NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
22543 | 2jp9 | 15532 | cing | 1-original | 13 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H5 DC 124 5H C 124 -3.983 -31.306 -5.024 2 H6 DC 124 6H C 124 -5.879 -31.003 -6.528 3 H5' DC 124 H5' C 124 -8.748 -32.444 -9.780 4 H5'' DC 124 H5" C 124 -7.439 -32.472 -8.587 5 H4' DC 124 H4' C 124 -10.390 -32.461 -7.802 6 H3' DC 124 H3' C 124 -9.172 -30.299 -9.038 7 H2' DC 124 H2' C 124 -7.343 -30.132 -7.567 8 H2'' DC 124 H2" C 124 -8.461 -28.990 -6.768 9 H1' DC 124 H1' C 124 -9.381 -30.667 -5.322 10 H41 DC 124 1H4 C 124 -4.528 -32.289 -1.532 11 H42 DC 124 2H4 C 124 -3.368 -31.968 -2.807 12 H8 DG 125 8H G 125 -9.133 -26.935 -5.702 13 H1 DG 125 1H G 125 -6.448 -29.070 -0.241 14 H5' DG 125 H5' G 125 -12.803 -29.719 -6.317 15 H5'' DG 125 H5" G 125 -13.922 -28.443 -6.844 16 H4' DG 125 H4' G 125 -13.826 -28.550 -4.418 17 H3' DG 125 H3' G 125 -13.404 -26.125 -5.740 18 H2' DG 125 H2' G 125 -11.120 -26.044 -5.355 19 H2'' DG 125 H2" G 125 -11.618 -25.291 -3.816 20 H1' DG 125 H1' G 125 -11.519 -27.340 -2.643 21 H21 DG 125 1H2 G 125 -7.943 -29.284 1.298 22 H22 DG 125 2H2 G 125 -9.644 -28.984 0.981 23 H5 DC 126 5H C 126 -8.065 -23.847 -4.318 24 H6 DC 126 6H C 126 -10.051 -23.532 -2.917 25 H5' DC 126 H5' C 126 -13.638 -26.170 -1.093 26 H5'' DC 126 H5" C 126 -14.641 -24.839 -0.472 27 H4' DC 126 H4' C 126 -12.750 -25.151 0.991 28 H3' DC 126 H3' C 126 -13.321 -22.661 -0.148 29 H2' DC 126 H2' C 126 -11.483 -22.850 -1.648 30 H2'' DC 126 H2" C 126 -10.708 -21.955 -0.311 31 H1' DC 126 H1' C 126 -10.018 -24.083 0.779 32 H41 DC 126 1H4 C 126 -5.080 -25.529 -3.007 33 H42 DC 126 2H4 C 126 -5.952 -25.017 -4.433 34 H8 DG 127 8H G 127 -9.672 -21.734 1.605 35 H1 DG 127 1H G 127 -3.423 -22.869 0.648 36 H5' DG 127 H5' G 127 -12.117 -23.625 4.004 37 H5'' DG 127 H5" G 127 -12.571 -22.525 5.311 38 H4' DG 127 H4' G 127 -10.461 -23.693 5.869 39 H3' DG 127 H3' G 127 -10.711 -20.828 5.737 40 H2' DG 127 H2' G 127 -9.158 -20.478 4.072 41 H2'' DG 127 H2" G 127 -7.930 -20.791 5.336 42 H1' DG 127 H1' G 127 -7.657 -23.017 4.687 43 H21 DG 127 1H2 G 127 -2.467 -23.419 2.491 44 H22 DG 127 2H2 G 127 -3.337 -23.460 4.013 45 H8 DG 128 8H G 128 -7.460 -18.616 4.228 46 H1 DG 128 1H G 128 -2.689 -19.744 0.084 47 H5' DG 128 H5' G 128 -6.703 -21.939 7.525 48 H5'' DG 128 H5" G 128 -6.507 -21.187 9.123 49 H4' DG 128 H4' G 128 -4.507 -20.675 8.002 50 H3' DG 128 H3' G 128 -6.209 -18.471 8.589 51 H2' DG 128 H2' G 128 -6.777 -18.098 6.294 52 H2'' DG 128 H2" G 128 -5.277 -17.104 6.417 53 H1' DG 128 H1' G 128 -3.895 -18.987 5.719 54 H21 DG 128 1H2 G 128 -0.815 -20.028 1.147 55 H22 DG 128 2H2 G 128 -0.752 -20.083 2.898 56 H8 DG 129 8H G 129 -3.459 -16.194 5.592 57 H1 DG 129 1H G 129 -1.063 -16.500 -0.362 58 H5' DG 129 H5' G 129 -1.561 -18.336 8.766 59 H5'' DG 129 H5" G 129 -0.973 -17.141 9.909 60 H4' DG 129 H4' G 129 0.623 -17.317 8.131 61 H3' DG 129 H3' G 129 -0.754 -14.849 8.715 62 H2' DG 129 H2' G 129 -1.879 -14.846 6.734 63 H2'' DG 129 H2" G 129 -0.408 -14.095 6.104 64 H1' DG 129 H1' G 129 0.450 -16.232 5.323 65 H21 DG 129 1H2 G 129 1.092 -16.421 -0.305 66 H22 DG 129 2H2 G 129 1.976 -16.358 1.210 67 H8 DG 130 8H G 130 0.668 -13.618 4.226 68 H1 DG 130 1H G 130 -0.694 -12.890 -1.986 69 H5' DG 130 H5' G 130 2.901 -15.448 5.612 70 H5'' DG 130 H5" G 130 3.975 -14.565 6.696 71 H4' DG 130 H4' G 130 5.087 -14.456 4.668 72 H3' DG 130 H3' G 130 4.244 -12.100 5.818 73 H2' DG 130 H2' G 130 2.373 -11.787 4.506 74 H2'' DG 130 H2" G 130 3.521 -10.938 3.484 75 H1' DG 130 H1' G 130 3.703 -12.722 1.949 76 H21 DG 130 1H2 G 130 1.098 -12.412 -3.130 77 H22 DG 130 2H2 G 130 2.650 -12.160 -2.346 78 H8 DG 131 8H G 131 2.570 -9.465 2.438 79 H1 DG 131 1H G 131 -1.905 -9.359 -2.154 80 H5' DG 131 H5' G 131 5.832 -11.793 1.663 81 H5'' DG 131 H5" G 131 7.346 -10.874 1.800 82 H4' DG 131 H4' G 131 6.590 -10.362 -0.367 83 H3' DG 131 H3' G 131 6.616 -8.198 1.455 84 H2' DG 131 H2' G 131 4.300 -8.052 1.719 85 H2'' DG 131 H2" G 131 4.430 -7.010 0.286 86 H1' DG 131 H1' G 131 3.896 -8.848 -1.209 87 H21 DG 131 1H2 G 131 -1.027 -8.886 -4.079 88 H22 DG 131 2H2 G 131 0.694 -8.580 -4.263 89 H5 DC 132 5H C 132 1.355 -6.557 1.566 90 H6 DC 132 6H C 132 2.845 -5.776 -0.224 91 H5' DC 132 H5' C 132 5.237 -7.670 -2.866 92 H5'' DC 132 H5" C 132 6.284 -6.412 -3.533 93 H4' DC 132 H4' C 132 4.228 -6.154 -4.661 94 H3' DC 132 H3' C 132 5.235 -4.124 -2.895 95 H2' DC 132 H2' C 132 3.444 -4.047 -1.471 96 H2'' DC 132 H2" C 132 2.670 -3.116 -2.769 97 H1' DC 132 H1' C 132 1.600 -5.002 -3.681 98 H41 DC 132 1H4 C 132 -2.288 -6.540 1.105 99 H42 DC 132 2H4 C 132 -0.961 -6.771 2.222 100 H8 DG 133 8H G 133 1.212 -1.800 -3.172 101 H1 DG 133 1H G 133 -4.897 -2.840 -1.508 102 H5' DG 133 H5' G 133 2.630 -3.315 -6.777 103 H5'' DG 133 H5" G 133 3.290 -1.847 -7.521 104 H4' DG 133 H4' G 133 0.950 -2.024 -8.094 105 H3' DG 133 H3' G 133 2.066 0.242 -6.865 106 H2' DG 133 H2' G 133 1.150 -0.136 -4.753 107 