.592 236 H1' U 38 H1' U 38 12.178 -13.922 -1.708 237 H3 U 38 H3 U 38 14.772 -11.655 1.312 238 H5 U 38 H5 U 38 15.478 -9.797 -2.374 239 H6 U 38 H6 U 38 13.607 -11.010 -3.304 240 H5' C 39 H5' C 39 8.320 -11.748 0.092 241 H5'' C 39 H5" C 39 7.174 -10.455 0.466 242 H4' C 39 H4' C 39 8.240 -11.153 2.471 243 H3' C 39 H3' C 39 9.497 -8.492 1.685 244 H2' C 39 H2' C 39 10.145 -8.494 3.974 245 HO2' C 39 HO2' C 39 9.255 -9.732 5.485 246 H1' C 39 H1' C 39 10.965 -11.135 3.796 247 H41 C 39 H41 C 39 15.878 -7.257 3.290 248 H42 C 39 H42 C 39 15.739 -7.185 1.534 249 H5 C 39 H5 C 39 13.830 -8.178 0.344 250 H6 C 39 H6 C 39 11.807 -9.545 0.629 251 H5' U 40 H5' U 40 7.198 -8.285 5.142 252 H5'' U 40 H5" U 40 6.477 -6.721 5.542 253 H4' U 40 H4' U 40 7.890 -7.662 7.372 254 H3' U 40 H3' U 40 8.845 -5.083 6.120 255 H2' U 40 H2' U 40 10.423 -4.988 7.949 256 HO2' U 40 HO2' U 40 10.371 -6.351 9.699 257 H1' U 40 H1' U 40 11.206 -7.585 7.629 258 H3 U 40 H3 U 40 14.560 -4.857 6.136 259 H5 U 40 H5 U 40 12.010 -5.313 2.839 260 H6 U 40 H6 U 40 10.388 -6.412 4.272 261 H5' C 41 H5' C 41 8.415 -4.516 10.259 262 H5'' C 41 H5" C 41 7.677 -2.967 10.681 263 H4' C 41 H4' C 41 9.790 -3.280 11.863 264 H3' C 41 H3' C 41 9.821 -1.107 9.761 265 H2' C 41 H2' C 41 11.994 -0.495 10.625 266 HO2' C 41 HO2' C 41 11.298 -1.129 12.921 267 H1' C 41 H1' C 41 12.926 -3.057 10.700 268 H41 C 41 H41 C 41 14.666 -1.002 5.045 269 H42 C 41 H42 C 41 13.197 -1.673 4.327 270 H5 C 41 H5 C 41 11.354 -2.428 5.632 271 H6 C 41 H6 C 41 10.613 -2.912 7.887 272 H5' U 42 H5' U 42 11.272 0.949 13.163 273 H5'' U 42 H5" U 42 10.418 2.491 13.285 274 H4' U 42 H4' U 42 12.796 2.879 13.258 275 H3' U 42 H3' U 42 11.475 3.713 10.662 276 H2' U 42 H2' U 42 13.586 4.806 10.182 277 HO2' U 42 HO2' U 42 13.954 5.350 12.551 278 H1' U 42 H1' U 42 15.052 2.610 10.889 279 H3 U 42 H3 U 42 15.116 2.932 6.322 280 H5 U 42 H5 U 42 11.485 1.051 7.162 281 H6 U 42 H6 U 42 11.839 1.488 9.534 282 H5' G 43 H5' G 43 13.439 7.257 11.989 283 H5'' G 43 H5" G 43 12.370 8.634 11.708 284 H4' G 43 H4' G 43 14.548 8.987 10.692 285 H3' G 43 H3' G 43 12.324 8.612 8.666 286 H2' G 43 H2' G 43 13.950 9.365 7.045 287 HO2' G 43 HO2' G 43 14.990 10.884 8.720 288 H1' G 43 H1' G 43 15.910 7.714 7.971 289 H8 G 43 H8 G 43 12.689 5.792 8.399 290 H1 G 43 H1 G 43 14.682 6.153 2.282 291 H21 G 43 H21 G 43 16.134 7.803 2.097 292 H22 G 43 H22 G 43 16.689 8.674 3.532 293 H5' C 44 H5' C 44 14.045 12.253 7.566 294 H5'' C 44 H5" C 44 12.791 13.441 7.206 295 H4' C 44 H4' C 44 14.354 13.191 5.352 296 H3' C 44 H3' C 44 11.560 12.181 4.754 297 H2' C 44 H2' C 44 12.307 12.074 2.457 298 HO2' C 44 HO2' C 44 13.732 14.054 2.717 299 H1' C 44 H1' C 44 14.665 10.845 3.088 300 H41 C 44 H41 C 44 10.796 6.152 1.768 301 H42 C 44 H42 C 44 10.232 5.996 3.417 302 H5 C 44 H5 C 44 10.850 7.686 5.120 303 H6 C 44 H6 C 44 12.204 9.671 5.512 304 H5' C 45 H5' C 45 12.316 15.141 1.775 305 H5'' C 45 H5" C 45 10.840 16.049 1.434 306 H4' C 45 H4' C 45 11.758 14.996 -0.578 307 H3' C 45 H3' C 45 9.099 13.845 0.318 308 H2' C 45 H2' C 45 9.097 12.705 -1.811 309 HO2' C 45 HO2' C 45 10.254 14.623 -2.887 310 H1' C 45 H1' C 45 11.703 11.891 -1.593 311 H41 C 45 H41 C 45 8.236 7.165 0.584 312 H42 C 45 H42 C 45 8.150 7.851 2.205 313 H5 C 45 H5 C 45 8.978 10.093 2.695 314 H6 C 45 H6 C 45 10.147 12.005 1.744 315 H5' C 46 H5' C 46 8.411 14.909 -3.676 316 H5'' C 46 H5" C 46 6.815 15.643 -3.848 317 H4' C 46 H4' C 46 7.072 13.685 -5.302 318 H3' C 46 H3' C 46 5.075 13.352 -3.041 319 HO3' C 46 HO3' C 46 4.521 13.646 -5.789 320 H2' C 46 H2' C 46 4.448 11.295 -4.058 321 HO2' C 46 HO2' C 46 5.065 10.719 -6.171 322 H1' C 46 H1' C 46 7.058 10.543 -4.712 323 H41 C 46 H41 C 46 5.119 7.433 0.376 324 H42 C 46 H42 C 46 5.341 8.819 1.452 325 H5 C 46 H5 C 46 6.150 10.971 0.611 326 H6 C 46 H6 C 46 6.778 12.186 -1.411 327 H1 GLY 44 H1 GLY 44 19.644 1.630 -5.065 328 H2 GLY 44 H2 GLY 44 19.958 2.034 -6.624 329 H3 GLY 44 H3 GLY 44 20.062 3.167 -5.437 330 HA2 GLY 44 HA2 GLY 44 22.271 2.488 -6.095 331 HA3 GLY 44 HA3 GLY 44 21.916 2.038 -4.417 332 H ILE 45 H ILE 45 23.585 0.433 -4.633 333 HA ILE 45 HA ILE 45 22.651 -2.173 -5.690 334 HB ILE 45 HB ILE 45 24.907 -2.660 -6.611 335 HG12 ILE 45 HG12 ILE 45 25.433 0.341 -6.502 336 HG13 ILE 45 HG13 ILE 45 26.120 -0.817 -5.364 337 HG21 ILE 45 HG21 ILE 45 24.547 -1.650 -8.766 338 HG22 ILE 45 HG22 ILE 45 22.985 -2.034 -8.054 339 HG23 ILE 45 HG23 ILE 45 23.565 -0.353 -8.061 340 HD11 ILE 45 HD11 ILE 45 26.627 -0.790 -8.365 341 HD12 ILE 45 HD12 ILE 45 27.743 -0.304 -7.080 342 HD13 ILE 45 HD13 ILE 45 27.255 -2.001 -7.219 343 H SER 46 H SER 46 24.167 -3.956 -4.930 344 HA SER 46 HA SER 46 25.450 -3.367 -2.286 345 HB2 SER 46 HB2 SER 46 24.405 -5.157 -1.261 346 HB3 SER 46 HB3 SER 46 23.101 -4.483 -2.244 347 HG SER 46 HG SER 46 22.979 -6.427 -3.037 348 H TYR 47 H TYR 47 26.317 -5.959 -1.795 349 HA TYR 47 HA TYR 47 28.214 -6.621 -4.004 350 HB2 TYR 47 HB2 TYR 47 28.828 -6.783 -1.037 351 HB3 TYR 47 HB3 TYR 47 29.942 -7.022 -2.374 352 HD1 TYR 47 HD1 TYR 47 30.460 -5.005 -3.913 353 HD2 TYR 47 HD2 TYR 47 28.522 -4.625 -0.075 354 HE1 TYR 47 HE1 TYR 47 31.054 -2.587 -3.851 355 HE2 TYR 47 HE2 TYR 47 29.110 -2.202 -0.022 356 HH TYR 47 HH TYR 47 30.925 -0.620 -2.677 357 H GLY 48 H GLY 48 25.498 -7.742 -2.774 358 HA2 GLY 48 HA2 GLY 48 25.383 -10.289 -3.509 359 HA3 GLY 48 HA3 GLY 48 26.335 -10.517 -2.044 360 H ARG 49 H ARG 49 23.733 -8.126 -2.230 361 HA ARG 49 HA ARG 49 21.765 -9.825 -0.830 362 HB2 ARG 49 HB2 ARG 49 23.148 -7.397 0.378 363 HB3 ARG 49 HB3 ARG 49 21.499 -7.777 0.831 364 HG2 ARG 49 HG2 ARG 49 23.880 -9.625 1.248 365 HG3 ARG 49 HG3 ARG 49 23.068 -8.634 2.457 366 HD2 ARG 49 HD2 ARG 49 20.899 -9.922 1.757 367 HD3 ARG 49 HD3 ARG 49 22.012 -11.093 1.026 368 HE ARG 49 HE ARG 49 22.936 -10.649 3.646 369 HH11 ARG 49 HH11 ARG 49 19.971 -12.126 2.227 370 HH12 ARG 49 HH12 ARG 49 19.683 -13.024 3.556 371 HH21 ARG 49 HH21 ARG 49 22.413 -11.723 5.407 372 HH22 ARG 49 HH22 ARG 49 21.016 -12.762 5.464 373 H LYS 50 H LYS 50 19.660 -8.488 -0.452 374 HA LYS 50 HA LYS 50 19.011 -7.194 -3.001 375 HB2 LYS 50 HB2 LYS 50 17.411 -8.703 -1.798 376 HB3 LYS 50 HB3 LYS 50 17.322 -7.538 -0.482 377 HG2 LYS 50 HG2 LYS 50 15.372 -7.267 -1.867 378 HG3 LYS 50 HG3 LYS 50 16.384 -5.853 -2.061 379 HD2 LYS 50 HD2 LYS 50 17.295 -7.275 -4.194 380 HD3 LYS 50 HD3 LYS 50 15.724 -8.032 -4.039 381 HE2 LYS 50 HE2 LYS 50 16.239 -5.027 -4.297 382 HE3 LYS 50 HE3 LYS 50 15.833 -6.105 -5.638 383 HZ1 LYS 50 HZ1 LYS 50 14.062 -5.615 -3.307 384 HZ2 LYS 50 HZ2 LYS 50 13.866 -4.975 -4.806 385 HZ3 LYS 50 HZ3 LYS 50 13.725 -6.588 -4.593 386 H LYS 51 H LYS 51 18.656 -5.134 -3.409 387 HA LYS 51 HA LYS 51 19.710 -2.931 -1.930 388 HB2 LYS 51 HB2 LYS 51 17.518 -3.062 -4.042 389 HB3 LYS 51 HB3 LYS 51 18.333 -1.580 -3.535 390 HG2 LYS 51 HG2 LYS 51 20.397 -2.209 -4.523 391 HG3 LYS 51 HG3 LYS 51 19.961 -3.917 -4.602 392 HD2 LYS 51 HD2 LYS 51 18.164 -3.363 -6.269 393 HD3 LYS 51 HD3 LYS 51 18.729 -1.691 -6.270 394 HE2 LYS 51 HE2 LYS 51 19.572 -2.942 -8.192 395 HE3 LYS 51 HE3 LYS 51 20.903 -2.387 -7.177 396 HZ1 LYS 51 HZ1 LYS 51 20.885 -4.821 -7.999 397 HZ2 LYS 51 HZ2 LYS 51 21.337 -4.560 -6.471 398 HZ3 LYS 51 HZ3 LYS 51 19.809 -5.106 -6.797 399 H ARG 52 H ARG 52 19.036 -2.221 -0.019 400 HA ARG 52 HA ARG 52 16.871 -3.196 1.459 401 HB2 ARG 52 HB2 ARG 52 18.139 -0.457 1.858 402 HB3 ARG 52 HB3 ARG 52 17.376 -1.473 3.060 403 HG2 ARG 52 HG2 ARG 52 20.081 -1.929 1.753 404 HG3 ARG 52 HG3 ARG 52 19.735 -1.415 3.396 405 HD2 ARG 52 HD2 ARG 52 18.461 -3.718 3.558 406 HD3 ARG 52 HD3 ARG 52 19.473 -4.167 2.184 407 HE ARG 52 HE ARG 52 21.387 -3.241 3.806 408 HH11 ARG 52 HH11 ARG 52 18.696 -5.297 4.783 409 HH12 ARG 52 HH12 ARG 52 19.445 -5.760 6.242 410 HH21 ARG 52 HH21 ARG 52 22.359 -3.949 5.800 411 HH22 ARG 52 HH22 ARG 52 21.339 -4.816 6.880 412 H ARG 53 H ARG 53 14.705 -2.634 1.795 413 HA ARG 53 HA ARG 53 13.601 -0.201 0.482 414 HB2 ARG 53 HB2 ARG 53 12.169 -1.348 -1.001 415 HB3 ARG 53 HB3 ARG 53 13.749 -2.061 -1.206 416 HG2 ARG 53 HG2 ARG 53 12.620 -4.007 -1.138 417 HG3 ARG 53 HG3 ARG 53 12.739 -3.838 0.609 418 HD2 ARG 53 HD2 ARG 53 10.471 -2.781 0.641 419 HD3 ARG 53 HD3 ARG 53 10.377 -2.903 -1.112 420 HE ARG 53 HE ARG 53 9.786 -4.971 0.822 421 HH11 ARG 53 HH11 ARG 53 10.833 -4.663 -2.548 422 HH12 ARG 53 HH12 ARG 53 10.276 -6.291 -2.877 423 HH21 ARG 53 HH21 ARG 53 9.045 -6.831 0.237 424 HH22 ARG 53 HH22 ARG 53 9.322 -7.489 -1.387 425 H GLN 54 H GLN 54 11.358 0.239 0.884 426 HA GLN 54 HA GLN 54 10.094 -1.178 3.165 427 HB2 GLN 54 HB2 GLN 54 9.448 0.877 4.262 428 HB3 GLN 54 HB3 GLN 54 11.195 0.765 4.163 429 HG2 GLN 54 HG2 GLN 54 11.289 2.434 2.412 430 HG3 GLN 54 HG3 GLN 54 9.540 2.388 2.172 431 HE21 GLN 54 HE21 GLN 54 11.150 4.534 5.252 432 HE22 GLN 54 HE22 GLN 54 11.884 3.066 4.902 433 H ARG 55 H ARG 55 7.798 -0.349 3.457 434 HA ARG 55 HA ARG 55 6.371 0.372 0.946 435 HB2 ARG 55 HB2 ARG 55 5.758 -2.073 2.676 436 HB3 ARG 55 HB3 ARG 55 4.740 -1.466 1.367 437 HG2 ARG 55 HG2 ARG 55 6.519 -1.952 -0.286 438 HG3 ARG 55 HG3 ARG 55 7.591 -2.504 1.012 439 HD2 ARG 55 HD2 ARG 55 6.648 -4.445 -0.015 440 HD3 ARG 55 HD3 ARG 55 5.993 -4.267 1.619 441 HE ARG 55 HE ARG 55 4.365 -3.108 -0.566 442 HH11 ARG 55 HH11 ARG 55 4.753 -5.949 1.532 443 HH12 ARG 55 HH12 ARG 55 3.135 -6.484 1.161 444 HH21 ARG 55 HH21 ARG 55 2.393 -3.809 -0.886 445 HH22 ARG 55 HH22 ARG 55 1.808 -5.303 -0.179 446 H ARG 56 H ARG 56 4.119 1.002 1.398 447 HA ARG 56 HA ARG 56 3.510 1.847 4.185 448 HB2 ARG 56 HB2 ARG 56 4.917 3.542 2.730 449 HB3 ARG 56 HB3 ARG 56 3.392 3.864 1.914 450 HG2 ARG 56 HG2 ARG 56 2.374 4.626 3.984 451 HG3 ARG 56 HG3 ARG 56 3.767 4.087 4.936 452 HD2 ARG 56 HD2 ARG 56 3.877 6.243 2.783 453 HD3 ARG 56 HD3 ARG 56 3.676 6.548 4.515 454 HE ARG 56 HE ARG 56 6.046 4.975 3.626 455 HH11 ARG 56 HH11 ARG 56 4.931 8.058 4.860 456 HH12 ARG 56 HH12 ARG 56 6.528 8.533 5.363 457 HH21 ARG 56 HH21 ARG 56 8.035 5.603 4.341 458 HH22 ARG 56 HH22 ARG 56 8.216 7.156 5.122 459 H ARG 57 H ARG 57 1.335 2.673 4.444 460 HA ARG 57 HA ARG 57 -0.722 1.995 2.429 461 HB2 ARG 57 HB2 ARG 57 -0.171 -0.146 3.567 462 HB3 ARG 57 HB3 ARG 57 -0.497 0.591 5.136 463 HG2 ARG 57 HG2 ARG 57 -2.876 0.802 4.596 464 HG3 ARG 57 HG3 ARG 57 -2.572 0.334 2.915 465 HD2 ARG 57 HD2 ARG 57 -3.539 -1.522 4.114 466 HD3 ARG 57 HD3 ARG 57 -1.874 -1.913 3.653 467 HE ARG 57 HE ARG 57 -1.743 -0.856 6.263 468 HH11 ARG 57 HH11 ARG 57 -3.124 -3.707 4.766 469 HH12 ARG 57 HH12 ARG 57 -2.982 -4.652 6.223 470 HH21 ARG 57 HH21 ARG 57 -1.588 -2.122 8.089 471 HH22 ARG 57 HH22 ARG 57 -2.136 -3.771 8.048 472 H ALA 58 H ALA 58 -2.784 2.802 2.937 473 HA ALA 58 HA ALA 58 -3.236 4.400 5.366 474 HB1 ALA 58 HB1 ALA 58 -3.442 5.581 2.553 475 HB2 ALA 58 HB2 ALA 58 -3.927 6.388 4.060 476 HB3 ALA 58 HB3 ALA 58 -2.221 6.012 3.773 477 H HIS 59 H HIS 59 -5.554 5.166 5.418 478 HA HIS 59 HA HIS 59 -7.491 3.383 4.014 479 HB2 HIS 59 HB2 HIS 59 -7.216 3.675 7.035 480 HB3 HIS 59 HB3 HIS 59 -8.547 2.868 6.215 481 HD2 HIS 59 HD2 HIS 59 -5.071 2.235 7.513 482 HE1 HIS 59 HE1 HIS 59 -6.147 -1.296 5.372 483 HE2 HIS 59 HE2 HIS 59 -4.465 -0.277 6.990 484 H GLN 60 H GLN 60 -9.741 4.002 4.425 485 HA GLN 60 HA GLN 60 -10.341 6.724 5.324 486 HB2 GLN 60 HB2 GLN 60 -11.345 7.439 3.228 487 HB3 GLN 60 HB3 GLN 60 -9.623 7.135 3.024 488 HG2 GLN 60 HG2 GLN 60 -10.156 4.913 1.996 489 HG3 GLN 60 HG3 GLN 60 -11.878 5.270 2.137 490 HE21 GLN 60 HE21 GLN 60 -10.332 6.293 -1.274 491 HE22 GLN 60 HE22 GLN 60 -9.980 4.878 -0.289 Start of MODEL 9 1 H5' G 16 H5' G 16 0.918 -1.846 -3.870 2 H5'' G 16 H5" G 16 2.390 -2.652 -4.427 3 H4' G 16 H4' G 16 2.047 -0.748 -5.806 4 H3' G 16 H3' G 16 4.233 -0.117 -3.803 5 H2' G 16 H2' G 16 4.702 1.747 -5.252 6 HO2' G 16 HO2' G 16 3.624 2.079 -7.211 7 H1' G 16 H1' G 16 2.066 2.484 -5.299 8 H8 G 16 H8 G 16 2.673 1.033 -1.864 9 H1 G 16 H1 G 16 5.275 6.878 -2.730 10 H21 G 16 H21 G 16 5.414 7.270 -4.912 11 H22 G 16 H22 G 16 4.671 6.157 -6.065 12 HO5' G 16 HO5' G 16 2.665 -2.609 -2.291 13 H5' G 17 H5' G 17 5.865 0.456 -7.522 14 H5'' G 17 H5" G 17 7.477 -0.262 -7.629 15 H4' G 17 H4' G 17 7.559 2.033 -8.372 16 H3' G 17 H3' G 17 8.873 1.641 -5.661 17 H2' G 17 H2' G 17 9.806 3.824 -6.032 18 HO2' G 17 HO2' G 17 9.979 3.557 -8.453 19 H1' G 17 H1' G 17 7.387 4.884 -6.660 20 H8 G 17 H8 G 17 6.668 2.158 -4.124 21 H1 G 17 H1 G 17 9.267 7.523 -1.638 22 H21 G 17 H21 G 17 10.151 8.712 -3.307 23 H22 G 17 H22 G 17 9.934 8.179 -4.975 24 H5' G 18 H5' G 18 11.850 3.021 -8.237 25 H5'' G 18 H5" G 18 13.412 2.265 -7.925 26 H4' G 18 H4' G 18 13.441 4.757 -7.861 27 H3' G 18 H3' G 18 14.206 3.273 -5.345 28 H2' G 18 H2' G 18 14.849 5.426 -4.446 29 HO2' G 18 HO2' G 18 15.646 6.181 -6.649 30 H1' G 18 H1' G 18 12.608 6.719 -5.287 31 H8 G 18 H8 G 18 11.485 3.240 -4.280 32 H1 G 18 H1 G 18 12.381 7.322 0.641 33 H21 G 18 H21 G 18 13.639 9.007 -0.064 34 H22 G 18 H22 G 18 14.064 9.147 -1.774 35 H5' C 19 H5' C 19 17.590 5.852 -6.139 36 H5'' C 19 H5" C 19 19.080 4.973 -5.785 37 H4' C 19 H4' C 19 18.961 7.024 -4.489 38 H3' C 19 H3' C 19 18.639 4.539 -2.790 39 H2' C 19 H2' C 19 18.882 6.036 -0.898 40 HO2' C 19 HO2' C 19 20.450 7.484 -2.093 41 H1' C 19 H1' C 19 17.096 7.849 -1.881 42 H41 C 19 H41 C 19 13.818 3.855 1.700 43 H42 C 19 H42 C 19 13.715 2.672 0.400 44 H5 C 19 H5 C 19 14.853 2.937 -1.692 45 H6 C 19 H6 C 19 16.214 4.448 -3.002 46 H5' A 20 H5' A 20 21.966 6.626 -0.979 47 H5'' A 20 H5" A 20 23.154 5.416 -0.487 48 H4' A 20 H4' A 20 22.532 6.829 1.381 49 H3' A 20 H3' A 20 21.487 3.996 1.671 50 H2' A 20 H2' A 20 21.013 4.636 3.960 51 HO2' A 20 HO2' A 20 22.968 6.131 4.061 52 H1' A 20 H1' A 20 19.750 6.923 3.209 53 H8 A 20 H8 A 20 19.171 4.310 0.476 54 H61 A 20 H61 