H2'' DG 133 H2" G 133 -0.202 0.790 -5.387 108 H1' DG 133 H1' G 133 -1.427 -1.228 -5.979 109 H21 DG 133 1H2 G 133 -6.219 -2.397 -3.174 110 H22 DG 133 2H2 G 133 -5.609 -1.860 -4.723 111 H5' DT 134 H5' T 134 -2.478 -0.093 -7.373 112 H5'' DT 134 H5" T 134 -2.907 1.178 -8.529 113 H4' DT 134 H4' T 134 -4.769 1.096 -7.095 114 H3' DT 134 H3' T 134 -3.089 3.366 -7.232 115 H2' DT 134 H2' T 134 -2.213 3.105 -5.087 116 H2'' DT 134 H2" T 134 -3.637 4.097 -4.722 117 H1' DT 134 H1' T 134 -5.031 2.094 -4.262 118 H3 DT 134 3H T 134 -4.170 0.347 -0.152 119 H71 DT 134 1H7 T 134 0.522 0.258 -1.805 120 H72 DT 134 2H7 T 134 0.534 1.975 -2.254 121 H73 DT 134 3H7 T 134 0.348 1.501 -0.550 122 H6 DT 134 6H T 134 -1.344 1.822 -3.759 123 H5 DC 135 5H C 135 -3.680 4.915 -2.765 124 H6 DC 135 6H C 135 -5.540 5.325 -4.291 125 H5' DC 135 H5' C 135 -7.535 3.520 -7.399 126 H5'' DC 135 H5" C 135 -8.353 4.881 -8.202 127 H4' DC 135 H4' C 135 -9.656 4.239 -6.244 128 H3' DC 135 H3' C 135 -8.662 6.888 -6.488 129 H2' DC 135 H2' C 135 -7.076 6.522 -4.907 130 H2'' DC 135 H2" C 135 -8.308 7.132 -3.844 131 H1' DC 135 H1' C 135 -9.110 4.859 -3.305 132 H41 DC 135 1H4 C 135 -4.178 3.392 0.514 133 H42 DC 135 2H4 C 135 -3.050 4.035 -0.650 134 H5' DT 136 H5' T 136 -11.038 5.365 -2.534 135 H5'' DT 136 H5" T 136 -12.448 6.312 -2.997 136 H4' DT 136 H4' T 136 -12.621 6.177 -0.702 137 H3' DT 136 H3' T 136 -12.208 8.667 -1.870 138 H2' DT 136 H2' T 136 -10.062 9.037 -1.392 139 H2'' DT 136 H2" T 136 -10.654 9.581 0.150 140 H1' DT 136 H1' T 136 -10.162 7.551 1.303 141 H3 DT 136 3H T 136 -5.806 6.493 1.753 142 H71 DT 136 1H7 T 136 -5.423 9.509 -2.073 143 H72 DT 136 2H7 T 136 -4.918 7.890 -2.625 144 H73 DT 136 3H7 T 136 -6.466 8.574 -3.170 145 H6 DT 136 6H T 136 -8.405 8.137 -1.908 146 H8 DG 137 8H G 137 -9.629 10.353 1.689 147 H1 DG 137 1H G 137 -3.754 9.361 4.052 148 H5' DG 137 H5' G 137 -12.094 7.508 2.377 149 H5'' DG 137 H5" G 137 -13.608 8.172 2.984 150 H4' DG 137 H4' G 137 -12.397 7.917 4.948 151 H3' DG 137 H3' G 137 -12.972 10.531 4.184 152 H2' DG 137 H2' G 137 -10.914 11.040 3.306 153 H2'' DG 137 H2" G 137 -10.575 11.557 4.946 154 H1' DG 137 H1' G 137 -9.414 9.524 5.490 155 H21 DG 137 1H2 G 137 -3.845 8.815 6.138 156 H22 DG 137 2H2 G 137 -5.374 8.722 6.997 157 H5 DC 138 5H C 138 -8.589 13.062 4.052 158 H6 DC 138 6H C 138 -9.149 12.340 6.310 159 H5' DC 138 H5' C 138 -10.331 9.367 7.569 160 H5'' DC 138 H5" C 138 -11.292 9.896 8.946 161 H4' DC 138 H4' C 138 -9.149 9.574 