A 20 14.762 2.157 4.362 55 H62 A 20 H62 A 20 15.457 1.898 2.792 56 H2 A 20 H2 A 20 17.107 5.072 6.541 57 H5' G 21 H5' G 21 23.496 4.449 5.257 58 H5'' G 21 H5" G 21 24.484 3.011 5.518 59 H4' G 21 H4' G 21 23.140 3.340 7.431 60 H3' G 21 H3' G 21 21.945 1.048 5.836 61 H2' G 21 H2' G 21 20.777 0.592 7.901 62 HO2' G 21 HO2' G 21 21.077 1.860 9.770 63 H1' G 21 H1' G 21 19.876 3.159 8.018 64 H8 G 21 H8 G 21 20.442 2.312 4.357 65 H1 G 21 H1 G 21 15.408 -0.777 6.934 66 H21 G 21 H21 G 21 15.462 -0.522 9.137 67 H22 G 21 H22 G 21 16.692 0.505 9.878 68 H5' A 22 H5' A 22 22.911 -0.206 9.578 69 H5'' A 22 H5" A 22 24.247 -1.323 9.492 70 H4' A 22 H4' A 22 22.828 -2.135 11.238 71 H3' A 22 H3' A 22 22.442 -3.727 8.701 72 H2' A 22 H2' A 22 20.690 -4.956 9.650 73 HO2' A 22 HO2' A 22 21.638 -5.310 11.761 74 H1' A 22 H1' A 22 19.451 -2.921 10.977 75 H8 A 22 H8 A 22 20.636 -1.595 7.574 76 H61 A 22 H61 A 22 15.372 -3.948 5.358 77 H62 A 22 H62 A 22 16.563 -2.679 5.129 78 H2 A 22 H2 A 22 15.745 -5.358 9.482 79 H5' U 23 H5' U 23 26.186 -6.233 7.750 80 H5'' U 23 H5" U 23 25.031 -5.944 6.449 81 H4' U 23 H4' U 23 24.294 -7.285 9.082 82 H3' U 23 H3' U 23 25.821 -8.454 6.964 83 H2' U 23 H2' U 23 24.062 -8.517 5.464 84 HO2' U 23 HO2' U 23 24.072 -10.844 6.991 85 H1' U 23 H1' U 23 22.231 -8.993 7.839 86 H3 U 23 H3 U 23 18.790 -9.761 5.064 87 H5 U 23 H5 U 23 20.979 -6.848 2.973 88 H6 U 23 H6 U 23 22.534 -6.728 4.865 89 H5' U 25 H5' U 25 24.938 -8.298 10.883 90 H5'' U 25 H5" U 25 26.666 -8.093 11.229 91 H4' U 25 H4' U 25 24.926 -9.887 12.939 92 H3' U 25 H3' U 25 24.475 -7.079 12.637 93 H2' U 25 H2' U 25 26.384 -6.504 13.826 94 HO2' U 25 HO2' U 25 24.241 -6.245 15.241 95 H1' U 25 H1' U 25 25.893 -9.022 15.462 96 H3 U 25 H3 U 25 30.116 -9.948 17.108 97 H5 U 25 H5 U 25 30.012 -5.817 16.477 98 H6 U 25 H6 U 25 27.900 -6.071 15.310 99 H5' G 26 H5' G 26 22.140 -9.372 11.986 100 H5'' G 26 H5" G 26 21.764 -8.284 10.653 101 H4' G 26 H4' G 26 19.827 -9.081 12.755 102 H3' G 26 H3' G 26 20.164 -9.972 9.884 103 H2' G 26 H2' G 26 17.824 -10.227 9.750 104 HO2' G 26 HO2' G 26 16.434 -10.146 11.527 105 H1' G 26 H1' G 26 17.220 -7.861 10.987 106 H8 G 26 H8 G 26 20.239 -7.043 9.004 107 H1 G 26 H1 G 26 15.045 -7.967 5.324 108 H21 G 26 H21 G 26 13.555 -9.143 6.560 109 H22 G 26 H22 G 26 13.881 -9.418 8.270 110 H5' A 27 H5' A 27 17.308 -12.753 11.558 111 H5'' A 27 H5" A 27 17.911 -14.387 11.248 112 H4' A 27 H4' A 27 15.645 -14.274 10.489 113 H3' A 27 H3' A 27 17.610 -14.238 8.176 114 H2' A 27 H2' A 27 15.697 -14.626 6.793 115 HO2' A 27 HO2' A 27 14.594 -16.038 8.467 116 H1' A 27 H1' A 27 14.197 -12.696 8.018 117 H8 A 27 H8 A 27 17.721 -11.299 7.930 118 H61 A 27 H61 A 27 16.598 -10.368 1.829 119 H62 A 27 H62 A 27 17.678 -9.907 3.103 120 H2 A 27 H2 A 27 13.423 -12.862 3.371 121 H5' G 28 H5' G 28 15.274 -17.659 7.423 122 H5'' G 28 H5" G 28 16.235 -18.946 6.694 123 H4' G 28 H4' G 28 14.272 -18.210 5.354 124 H3' G 28 H3' G 28 16.965 -17.844 3.979 125 H2' G 28 H2' G 28 15.680 -17.388 2.039 126 HO2' G 28 HO2' G 28 13.411 -17.535 1.969 127 H1' G 28 H1' G 28 14.098 -15.570 3.284 128 H8 G 28 H8 G 28 17.389 -15.249 5.052 129 H1 G 28 H1 G 28 17.514 -13.009 -0.970 130 H21 G 28 H21 G 28 15.816 -13.929 -2.103 131 H22 G 28 H22 G 28 14.678 -14.958 -1.229 132 H5' C 29 H5' C 29 14.635 -19.858 1.441 133 H5'' C 29 H5" C 29 15.407 -21.283 0.762 134 H4' C 29 H4' C 29 14.494 -19.808 -0.979 135 H3' C 29 H3' C 29 17.503 -20.080 -0.896 136 H2' C 29 H2' C 29 17.464 -19.022 -3.062 137 HO2' C 29 HO2' C 29 15.716 -19.792 -4.161 138 H1' C 29 H1' C 29 15.647 -17.118 -2.325 139 H41 C 29 H41 C 29 21.085 -14.125 -1.635 140 H42 C 29 H42 C 29 21.195 -14.614 0.044 141 H5 C 29 H5 C 29 19.710 -16.280 1.008 142 H6 C 29 H6 C 29 17.751 -17.663 0.600 143 H5' C 30 H5' C 30 15.941 -21.910 -4.522 144 H5'' C 30 H5" C 30 16.955 -23.233 -5.123 145 H4' C 30 H4' C 30 16.684 -21.382 -6.767 146 H3' C 30 H3' C 30 19.472 -21.894 -5.704 147 H2' C 30 H2' C 30 20.260 -20.233 -7.223 148 HO2' C 30 HO2' C 30 18.534 -21.044 -8.881 149 H1' C 30 H1' C 30 18.120 -18.502 -6.866 150 H41 C 30 H41 C 30 22.729 -16.004 -3.534 151 H42 C 30 H42 C 30 22.516 -17.108 -2.169 152 H5 C 30 H5 C 30 20.883 -18.925 -2.254 153 H6 C 30 H6 C 30 19.260 -20.036 -3.678 154 H5' U 31 H5' U 31 20.216 -21.742 -9.825 155 H5'' U 31 H5" U 31 21.292 -23.071 -10.274 156 H4' U 31 H4' U 31 22.309 -20.900 -10.811 157 H3' U 31 H3' U 31 23.588 -22.513 -8.611 158 H2' U 31 H2' U 31 25.249 -20.900 -8.346 159 HO2' U 31 HO2' U 31 25.763 -19.329 -9.785 160 H1' U 31 H1' U 31 23.622 -18.673 -8.921 161 H3 U 31 H3 U 31 24.634 -17.619 -4.661 162 H5 U 31 H5 U 31 23.005 -21.452 -4.271 163 H6 U 31 H6 U 31 22.621 -21.498 -6.682 164 H5' G 32 H5' G 32 27.741 -23.810 -8.943 165 H5'' G 32 H5" G 32 26.994 -22.280 -8.444 166 H4' G 32 H4' G 32 29.489 -22.224 -8.623 167 H3' G 32 H3' G 32 27.728 -20.352 -10.126 168 H2' G 32 H2' G 32 29.495 -19.408 -11.386 169 HO2' G 32 HO2' G 32 30.964 -19.689 -9.333 170 H1' G 32 H1' G 32 30.809 -21.702 -11.990 171 H8 G 32 H8 G 32 27.253 -20.267 -12.219 172 H1 G 32 H1 G 32 28.941 -24.313 -16.949 173 H21 G 32 H21 G 32 30.883 -25.311 -16.387 174 H22 G 32 H22 G 32 31.657 -24.909 -14.863 175 H5' G 33 H5' G 33 30.999 -17.803 -8.828 176 H5'' G 33 H5" G 33 30.338 -16.397 -8.003 177 H4' G 33 H4' G 33 31.818 -15.719 -9.839 178 H3' G 33 H3' G 33 28.910 -14.996 -10.073 179 H2' G 33 H2' G 33 29.083 -14.350 -12.299 180 HO2' G 33 HO2' G 33 31.207 -13.172 -11.650 181 H1' G 33 H1' G 33 31.079 -16.065 -13.177 182 H8 G 33 H8 G 33 27.870 -17.195 -11.219 183 H1 G 33 H1 G 33 27.779 -17.888 -17.628 184 H21 G 33 H21 G 33 29.760 -17.197 -18.455 185 H22 G 33 H22 G 33 30.991 -16.584 -17.362 186 H5' G 34 H5' G 34 29.007 -11.419 -10.577 187 H5'' G 34 H5" G 34 29.004 -10.371 -9.164 188 H4' G 34 H4' G 34 27.152 -10.221 -11.028 189 H3' G 34 H3' G 34 26.453 -9.772 -8.096 190 H2' G 34 H2' G 34 24.250 -9.673 -8.648 191 HO2' G 34 HO2' G 34 24.580 -8.542 -10.727 192 H1' G 34 H1' G 34 24.104 -11.896 -10.114 193 H8 G 34 H8 G 34 26.751 -11.524 -7.203 194 H1 G 34 H1 G 34 21.980 -15.705 -6.188 195 H21 G 34 H21 G 34 20.694 -15.789 -7.948 196 H22 G 34 H22 G 34 20.950 -14.723 -9.330 197 H5' A 35 H5' A 35 28.255 -4.571 -8.301 198 H5'' A 35 H5" A 35 27.179 -5.824 -7.690 199 H4' A 35 H4' A 35 25.989 -3.747 -8.244 200 H3' A 35 H3' A 35 25.256 -6.349 -9.404 201 H2' A 35 H2' A 35 24.192 -5.645 -11.320 202 HO2' A 35 HO2' A 35 22.796 -4.163 -10.039 203 H1' A 35 H1' A 35 25.423 -3.262 -11.872 204 H8 A 35 H8 A 35 26.141 -7.049 -11.691 205 H61 A 35 H61 A 35 29.565 -5.729 -16.775 206 H62 A 35 H62 A 35 28.913 -7.078 -15.838 207 H2 A 35 H2 A 35 28.434 -1.989 -14.990 208 H5' G 36 H5' G 36 22.809 -7.124 -9.836 209 H5'' G 36 H5" G 36 21.578 -6.304 -8.874 210 H4' G 36 H4' G 36 20.811 -8.282 -10.225 211 H3' G 36 H3' G 36 20.330 -8.153 -7.255 212 H2' G 36 H2' G 36 18.983 -10.136 -7.544 213 HO2' G 36 HO2' G 36 18.343 -9.279 -9.863 214 H1' G 36 H1' G 36 20.747 -11.479 -9.079 215 H8 G 36 H8 G 36 23.018 -9.656 -6.829 216 H1 G 36 H1 G 36 19.839 -14.391 -3.764 217 H21 G 36 H21 G 36 18.240 -15.141 -5.083 218 H22 G 36 H22 G 36 18.028 -14.475 -6.703 219 H5' C 37 H5' C 37 16.637 -8.871 -9.093 220 H5'' C 37 H5" C 37 15.267 -8.039 -8.380 221 H4' C 37 H4' C 37 14.996 -10.479 -8.440 222 H3' C 37 H3' C 37 15.172 -9.280 -5.674 223 H2' C 37 H2' C 37 14.372 -11.457 -4.938 224 HO2' C 37 HO2' C 37 12.995 -11.779 -6.931 225 H1' C 37 H1' C 37 16.176 -12.814 -6.417 226 H41 C 37 H41 C 37 19.127 -11.925 -0.864 227 H42 C 37 H42 C 37 20.026 -10.659 -1.659 228 H5 C 37 H5 C 37 19.539 -9.771 -3.769 229 H6 C 37 H6 C 37 18.052 -9.891 -5.690 230 H5' U 38 H5' U 38 11.332 -11.176 -5.903 231 H5'' U 38 H5" U 38 10.083 -10.130 -5.215 232 H4' U 38 H4' U 38 10.037 -12.366 -4.214 233 H3' U 38 H3' U 38 10.831 -10.090 -2.384 234 H2' U 38 H2' U 38 10.844 -11.629 -0.579 235 HO2' U 38 HO2' U 38 8.940 -12.884 -1.663 236 H1' U 38 H1' U 38 12.220 -13.586 -1.886 237 H3 U 38 H3 U 38 14.896 -11.508 1.222 238 H5 U 38 H5 U 38 15.558 -9.511 -2.394 239 H6 U 38 H6 U 38 13.620 -10.612 -3.306 240 H5' C 39 H5' C 39 8.534 -11.756 0.163 241 H5'' C 39 H5" C 39 7.286 -10.633 0.699 242 H4' C 39 H4' C 39 8.438 -11.367 2.611 243 H3' C 39 H3' C 39 9.496 -8.591 1.945 244 H2' C 39 H2' C 39 10.218 -8.677 4.229 245 HO2' C 39 HO2' C 39 8.697 -9.745 5.424 246 H1' C 39 H1' C 39 11.203 -11.219 3.900 247 H41 C 39 H41 C 39 15.968 -7.180 3.262 248 H42 C 39 H42 C 39 15.752 -7.108 1.516 249 H5 C 39 H5 C 39 13.765 -8.039 0.416 250 H6 C 39 H6 C 39 11.762 -9.415 0.777 251 H5' U 40 H5' U 40 6.910 -8.530 5.297 252 H5'' U 40 H5" U 40 6.083 -6.989 5.542 253 H4' U 40 H4' U 40 7.296 -7.717 7.545 254 H3' U 40 H3' U 40 8.432 -5.246 6.217 255 H2' U 40 H2' U 40 9.766 -5.032 8.226 256 HO2' U 40 HO2' U 40 7.909 -6.029 9.582 257 H1' U 40 H1' U 40 10.520 -7.652 8.237 258 H3 U 40 H3 U 40 14.173 -5.164 6.930 259 H5 U 40 H5 U 40 12.021 -5.939 3.430 260 H6 U 40 H6 U 40 10.155 -6.739 4.737 261 H5' C 41 H5' C 41 7.731 -4.175 10.165 262 H5'' C 41 H5" C 41 7.155 -2.519 10.335 263 H4' C 41 H4' C 41 9.261 -2.979 11.573 264 H3' C 41 H3' C 41 9.393 -0.916 9.370 265 H2' C 41 H2' C 41 11.595 -0.404 10.178 266 HO2' C 41 HO2' C 41 12.434 -1.195 12.096 267 H1' C 41 H1' C 41 12.358 -3.029 10.408 268 H41 C 41 H41 C 41 14.324 -1.205 4.712 269 H42 C 41 H42 C 41 12.765 -1.627 4.011 270 H5 C 41 H5 C 41 10.949 -2.497 5.270 271 H6 C 41 H6 C 41 10.113 -2.830 7.545 272 H5' U 42 H5' U 42 10.788 0.976 12.913 273 H5'' U 42 H5" U 42 9.981 2.536 13.122 274 H4' U 42 H4' U 42 12.353 2.873 13.285 275 H3' U 42 H3' U 42 11.221 3.894 10.667 276 H2' U 42 H2' U 42 13.378 4.903 10.303 277 HO2' U 42 HO2' U 42 13.633 5.321 12.742 278 H1' U 42 H1' U 42 14.763 2.657 11.015 279 H3 U 42 H3 U 42 15.111 2.981 6.476 280 H5 U 42 H5 U 42 11.466 1.027 7.121 281 H6 U 42 H6 U 42 11.619 1.574 9.480 282 H5' G 43 H5' G 43 13.278 7.241 12.026 283 H5'' G 43 H5" G 43 12.257 8.671 11.837 284 H4' G 43 H4' G 43 14.385 8.971 10.698 285 H3' G 43 H3' G 43 12.048 8.667 8.796 286 H2' G 43 H2' G 43 13.583 9.386 7.097 287 HO2' G 43 HO2' G 43 15.590 10.252 7.521 288 H1' G 43 H1' G 43 15.626 7.765 7.999 289 H8 G 43 H8 G 43 12.353 5.855 8.276 290 H1 G 43 H1 G 43 14.876 6.009 2.350 291 H21 G 43 H21 G 43 16.329 7.663 2.223 292 H22 G 43 H22 G 43 16.768 8.578 3.668 293 H5' C 44 H5' C 44 13.847 12.320 7.856 294 H5'' C 44 H5" C 44 12.666 13.561 7.424 295 H4' C 44 H4' C 44 14.293 13.221 5.637 296 H3' C 44 H3' C 44 11.500 12.283 4.926 297 H2' C 44 H2' C 44 12.349 12.068 2.676 298 HO2' C 44 HO2' C 44 13.830 14.007 2.937 299 H1' C 44 H1' C 44 14.629 10.786 3.455 300 H41 C 44 H41 C 44 10.821 6.015 2.271 301 H42 C 44 H42 C 44 10.055 6.100 3.871 302 H5 C 44 H5 C 44 10.522 7.920 5.407 303 H6 C 44 H6 C 44 11.857 9.927 5.733 304 H5' C 45 H5' C 45 12.523 15.110 1.891 305 H5'' C 45 H5" C 45 11.094 16.040 1.433 306 H4' C 45 H4' C 45 12.086 14.891 -0.488 307 H3' C 45 H3' C 45 9.374 13.793 0.307 308 H2' C 45 H2' C 45 9.459 12.609 -1.779 309 HO2' C 45 HO2' C 45 11.014 12.960 -3.344 310 H1' C 45 H1' C 45 12.052 11.775 -1.390 311 H41 C 45 H41 C 45 8.445 7.111 0.692 312 H42 C 45 H42 C 45 8.248 7.854 2.280 313 H5 C 45 H5 C 45 9.059 10.096 2.762 314 H6 C 45 H6 C 45 10.275 11.993 1.834 315 H5' C 46 H5' C 46 9.103 14.901 -3.709 316 H5'' C 46 H5" C 46 7.569 15.699 -4.071 317 H4' C 46 H4' C 46 7.916 13.796 -5.554 318 H3' C 46 H3' C 46 5.695 13.409 -3.527 319 HO3' C 46 HO3' C 46 4.416 14.064 -5.314 320 H2' C 46 H2' C 46 5.139 11.407 -4.694 321 HO2' C 46 HO2' C 46 5.575 12.412 -6.868 322 H1' C 46 H1' C 46 7.765 10.608 -5.070 323 H41 C 46 H41 C 46 5.418 7.416 -0.220 324 H42 C 46 H42 C 46 5.693 8.737 0.920 325 H5 C 46 H5 C 46 6.557 10.902 0.185 326 H6 C 46 H6 C 46 7.283 12.175 -1.762 327 H1 GLY 44 H1 GLY 44 26.735 -2.039 7.078 328 H2 GLY 44 H2 GLY 44 27.077 -2.606 8.572 329 H3 GLY 44 H3 GLY 44 26.863 -3.650 7.335 330 HA2 GLY 44 HA2 GLY 44 29.062 -1.690 7.496 331 HA3 GLY 44 HA3 GLY 44 29.226 -3.412 7.889 332 H ILE 45 H ILE 45 29.691 -4.809 6.272 333 HA ILE 45 HA ILE 45 29.128 -4.130 3.427 334 HB ILE 45 HB ILE 45 31.797 -5.164 4.487 335 HG12 ILE 45 HG12 ILE 45 31.109 -2.506 3.145 336 HG13 ILE 45 HG13 ILE 45 31.539 -2.730 4.841 337 HG21 ILE 45 HG21 ILE 45 32.535 -5.124 2.121 338 HG22 ILE 45 HG22 ILE 45 31.195 -6.220 2.321 339 HG23 ILE 45 HG23 ILE 45 30.913 -4.611 1.612 340 HD11 ILE 45 HD11 ILE 45 33.389 -3.079 2.466 341 HD12 ILE 45 HD12 ILE 45 33.460 -1.872 3.755 342 HD13 ILE 45 HD13 ILE 45 33.794 -3.574 4.131 343 H SER 46 H SER 46 28.470 -5.904 2.243 344 HA SER 46 HA SER 46 28.560 -8.630 3.407 345 HB2 SER 46 HB2 SER 46 25.935 -7.278 2.641 346 HB3 SER 46 HB3 SER 46 26.147 -8.937 3.223 347 HG SER 46 HG SER 46 27.222 -7.722 5.106 348 H TYR 47 H TYR 47 27.783 -10.276 1.955 349 HA TYR 47 HA TYR 47 27.710 -9.636 -0.948 350 HB2 TYR 47 HB2 TYR 47 29.492 -11.749 0.330 351 HB3 TYR 47 HB3 TYR 47 29.312 -11.447 -1.391 352 HD1 TYR 47 HD1 TYR 47 30.126 -9.251 -2.380 353 HD2 TYR 47 HD2 TYR 47 31.019 -10.448 1.669 354 HE1 TYR 47 HE1 TYR 47 31.959 -7.570 -2.287 355 HE2 TYR 47 HE2 TYR 47 32.851 -8.758 1.761 356 HH TYR 47 HH TYR 47 33.622 -6.633 -1.023 357 H GLY 48 H GLY 48 26.795 -11.440 -2.234 358 HA2 GLY 48 HA2 GLY 48 25.024 -12.897 -2.614 359 HA3 GLY 48 HA3 GLY 48 25.280 -13.585 -1.003 360 H ARG 49 H ARG 49 24.506 -10.277 -2.002 361 HA ARG 49 HA ARG 49 21.829 -10.190 -0.756 362 HB2 ARG 49 HB2 ARG 49 24.204 -8.471 0.127 363 HB3 ARG 49 HB3 ARG 49 22.536 -8.113 0.540 364 HG2 ARG 49 HG2 ARG 49 24.098 -10.551 1.463 365 HG3 ARG 49 HG3 ARG 49 23.680 -9.118 2.401 366 HD2 ARG 49 HD2 ARG 49 21.229 -9.666 1.973 367 HD3 ARG 49 HD3 ARG 49 21.764 -11.216 1.314 368 HE ARG 49 HE ARG 49 22.893 -10.666 3.941 369 HH11 ARG 49 HH11 ARG 49 19.985 -12.133 2.393 370 HH12 ARG 49 HH12 ARG 49 19.599 -12.974 3.737 371 HH21 ARG 49 HH21 ARG 49 22.275 -11.671 5.679 372 HH22 ARG 49 HH22 ARG 49 20.856 -12.668 5.717 373 H LYS 50 H LYS 50 20.900 -7.946 -1.070 374 HA LYS 50 HA LYS 50 21.893 -6.566 -3.537 375 HB2 LYS 50 HB2 LYS 50 19.601 -5.986 -4.115 376 HB3 LYS 50 HB3 LYS 50 19.868 -7.706 -4.170 377 HG2 LYS 50 HG2 LYS 50 18.725 -7.963 -1.963 378 HG3 LYS 50 HG3 LYS 50 18.481 -6.218 -1.874 379 HD2 LYS 50 HD2 LYS 50 17.362 -8.016 -4.056 380 HD3 LYS 50 HD3 LYS 50 16.472 -7.518 -2.610 381 HE2 LYS 50 HE2 LYS 50 16.357 -5.260 -3.278 382 HE3 LYS 50 HE3 LYS 50 17.639 -5.453 -4.479 383 HZ1 LYS 50 HZ1 LYS 50 15.463 -5.402 -5.538 384 HZ2 LYS 50 HZ2 LYS 50 16.197 -6.831 -5.796 385 HZ3 LYS 50 HZ3 LYS 50 14.958 -6.746 -4.735 386 H LYS 51 H LYS 51 21.048 -4.379 -3.723 387 HA LYS 51 HA LYS 51 21.710 -2.589 -1.602 388 HB2 LYS 51 HB2 LYS 51 19.964 -2.253 -4.079 389 HB3 LYS 51 HB3 LYS 51 20.533 -0.915 -3.078 390 HG2 LYS 51 HG2 LYS 51 22.844 -1.362 -3.595 391 HG3 LYS 51 HG3 LYS 51 22.466 -2.865 -4.430 392 HD2 LYS 51 HD2 LYS 51 21.501 -0.133 -5.345 393 HD3 LYS 51 HD3 LYS 51 22.974 -0.896 -5.934 394 HE2 LYS 51 HE2 LYS 51 20.212 -2.180 -6.176 395 HE3 LYS 51 HE3 LYS 51 20.907 -1.123 -7.402 396 HZ1 LYS 51 HZ1 LYS 51 21.328 -3.430 -7.930 397 HZ2 LYS 51 HZ2 LYS 51 22.752 -2.692 -7.647 398 HZ3 LYS 51 HZ3 LYS 51 22.122 -3.720 -6.545 399 H ARG 52 H ARG 52 20.433 -1.331 -0.238 400 HA ARG 52 HA ARG 52 18.251 -2.693 1.060 401 HB2 ARG 52 HB2 ARG 52 19.309 0.141 1.402 402 HB3 ARG 52 HB3 ARG 52 18.175 -0.651 2.487 403 HG2 ARG 52 HG2 ARG 52 21.025 -1.633 1.980 404 HG3 ARG 52 HG3 ARG 52 20.519 -0.625 3.328 405 HD2 ARG 52 HD2 ARG 52 18.892 -2.438 3.999 406 HD3 ARG 52 HD3 ARG 52 19.639 -3.479 2.770 407 HE ARG 52 HE ARG 52 21.638 -2.365 4.562 408 HH11 ARG 52 HH11 ARG 52 19.000 -4.741 4.761 409 HH12 ARG 52 HH12 ARG 52 19.762 -5.610 6.006 410 HH21 ARG 52 HH21 ARG 52 22.600 -3.627 6.151 411 HH22 ARG 52 HH22 ARG 52 21.637 -4.853 6.904 412 H ARG 53 H ARG 53 16.240 -1.414 1.739 413 HA ARG 53 HA ARG 53 14.714 -0.367 -0.609 414 HB2 ARG 53 HB2 ARG 53 13.054 -2.225 -0.311 415 HB3 ARG 53 HB3 ARG 53 14.618 -2.785 -0.872 416 HG2 ARG 53 HG2 ARG 53 15.183 -3.793 1.162 417 HG3 ARG 53 HG3 ARG 53 14.061 -2.826 2.117 418 HD2 ARG 53 HD2 ARG 53 13.079 -4.799 0.041 419 HD3 ARG 53 HD3 ARG 53 13.485 -5.289 1.692 420 HE ARG 53 HE ARG 53 11.761 -3.122 2.016 421 HH11 ARG 53 HH11 ARG 53 11.367 -6.273 0.438 422 HH12 ARG 53 HH12 ARG 53 9.718 -6.373 1.077 423 HH21 ARG 53 HH21 ARG 53 9.750 -3.486 2.772 424 HH22 ARG 53 HH22 ARG 53 8.900 -4.974 2.278 425 H GLN 54 H GLN 54 12.225 -0.348 0.167 426 HA GLN 54 HA GLN 54 12.013 0.484 3.034 427 HB2 GLN 54 HB2 GLN 54 11.958 2.508 1.736 428 HB3 GLN 54 HB3 GLN 54 10.723 1.876 0.659 429 HG2 GLN 54 HG2 GLN 54 9.836 3.511 2.270 430 HG3 GLN 54 HG3 GLN 54 9.075 1.950 2.498 431 HE21 GLN 54 HE21 GLN 54 11.609 3.432 5.367 432 HE22 GLN 54 HE22 GLN 54 11.418 4.268 3.950 433 H ARG 55 H ARG 55 9.306 0.312 0.766 434 HA ARG 55 HA ARG 55 8.332 -2.171 2.118 435 HB2 ARG 55 HB2 ARG 55 6.169 -1.244 2.402 436 HB3 ARG 55 HB3 ARG 55 7.356 -0.187 3.150 437 HG2 ARG 55 HG2 ARG 55 7.180 1.379 1.205 438 HG3 ARG 55 HG3 ARG 55 5.966 0.313 0.468 439 HD2 ARG 55 HD2 ARG 55 4.473 0.605 2.378 440 HD3 ARG 55 HD3 ARG 55 5.716 1.529 3.246 441 HE ARG 55 HE ARG 55 5.004 2.743 0.694 442 HH11 ARG 55 HH11 ARG 55 3.778 2.412 3.959 443 HH12 ARG 55 HH12 ARG 55 2.986 3.963 3.917 444 HH21 ARG 55 HH21 ARG 55 4.092 4.782 0.769 445 HH22 ARG 55 HH22 ARG 55 3.119 5.238 2.142 446 H ARG 56 H ARG 56 6.520 -3.186 1.071 447 HA ARG 56 HA ARG 56 6.448 -3.030 -1.925 448 HB2 ARG 56 HB2 ARG 56 6.786 -5.495 -0.158 449 HB3 ARG 56 HB3 ARG 56 6.433 -5.570 -1.877 450 HG2 ARG 56 HG2 ARG 56 8.948 -4.270 -0.766 451 HG3 ARG 56 HG3 ARG 56 8.827 -5.945 -1.304 452 HD2 ARG 56 HD2 ARG 56 8.088 -5.157 -3.558 453 HD3 ARG 56 HD3 ARG 56 8.290 -3.490 -3.021 454 HE ARG 56 HE ARG 56 10.598 -3.682 -3.140 455 HH11 ARG 56 HH11 ARG 56 9.452 -7.045 -3.481 456 HH12 ARG 56 HH12 ARG 56 10.628 -7.314 -4.758 457 HH21 ARG 56 HH21 ARG 56 12.355 -4.437 -4.292 458 HH22 ARG 56 HH22 ARG 56 12.406 -6.138 -4.735 459 H ARG 57 H ARG 57 4.582 -2.489 0.586 460 HA ARG 57 HA ARG 57 2.134 -3.936 -0.375 461 HB2 ARG 57 HB2 ARG 57 2.888 -3.391 2.515 462 HB3 ARG 57 HB3 ARG 57 1.520 -4.329 1.947 463 HG2 ARG 57 HG2 ARG 57 4.453 -5.161 1.674 464 HG3 ARG 57 HG3 ARG 57 3.362 -5.626 2.960 465 HD2 ARG 57 HD2 ARG 57 3.165 -7.485 1.717 466 HD3 ARG 57 HD3 ARG 57 1.844 -6.564 1.022 467 HE ARG 57 HE ARG 57 3.191 -6.145 -0.951 468 HH11 ARG 57 HH11 ARG 57 5.207 -8.018 1.231 469 HH12 ARG 57 HH12 ARG 57 5.893 -8.916 -0.133 470 HH21 ARG 57 HH21 ARG 57 4.294 -7.292 -2.557 471 HH22 ARG 57 HH22 ARG 57 5.485 -8.492 -2.044 472 H ALA 58 H ALA 58 0.149 -2.928 0.148 473 HA ALA 58 HA ALA 58 0.105 -0.150 1.133 474 HB1 ALA 58 HB1 ALA 58 -0.915 -0.951 -1.635 475 HB2 ALA 58 HB2 ALA 58 -1.115 0.641 -0.871 476 HB3 ALA 58 HB3 ALA 58 0.504 0.067 -1.308 477 H HIS 59 H HIS 59 -2.080 0.601 1.553 478 HA HIS 59 HA HIS 59 -4.048 -1.587 2.142 479 HB2 HIS 59 HB2 HIS 59 -3.050 0.556 4.058 480 HB3 HIS 59 HB3 HIS 59 -4.217 -0.713 4.424 481 HD2 HIS 59 HD2 HIS 59 -3.262 -3.291 4.541 482 HE1 HIS 59 HE1 HIS 59 0.847 -2.213 4.950 483 HE2 HIS 59 HE2 HIS 59 -0.833 -4.121 5.143 484 H GLN 60 H GLN 60 -3.881 1.080 0.370 485 HA GLN 60 HA GLN 60 -6.730 1.763 0.666 486 HB2 GLN 60 HB2 GLN 60 -5.500 3.302 2.212 487 HB3 GLN 60 HB3 GLN 60 -4.554 3.897 0.840 488 HG2 GLN 60 HG2 GLN 60 -6.651 4.678 -0.250 489 HG3 GLN 60 HG3 GLN 60 -7.596 4.074 1.114 490 HE21 GLN 60 HE21 GLN 60 -6.622 7.826 1.400 491 HE22 GLN 60 HE22 GLN 60 -7.090 6.918 -0.033 Start of MODEL 10 1 H5' G 16 H5' G 16 3.069 -2.570 -3.242 2 H5'' G 16 H5" G 16 2.474 -1.323 -2.130 3 H4' G 16 H4' G 16 2.039 -1.125 -5.057 4 H3' G 16 H3' G 16 4.394 -0.161 -3.436 5 H2' G 16 H2' G 16 4.571 1.672 -4.971 6 HO2' G 16 HO2' G 16 3.315 1.839 -6.852 7 H1' G 16 H1' G 16 1.918 2.274 -4.849 8 H8 G 16 H8 G 16 2.692 1.034 -1.421 9 H1 G 16 H1 G 16 5.142 6.887 -2.599 10 H21 G 16 H21 G 16 5.249 7.169 -4.797 11 H22 G 16 H22 G 16 4.524 5.982 -5.887 12 HO5' G 16 HO5' G 16 0.943 -3.073 -2.419 13 H5' G 17 H5' G 17 5.580 0.383 -7.501 14 H5'' G 17 H5" G 17 7.147 -0.414 -7.707 15 H4' G 17 H4' G 17 7.324 1.808 -8.585 16 H3' G 17 H3' G 17 8.716 1.519 -5.906 17 H2' G 17 H2' G 17 9.709 3.656 -6.388 18 HO2' G 17 HO2' G 17 9.786 3.240 -8.808 19 H1' G 17 H1' G 17 7.322 4.783 -7.008 20 H8 G 17 H8 G 17 6.582 2.158 -4.366 21 H1 G 17 H1 G 17 9.202 7.581 -2.062 22 H21 G 17 H21 G 17 10.086 8.718 -3.747 23 H22 G 17 H22 G 17 9.882 8.152 -5.408 24 H5' G 18 H5' G 18 11.711 2.770 -8.489 25 H5'' G 18 H5" G 18 13.256 1.999 -8.139 26 H4' G 18 H4' G 18 13.315 4.485 -8.112 27 H3' G 18 H3' G 18 14.030 3.063 -5.544 28 H2' G 18 H2' G 18 14.673 5.236 -4.699 29 HO2' G 18 HO2' G 18 15.471 5.901 -6.958 30 H1' G 18 H1' G 18 12.449 6.519 -5.605 31 H8 G 18 H8 G 18 11.297 3.072 -4.546 32 H1 G 18 H1 G 18 12.241 7.186 0.336 33 H21 G 18 H21 G 18 13.533 8.839 -0.384 34 H22 G 18 H22 G 18 13.937 8.971 -2.101 35 H5' C 19 H5' C 19 17.355 5.669 -6.266 36 H5'' C 19 H5" C 19 18.859 4.829 -5.878 37 H4' C 19 H4' C 19 18.628 6.894 -4.594 38 H3' C 19 H3' C 19 18.430 4.383 -2.919 39 H2' C 19 H2' C 19 18.588 5.878 -1.011 40 HO2' C 19 HO2' C 19 20.091 7.405 -2.185 41 H1' C 19 H1' C 19 16.733 7.619 -2.002 42 H41 C 19 H41 C 19 13.451 3.676 1.565 43 H42 C 19 H42 C 19 13.310 2.488 0.268 44 H5 C 19 H5 C 19 14.584 2.677 -1.788 45 H6 C 19 H6 C 19 15.967 4.182 -3.094 46 H5' A 20 H5' A 20 21.671 6.632 -1.089 47 H5'' A 20 H5" A 20 22.920 5.480 -0.601 48 H4' A 20 H4' A 20 22.197 6.868 1.272 49 H3' A 20 H3' A 20 21.406 3.957 1.527 50 H2' A 20 H2' A 20 20.804 4.511 3.805 51 HO2' A 20 HO2' A 20 22.617 6.131 4.032 52 H1' A 20 H1' A 20 19.400 6.725 3.076 53 H8 A 20 H8 A 20 18.939 4.172 0.277 54 H61 A 20 H61 A 20 14.598 1.792 4.108 55 H62 A 20 H62 A 20 15.211 1.729 2.452 56 H2 A 20 H2 A 20 16.940 4.615 6.387 57 H5' G 21 H5' G 21 23.607 4.601 5.227 58 H5'' G 21 H5" G 21 24.622 3.171 5.447 59 H4' G 21 H4' G 21 23.285 3.555 7.407 60 H3' G 21 H3' G 21 22.302 1.095 5.918 61 H2' G 21 H2' G 21 21.051 0.666 7.927 62 HO2' G 21 HO2' G 21 21.202 1.986 9.771 63 H1' G 21 H1' G 21 20.007 3.179 7.947 64 H8 G 21 H8 G 21 20.656 2.308 4.303 65 H1 G 21 H1 G 21 15.613 -0.767 6.893 66 H21 G 21 H21 G 21 15.719 -0.583 9.105 67 H22 G 21 H22 G 21 16.969 0.423 9.836 68 H5' A 22 H5' A 22 23.050 -0.059 9.781 69 H5'' A 22 H5" A 22 24.272 -1.309 9.828 70 H4' A 22 H4' A 22 22.537 -1.946 11.352 71 H3' A 22 H3' A 22 22.417 -3.585 8.812 72 H2' A 22 H2' A 22 20.534 -4.738 9.658 73 HO2' A 22 HO2' A 22 21.434 -4.869 11.885 74 H1' A 22 H1' A 22 19.260 -2.574 10.753 75 H8 A 22 H8 A 22 20.858 -1.636 7.390 76 H61 A 22 H61 A 22 15.645 -3.960 4.908 77 H62 A 22 H62 A 22 16.928 -2.787 4.662 78 H2 A 22 H2 A 22 15.675 -5.062 9.127 79 H5' U 23 H5' U 23 26.020 -6.443 8.325 80 H5'' U 23 H5" U 23 24.977 -6.271 6.914 81 H4' U 23 H4' U 23 24.114 -7.567 9.533 82 H3' U 23 H3' U 23 25.717 -8.729 7.450 83 H2' U 23 H2' U 23 24.009 -8.896 5.927 84 HO2' U 23 HO2' U 23 23.965 -11.164 7.533 85 H1' U 23 H1' U 23 22.095 -9.301 8.248 86 H3 U 23 H3 U 23 18.610 -9.926 5.494 87 H5 U 23 H5 U 23 21.048 -7.341 3.252 88 H6 U 23 H6 U 23 22.620 -7.282 5.124 89 H5' U 25 H5' U 25 24.472 -8.606 11.494 90 H5'' U 25 H5" U 25 26.163 -8.114 11.716 91 H4' U 25 H4' U 25 24.800 -10.058 13.605 92 H3' U 25 H3' U 25 24.347 -7.171 13.315 93 H2' U 25 H2' U 25 25.189 -6.430 15.372 94 HO2' U 25 HO2' U 25 23.941 -8.279 16.468 95 H1' U 25 H1' U 25 27.195 -8.221 15.809 96 H3 U 25 H3 U 25 30.755 -6.227 13.887 97 H5 U 25 H5 U 25 27.486 -4.104 12.373 98 H6 U 25 H6 U 25 25.996 -5.730 13.356 99 H5' G 26 H5' G 26 21.880 -9.514 12.289 100 H5'' G 26 H5" G 26 21.400 -8.498 10.938 101 H4' G 26 H4' G 26 19.604 -9.361 13.139 102 H3' G 26 H3' G 26 19.921 -10.224 10.273 103 H2' G 26 H2' G 26 17.594 -10.581 10.126 104 HO2' G 26 HO2' G 26 16.196 -10.596 11.900 105 H1' G 26 H1' G 26 16.851 -8.267 11.369 106 H8 G 26 H8 G 26 19.881 -7.282 9.476 107 H1 G 26 H1 G 26 14.786 -8.281 5.656 108 H21 G 26 H21 G 26 13.273 -9.465 6.824 109 H22 G 26 H22 G 26 13.583 -9.836 8.520 110 H5' A 27 H5' A 27 17.207 -13.170 11.869 111 H5'' A 27 H5" A 27 17.897 -14.762 11.522 112 H4' A 27 H4' A 27 15.651 -14.753 10.712 113 H3' A 27 H3' A 27 17.621 -14.469 8.422 114 H2' A 27 H2' A 27 15.749 -14.943 7.016 115 HO2' A 27 HO2' A 27 13.743 -15.589 7.787 116 H1' A 27 H1' A 27 14.130 -13.148 8.323 117 H8 A 27 H8 A 27 17.617 -11.624 8.268 118 H61 A 27 H61 A 27 16.404 -10.450 2.235 119 H62 A 27 H62 A 27 17.527 -10.098 3.502 120 H2 A 27 H2 A 27 13.237 -13.009 3.729 121 H5' G 28 H5' G 28 15.432 -17.833 7.602 122 H5'' G 28 H5" G 28 16.351 -19.129 6.832 123 H4' G 28 H4' G 28 14.356 -18.385 5.568 124 H3' G 28 H3' G 28 17.009 -18.024 4.111 125 H2' G 28 H2' G 28 15.673 -17.516 2.214 126 HO2' G 28 HO2' G 28 13.851 -19.071 3.051 127 H1' G 28 H1' G 28 14.124 -15.721 3.494 128 H8 G 28 H8 G 28 17.410 -15.393 5.252 129 H1 G 28 H1 G 28 17.551 -13.107 -0.752 130 H21 G 28 H21 G 28 15.879 -14.067 -1.904 131 H22 G 28 H22 G 28 14.767 -15.130 -1.039 132 H5' C 29 H5' C 29 14.664 -19.973 1.520 133 H5'' C 29 H5" C 29 15.441 -21.404 0.852 134 H4' C 29 H4' C 29 14.588 -19.904 -0.894 135 H3' C 29 H3' C 29 17.598 -20.175 -0.753 136 H2' C 29 H2' C 29 17.576 -19.109 -2.915 137 HO2' C 29 HO2' C 29 15.884 -19.753 -4.104 138 H1' C 29 H1' C 29 15.736 -17.222 -2.184 139 H41 C 29 H41 C 29 21.116 -14.171 -1.530 140 H42 C 29 H42 C 29 21.245 -14.622 0.158 141 H5 C 29 H5 C 29 19.776 -16.314 1.148 142 H6 C 29 H6 C 29 17.830 -17.723 0.751 143 H5' C 30 H5' C 30 16.036 -21.924 -4.404 144 H5'' C 30 H5" C 30 17.048 -23.217 -5.070 145 H4' C 30 H4' C 30 16.716 -21.297 -6.637 146 H3' C 30 H3' C 30 19.543 -21.831 -5.690 147 H2' C 30 H2' C 30 20.260 -20.136 -7.182 148 HO2' C 30 HO2' C 30 18.982 -19.254 -8.802 149 H1' C 30 H1' C 30 18.153 -18.409 -6.643 150 H41 C 30 H41 C 30 22.961 -16.130 -3.449 151 H42 C 30 H42 C 30 22.791 -17.284 -2.123 152 H5 C 30 H5 C 30 21.055 -19.009 -2.158 153 H6 C 30 H6 C 30 19.359 -20.048 -3.550 154 H5' U 31 H5' U 31 19.957 -21.559 -9.792 155 H5'' U 31 H5" U 31 21.029 -22.815 -10.422 156 H4' U 31 H4' U 31 21.909 -20.587 -10.942 157 H3' U 31 H3' U 31 23.483 -22.208 -8.941 158 H2' U 31 H2' U 31 25.123 -20.506 -8.901 159 HO2' U 31 HO2' U 31 25.278 -18.864 -10.386 160 H1' U 31 H1' U 31 23.330 -18.380 -9.037 161 H3 U 31 H3 U 31 24.735 -17.642 -4.814 162 H5 U 31 H5 U 31 23.154 -21.503 -4.573 163 H6 U 31 H6 U 31 22.618 -21.405 -6.943 164 H5' G 32 H5' G 32 27.595 -23.375 -9.727 165 H5'' G 32 H5" G 32 26.814 -21.925 -9.072 166 H4' G 32 H4' G 32 29.230 -21.632 -9.422 167 H3' G 32 H3' G 32 27.290 -19.889 -10.886 168 H2' G 32 H2' G 32 28.913 -18.910 -12.252 169 HO2' G 32 HO2' G 32 30.635 -18.492 -10.878 170 H1' G 32 H1' G 32 30.279 -21.108 -12.931 171 H8 G 32 H8 G 32 26.834 -19.603 -13.024 172 H1 G 32 H1 G 32 27.578 -24.577 -17.059 173 H21 G 32 H21 G 32 29.501 -25.637 -16.554 174 H22 G 32 H22 G 32 30.499 -25.046 -15.235 175 H5' G 33 H5' G 33 30.598 -17.458 -9.141 176 H5'' G 33 H5" G 33 29.900 -16.075 -8.297 177 H4' G 33 H4' G 33 31.680 -15.364 -9.849 178 H3' G 33 H3' G 33 28.907 -14.375 -10.160 179 H2' G 33 H2' G 33 28.940 -13.889 -12.381 180 HO2' G 33 HO2' G 33 31.120 -12.648 -11.720 181 H1' G 33 H1' G 33 31.169 -15.359 -13.289 182 H8 G 33 H8 G 33 27.711 -16.593 -11.831 183 H1 G 33 H1 G 33 28.706 -17.304 -18.162 184 H21 G 33 H21 G 33 30.783 -16.579 -18.656 185 H22 G 33 H22 G 33 31.810 -15.950 -17.377 186 H5' G 34 H5' G 34 29.124 -10.942 -10.370 187 H5'' G 34 H5" G 34 28.994 -10.011 -8.884 188 H4' G 34 H4' G 34 27.142 -10.019 -10.796 189 H3' G 34 H3' G 34 26.432 -9.662 -7.859 190 H2' G 34 H2' G 34 24.230 -9.710 -8.430 191 HO2' G 34 HO2' G 34 23.454 -9.765 -10.579 192 H1' G 34 H1' G 34 24.278 -11.934 -9.936 193 H8 G 34 H8 G 34 26.882 -11.481 -7.012 194 H1 G 34 H1 G 34 22.128 -15.695 -6.009 195 H21 G 34 H21 G 34 20.857 -15.795 -7.775 196 H22 G 34 H22 G 34 21.111 -14.731 -9.156 197 H5' A 35 H5' A 35 27.803 -4.308 -7.968 198 H5'' A 35 H5" A 35 26.867 -5.677 -7.359 199 H4' A 35 H4' A 35 25.520 -3.666 -7.918 200 H3' A 35 H3' A 35 24.967 -6.363 -8.983 201 H2' A 35 H2' A 35 23.587 -5.762 -10.741 202 HO2' A 35 HO2' A 35 23.209 -3.273 -9.372 203 H1' A 35 H1' A 35 24.727 -3.442 -11.558 204 H8 A 35 H8 A 35 25.358 -7.180 -11.267 205 H61 A 35 H61 A 35 29.199 -6.132 -16.105 206 H62 A 35 H62 A 35 28.404 -7.425 -15.202 207 H2 A 35 H2 A 35 28.163 -2.305 -14.447 208 H5' G 36 H5' G 36 23.142 -7.679 -9.249 209 H5'' G 36 H5" G 36 21.816 -6.513 -9.168 210 H4' G 36 H4' G 36 20.895 -8.417 -10.189 211 H3' G 36 H3' G 36 20.178 -8.306 -7.267 212 H2' G 36 H2' G 36 18.965 -10.307 -7.506 213 HO2' G 36 HO2' G 36 18.422 -11.251 -9.476 214 H1' G 36 H1' G 36 20.806 -11.676 -8.933 215 H8 G 36 H8 G 36 22.970 -9.654 -6.729 216 H1 G 36 H1 G 36 19.936 -14.447 -3.600 217 H21 G 36 H21 G 36 18.372 -15.274 -4.929 218 H22 G 36 H22 G 36 18.165 -14.635 -6.560 219 H5' C 37 H5' C 37 16.712 -9.243 -9.062 220 H5'' C 37 H5" C 37 15.293 -8.429 -8.447 221 H4' C 37 H4' C 37 15.087 -10.845 -8.327 222 H3' C 37 H3' C 37 15.259 -9.537 -5.621 223 H2' C 37 H2' C 37 14.428 -11.656 -4.804 224 HO2' C 37 HO2' C 37 13.809 -13.339 -6.157 225 H1' C 37 H1' C 37 16.277 -13.063 -6.226 226 H41 C 37 H41 C 37 19.123 -11.973 -0.648 227 H42 C 37 H42 C 37 20.027 -10.726 -1.472 228 H5 C 37 H5 C 37 19.596 -9.957 -3.663 229 H6 C 37 H6 C 37 18.104 -10.122 -5.574 230 H5' U 38 H5' U 38 11.691 -11.625 -5.738 231 H5'' U 38 H5" U 38 10.349 -10.621 -5.178 232 H4' U 38 H4' U 38 10.298 -12.706 -3.985 233 H3' U 38 H3' U 38 11.257 -10.398 -2.260 234 H2' U 38 H2' U 38 10.953 -11.857 -0.396 235 HO2' U 38 HO2' U 38 9.054 -13.023 -1.468 236 H1' U 38 H1' U 38 12.375 -13.865 -1.568 237 H3 U 38 H3 U 38 14.844 -11.589 1.585 238 H5 U 38 H5 U 38 15.588 -9.618 -2.031 239 H6 U 38 H6 U 38 13.794 -10.893 -3.044 240 H5' C 39 H5' C 39 8.386 -11.707 0.162 241 H5'' C 39 H5" C 39 7.220 -10.410 0.476 242 H4' C 39 H4' C 39 8.025 -11.281 2.574 243 H3' C 39 H3' C 39 9.285 -8.568 2.015 244 H2' C 39 H2' C 39 9.841 -8.639 4.332 245 HO2' C 39 HO2' C 39 9.060 -10.130 5.754 246 H1' C 39 H1' C 39 10.757 -11.234 4.136 247 H41 C 39 H41 C 39 15.756 -7.457 3.630 248 H42 C 39 H42 C 39 15.599 -7.409 1.878 249 H5 C 39 H5 C 39 13.651 -8.290 0.713 250 H6 C 39 H6 C 39 11.590 -9.582 0.991 251 H5' U 40 H5' U 40 7.002 -8.391 5.416 252 H5'' U 40 H5" U 40 6.225 -6.838 5.713 253 H4' U 40 H4' U 40 7.605 -7.577 7.612 254 H3' U 40 H3' U 40 8.607 -5.115 6.174 255 H2' U 40 H2' U 40 10.109 -4.866 8.039 256 HO2' U 40 HO2' U 40 9.938 -5.989 9.924 257 H1' U 40 H1' U 40 10.860 -7.503 8.021 258 H3 U 40 H3 U 40 14.398 -5.060 6.453 259 H5 U 40 H5 U 40 11.927 -5.602 3.117 260 H6 U 40 H6 U 40 10.201 -6.531 4.562 261 H5' C 41 H5' C 41 7.972 -4.240 10.200 262 H5'' C 41 H5" C 41 7.349 -2.618 10.510 263 H4' C 41 H4' C 41 9.445 -3.038 11.725 264 H3' C 41 H3' C 41 9.612 -0.976 9.521 265 H2' C 41 H2' C 41 11.798 -0.437 10.418 266 HO2' C 41 HO2' C 41 11.055 -0.907 12.716 267 H1' C 41 H1' C 41 12.565 -3.048 10.607 268 H41 C 41 H41 C 41 14.691 -1.381 4.978 269 H42 C 41 H42 C 41 13.234 -1.872 4.168 270 H5 C 41 H5 C 41 11.178 -2.387 5.469 271 H6 C 41 H6 C 41 10.321 -2.732 7.718 272 H5' U 42 H5' U 42 10.924 1.090 13.085 273 H5'' U 42 H5" U 42 10.092 2.650 13.153 274 H4' U 42 H4' U 42 12.481 3.016 13.326 275 H3' U 42 H3' U 42 11.335 3.837 10.648 276 H2' U 42 H2' U 42 13.455 4.869 10.211 277 HO2' U 42 HO2' U 42 15.081 5.062 11.761 278 H1' U 42 H1' U 42 14.883 2.681 11.049 279 H3 U 42 H3 U 42 15.159 2.749 6.481 280 H5 U 42 H5 U 42 11.486 0.931 7.269 281 H6 U 42 H6 U 42 11.721 1.550 9.610 282 H5' G 43 H5' G 43 13.302 7.211 11.896 283 H5'' G 43 H5" G 43 12.312 8.654 11.644 284 H4' G 43 H4' G 43 14.468 8.907 10.552 285 H3' G 43 H3' G 43 12.173 8.553 8.607 286 H2' G 43 H2' G 43 13.743 9.180 6.908 287 HO2' G 43 HO2' G 43 15.776 10.005 7.337 288 H1' G 43 H1' G 43 15.735 7.551 7.883 289 H8 G 43 H8 G 43 12.508 5.631 8.298 290 H1 G 43 H1 G 43 14.691 5.843 2.236 291 H21 G 43 H21 G 43 16.162 7.482 2.064 292 H22 G 43 H22 G 43 16.678 8.375 3.501 293 H5' C 44 H5' C 44 14.014 12.121 7.536 294 H5'' C 44 H5" C 44 12.856 13.377 7.092 295 H4' C 44 H4' C 44 14.469 12.969 5.304 296 H3' C 44 H3' C 44 11.646 12.104 4.618 297 H2' C 44 H2' C 44 12.481 11.843 2.365 298 HO2' C 44 HO2' C 44 14.013 13.732 2.573 299 H1' C 44 H1' C 44 14.715 10.492 3.151 300 H41 C 44 H41 C 44 10.689 5.893 1.996 301 H42 C 44 H42 C 44 9.941 5.992 3.589 302 H5 C 44 H5 C 44 10.566 7.752 5.173 303 H6 C 44 H6 C 44 12.003 9.690 5.495 304 H5' C 45 H5' C 45 12.740 14.933 1.570 305 H5'' C 45 H5" C 45 11.335 15.910 1.134 306 H4' C 45 H4' C 45 12.296 14.769 -0.806 307 H3' C 45 H3' C 45 9.540 13.769 -0.032 308 H2' C 45 H2' C 45 9.593 12.588 -2.140 309 HO2' C 45 HO2' C 45 10.904 14.420 -3.185 310 H1' C 45 H1' C 45 12.132 11.643 -1.761 311 H41 C 45 H41 C 45 8.385 7.124 0.366 312 H42 C 45 H42 C 45 8.281 7.841 1.974 313 H5 C 45 H5 C 45 9.184 10.054 2.449 314 H6 C 45 H6 C 45 10.448 11.905 1.502 315 H5' C 46 H5' C 46 9.127 14.773 -4.091 316 H5'' C 46 H5" C 46 7.591 15.603 -4.353 317 H4' C 46 H4' C 46 7.776 13.630 -5.777 318 H3' C 46 H3' C 46 5.689 13.406 -3.589 319 HO3' C 46 HO3' C 46 4.311 14.046 -5.307 320 H2' C 46 H2' C 46 4.982 11.388 -4.648 321 HO2' C 46 HO2' C 46 5.303 12.301 -6.881 322 H1' C 46 H1' C 46 7.553 10.482 -5.171 323 H41 C 46 H41 C 46 5.258 7.579 -0.101 324 H42 C 46 H42 C 46 5.567 8.956 0.963 325 H5 C 46 H5 C 46 6.528 11.035 0.115 326 H6 C 46 H6 C 46 7.275 12.183 -1.903 327 H1 GLY 44 H1 GLY 44 32.362 -9.452 -10.187 328 H2 GLY 44 H2 GLY 44 32.362 -10.168 -8.714 329 H3 GLY 44 H3 GLY 44 33.503 -9.037 -9.078 330 HA2 GLY 44 HA2 GLY 44 31.741 -7.349 -9.293 331 HA3 GLY 44 HA3 GLY 44 30.615 -8.599 -8.727 332 H ILE 45 H ILE 45 30.029 -7.563 -6.854 333 HA ILE 45 HA ILE 45 32.099 -7.263 -4.709 334 HB ILE 45 HB ILE 45 30.987 -5.199 -3.978 335 HG12 ILE 45 HG12 ILE 45 29.437 -5.289 -6.598 336 HG13 ILE 45 HG13 ILE 45 28.739 -5.678 -5.024 337 HG21 ILE 45 HG21 ILE 45 31.912 -4.961 -6.866 338 HG22 ILE 45 HG22 ILE 45 32.006 -3.734 -5.587 339 HG23 ILE 45 HG23 ILE 45 32.995 -5.191 -5.475 340 HD11 ILE 45 HD11 ILE 45 29.836 -2.973 -5.886 341 HD12 ILE 45 HD12 ILE 45 28.149 -3.413 -5.586 342 HD13 ILE 45 HD13 ILE 45 29.297 -3.367 -4.234 343 H SER 46 H SER 46 29.462 -9.033 -5.455 344 HA SER 46 HA SER 46 28.934 -9.574 -2.595 345 HB2 SER 46 HB2 SER 46 27.151 -7.986 -3.364 346 HB3 SER 46 HB3 SER 46 26.665 -9.185 -4.580 347 HG SER 46 HG SER 46 25.445 -9.359 -2.668 348 H TYR 47 H TYR 47 27.848 -11.569 -2.243 349 HA TYR 47 HA TYR 47 27.906 -13.638 -4.364 350 HB2 TYR 47 HB2 TYR 47 30.168 -13.468 -3.259 351 HB3 TYR 47 HB3 TYR 47 29.410 -13.870 -1.727 352 HD1 TYR 47 HD1 TYR 47 29.598 -15.189 -5.268 353 HD2 TYR 47 HD2 TYR 47 29.608 -16.116 -1.050 354 HE1 TYR 47 HE1 TYR 47 29.979 -17.587 -5.796 355 HE2 TYR 47 HE2 TYR 47 30.000 -18.519 -1.585 356 HH TYR 47 HH TYR 47 30.278 -19.700 -4.959 357 H GLY 48 H GLY 48 25.976 -12.180 -2.269 358 HA2 GLY 48 HA2 GLY 48 24.045 -14.184 -1.973 359 HA3 GLY 48 HA3 GLY 48 25.037 -14.302 -0.524 360 H ARG 49 H ARG 49 24.659 -11.054 -1.684 361 HA ARG 49 HA ARG 49 22.169 -10.456 -0.243 362 HB2 ARG 49 HB2 ARG 49 24.879 -9.298 0.583 363 HB3 ARG 49 HB3 ARG 49 23.357 -8.525 0.986 364 HG2 ARG 49 HG2 ARG 49 24.287 -11.234 1.982 365 HG3 ARG 49 HG3 ARG 49 24.155 -9.721 2.885 366 HD2 ARG 49 HD2 ARG 49 21.665 -9.734 2.402 367 HD3 ARG 49 HD3 ARG 49 21.856 -11.362 1.747 368 HE ARG 49 HE ARG 49 22.943 -10.952 4.452 369 HH11 ARG 49 HH11 ARG 49 20.090 -12.247 2.644 370 HH12 ARG 49 HH12 ARG 49 19.524 -13.023 3.961 371 HH21 ARG 49 HH21 ARG 49 22.127 -11.915 6.114 372 HH22 ARG 49 HH22 ARG 49 20.645 -12.814 6.037 373 H LYS 50 H LYS 50 21.620 -8.074 -0.491 374 HA LYS 50 HA LYS 50 22.851 -6.753 -2.835 375 HB2 LYS 50 HB2 LYS 50 20.866 -6.551 -4.098 376 HB3 LYS 50 HB3 LYS 50 21.099 -8.248 -3.780 377 HG2 LYS 50 HG2 LYS 50 19.237 -8.318 -2.244 378 HG3 LYS 50 HG3 LYS 50 19.215 -6.574 -2.041 379 HD2 LYS 50 HD2 LYS 50 18.537 -6.178 -4.295 380 HD3 LYS 50 HD3 LYS 50 18.705 -7.882 -4.732 381 HE2 LYS 50 HE2 LYS 50 16.809 -8.471 -3.339 382 HE3 LYS 50 HE3 LYS 50 16.703 -6.820 -2.696 383 HZ1 LYS 50 HZ1 LYS 50 16.136 -6.022 -4.883 384 HZ2 LYS 50 HZ2 LYS 50 16.408 -7.463 -5.585 385 HZ3 LYS 50 HZ3 LYS 50 15.118 -7.278 -4.588 386 H LYS 51 H LYS 51 21.665 -4.740 -3.368 387 HA LYS 51 HA LYS 51 21.630 -2.681 -1.514 388 HB2 LYS 51 HB2 LYS 51 20.283 -1.478 -3.180 389 HB3 LYS 51 HB3 LYS 51 21.539 -2.441 -3.957 390 HG2 LYS 51 HG2 LYS 51 19.704 -4.252 -4.315 391 HG3 LYS 51 HG3 LYS 51 18.555 -3.018 -3.814 392 HD2 LYS 51 HD2 LYS 51 18.515 -3.029 -6.159 393 HD3 LYS 51 HD3 LYS 51 19.381 -1.570 -5.696 394 HE2 LYS 51 HE2 LYS 51 20.431 -2.597 -7.612 395 HE3 LYS 51 HE3 LYS 51 21.545 -2.670 -6.247 396 HZ1 LYS 51 HZ1 LYS 51 21.279 -4.970 -6.103 397 HZ2 LYS 51 HZ2 LYS 51 19.804 -5.006 -6.858 398 HZ3 LYS 51 HZ3 LYS 51 21.197 -4.745 -7.696 399 H ARG 52 H ARG 52 20.305 -1.897 0.048 400 HA ARG 52 HA ARG 52 18.069 -3.484 1.064 401 HB2 ARG 52 HB2 ARG 52 18.906 -0.644 1.803 402 HB3 ARG 52 HB3 ARG 52 17.853 -1.703 2.729 403 HG2 ARG 52 HG2 ARG 52 20.844 -2.066 2.282 404 HG3 ARG 52 HG3 ARG 52 20.025 -1.577 3.761 405 HD2 ARG 52 HD2 ARG 52 18.835 -3.833 3.713 406 HD3 ARG 52 HD3 ARG 52 19.968 -4.315 2.437 407 HE ARG 52 HE ARG 52 21.736 -3.495 4.252 408 HH11 ARG 52 HH11 ARG 52 18.872 -5.456 4.967 409 HH12 ARG 52 HH12 ARG 52 19.481 -5.951 6.477 410 HH21 ARG 52 HH21 ARG 52 22.478 -4.214 6.261 411 HH22 ARG 52 HH22 ARG 52 21.378 -5.089 7.261 412 H ARG 53 H ARG 53 15.864 -2.664 1.385 413 HA ARG 53 HA ARG 53 14.918 -0.484 -0.338 414 HB2 ARG 53 HB2 ARG 53 13.347 -1.755 -1.639 415 HB3 ARG 53 HB3 ARG 53 14.961 -2.362 -1.897 416 HG2 ARG 53 HG2 ARG 53 13.537 -4.218 -1.899 417 HG3 ARG 53 HG3 ARG 53 14.431 -4.324 -0.383 418 HD2 ARG 53 HD2 ARG 53 12.529 -3.725 0.900 419 HD3 ARG 53 HD3 ARG 53 11.678 -3.043 -0.505 420 HE ARG 53 HE ARG 53 11.940 -5.727 -1.135 421 HH11 ARG 53 HH11 ARG 53 10.479 -4.019 1.586 422 HH12 ARG 53 HH12 ARG 53 9.231 -5.258 1.735 423 HH21 ARG 53 HH21 ARG 53 10.132 -7.201 -0.826 424 HH22 ARG 53 HH22 ARG 53 9.128 -6.863 0.582 425 H GLN 54 H GLN 54 12.566 -0.078 -0.112 426 HA GLN 54 HA GLN 54 11.342 -1.110 2.387 427 HB2 GLN 54 HB2 GLN 54 12.436 1.223 2.739 428 HB3 GLN 54 HB3 GLN 54 11.175 1.836 1.665 429 HG2 GLN 54 HG2 GLN 54 9.504 0.665 3.321 430 HG3 GLN 54 HG3 GLN 54 10.886 0.537 4.405 431 HE21 GLN 54 HE21 GLN 54 11.004 4.148 4.877 432 HE22 GLN 54 HE22 GLN 54 11.928 2.731 5.055 433 H ARG 55 H ARG 55 9.099 -1.239 2.289 434 HA ARG 55 HA ARG 55 7.589 -0.243 -0.043 435 HB2 ARG 55 HB2 ARG 55 8.287 -2.500 -0.728 436 HB3 ARG 55 HB3 ARG 55 7.681 -3.184 0.784 437 HG2 ARG 55 HG2 ARG 55 5.376 -2.700 0.165 438 HG3 ARG 55 HG3 ARG 55 5.899 -1.725 -1.213 439 HD2 ARG 55 HD2 ARG 55 5.126 -3.873 -2.006 440 HD3 ARG 55 HD3 ARG 55 6.873 -3.748 -2.271 441 HE ARG 55 HE ARG 55 6.374 -5.004 0.263 442 HH11 ARG 55 HH11 ARG 55 6.212 -5.863 -3.172 443 HH12 ARG 55 HH12 ARG 55 6.507 -7.550 -2.770 444 HH21 ARG 55 HH21 ARG 55 6.816 -7.111 0.538 445 HH22 ARG 55 HH22 ARG 55 6.745 -8.213 -0.841 446 H ARG 56 H ARG 56 5.409 0.051 0.443 447 HA ARG 56 HA ARG 56 4.454 -0.412 3.237 448 HB2 ARG 56 HB2 ARG 56 4.303 2.230 1.710 449 HB3 ARG 56 HB3 ARG 56 3.533 1.915 3.259 450 HG2 ARG 56 HG2 ARG 56 6.544 1.941 2.769 451 HG3 ARG 56 HG3 ARG 56 5.595 3.245 3.473 452 HD2 ARG 56 HD2 ARG 56 4.969 1.831 5.377 453 HD3 ARG 56 HD3 ARG 56 5.866 0.465 4.693 454 HE ARG 56 HE ARG 56 7.689 2.604 4.868 455 HH11 ARG 56 HH11 ARG 56 5.941 0.515 7.134 456 HH12 ARG 56 HH12 ARG 56 7.150 0.823 8.386 457 HH21 ARG 56 HH21 ARG 56 9.144 2.838 6.628 458 HH22 ARG 56 HH22 ARG 56 8.742 1.992 8.130 459 H ARG 57 H ARG 57 2.081 0.136 3.378 460 HA ARG 57 HA ARG 57 0.618 -1.095 1.057 461 HB2 ARG 57 HB2 ARG 57 0.213 -1.698 4.017 462 HB3 ARG 57 HB3 ARG 57 -0.604 -2.474 2.669 463 HG2 ARG 57 HG2 ARG 57 2.362 -2.737 3.352 464 HG3 ARG 57 HG3 ARG 57 1.097 -3.912 3.694 465 HD2 ARG 57 HD2 ARG 57 0.674 -4.187 1.275 466 HD3 ARG 57 HD3 ARG 57 1.989 -3.053 0.912 467 HE ARG 57 HE ARG 57 3.231 -4.917 2.508 468 HH11 ARG 57 HH11 ARG 57 1.342 -5.307 -0.417 469 HH12 ARG 57 HH12 ARG 57 2.169 -6.774 -0.859 470 HH21 ARG 57 HH21 ARG 57 4.268 -6.787 1.878 471 HH22 ARG 57 HH22 ARG 57 3.750 -7.589 0.419 472 H ALA 58 H ALA 58 -1.720 -0.792 1.122 473 HA ALA 58 HA ALA 58 -2.752 1.567 2.577 474 HB1 ALA 58 HB1 ALA 58 -2.549 1.443 -0.470 475 HB2 ALA 58 HB2 ALA 58 -3.343 2.724 0.472 476 HB3 ALA 58 HB3 ALA 58 -1.591 2.501 0.591 477 H HIS 59 H HIS 59 -5.053 1.997 2.024 478 HA HIS 59 HA HIS 59 -6.684 -0.190 0.926 479 HB2 HIS 59 HB2 HIS 59 -6.272 -0.857 3.297 480 HB3 HIS 59 HB3 HIS 59 -6.925 0.691 3.836 481 HD2 HIS 59 HD2 HIS 59 -9.243 0.199 4.870 482 HE1 HIS 59 HE1 HIS 59 -10.841 -2.426 1.910 483 HE2 HIS 59 HE2 HIS 59 -11.343 -1.183 4.075 484 H GLN 60 H GLN 60 -8.982 0.430 0.813 485 HA GLN 60 HA GLN 60 -9.709 3.261 1.080 486 HB2 GLN 60 HB2 GLN 60 -8.524 3.122 -1.102 487 HB3 GLN 60 HB3 GLN 60 -9.683 1.925 -1.671 488 HG2 GLN 60 HG2 GLN 60 -10.568 4.673 -0.685 489 HG3 GLN 60 HG3 GLN 60 -9.945 4.451 -2.310 490 HE21 GLN 60 HE21 GLN 60 -13.808 3.542 -1.688 491 HE22 GLN 60 HE22 GLN 60 -12.827 4.312 -0.447
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