9.813 162 H3' DC 138 H3' C 138 -10.344 12.091 9.929 163 H2' DC 138 H2' C 138 -9.147 13.109 8.281 164 H2'' DC 138 H2" C 138 -7.987 13.413 9.541 165 H1' DC 138 H1' C 138 -6.565 11.637 8.908 166 H41 DC 138 1H4 C 138 -5.110 13.218 2.952 167 H42 DC 138 2H4 C 138 -6.801 13.291 2.502 168 H8 DG 139 8H G 139 -6.448 14.664 9.661 169 H1 DG 139 1H G 139 -2.165 15.857 5.046 170 H5' DG 139 H5' G 139 -6.118 11.088 11.197 171 H5'' DG 139 H5" G 139 -6.210 11.356 12.944 172 H4' DG 139 H4' G 139 -3.931 11.547 12.449 173 H3' DG 139 H3' G 139 -5.224 13.743 13.556 174 H2' DG 139 H2' G 139 -5.471 14.949 11.588 175 H2'' DG 139 H2" G 139 -3.903 15.591 12.043 176 H1' DG 139 H1' G 139 -2.716 14.132 10.603 177 H21 DG 139 1H2 G 139 -0.169 15.396 5.714 178 H22 DG 139 2H2 G 139 0.150 14.884 7.366 179 H5 DC 140 5H C 140 -4.251 17.643 10.478 180 H6 DC 140 6H C 140 -2.226 16.853 11.624 181 H5' DC 140 H5' C 140 -0.794 13.445 12.086 182 H5'' DC 140 H5" C 140 0.096 13.747 13.581 183 H4' DC 140 H4' C 140 1.565 14.177 11.707 184 H3' DC 140 H3' C 140 1.213 16.034 13.730 185 H2' DC 140 H2' C 140 -0.322 17.424 12.640 186 H2'' DC 140 H2" C 140 1.179 18.215 12.078 187 H1' DC 140 H1' C 140 1.207 17.030 10.045 188 H41 DC 140 1H4 C 140 -4.091 18.951 7.077 189 H42 DC 140 2H4 C 140 -5.100 18.495 8.430 190 H8 DG 141 8H G 141 -3.478 21.469 0.816 191 H1 DG 141 1H G 141 -1.624 18.719 6.318 192 H5' DG 141 H5' G 141 -0.765 24.626 -0.800 193 H5'' DG 141 H5" G 141 -1.097 23.827 -2.355 194 H4' DG 141 H4' G 141 0.823 22.891 -0.974 195 H3' DG 141 H3' G 141 -0.972 21.394 -2.546 196 H2' DG 141 H2' G 141 -2.160 20.512 -0.789 197 H2'' DG 141 H2" G 141 -0.892 19.291 -0.746 198 H1' DG 141 H1' G 141 0.272 20.413 1.043 199 H21 DG 141 1H2 G 141 0.500 18.253 6.276 200 H22 DG 141 2H2 G 141 1.469 18.512 4.833 201 H5 DC 142 5H C 142 -2.650 17.614 0.388 202 H6 DC 142 6H C 142 -0.288 17.204 -0.045 203 H5' DC 142 H5' C 142 2.003 19.639 0.388 204 H5'' DC 142 H5" C 142 3.227 19.298 -0.814 205 H4' DC 142 H4' C 142 3.968 18.075 0.932 206 H3' DC 142 H3' C 142 3.120 16.639 -1.276 207 H2' DC 142 H2' C 142 1.142 15.926 -0.480 208 H2'' DC 142 H2" C 142 2.011 14.627 0.192 209 H1' DC 142 H1' C 142 1.964 15.513 2.401 210 H41 DC 142 1H4 C 142 -4.145 16.806 3.622 211 H42 DC 142 2H4 C 142 -4.349 17.571 2.060 212 H8 DG 143 8H G 143 1.526 13.048 1.300 213 H1 DG 143 1H G 143 -3.741 12.517 4.907 214 H5' DG 143 H5' G 143 4.258 15.360 3.172 215 H5'' DG 143 H5" G 143 5.718 14.430 2.778 216 H4' DG 143 H4' G 143 4.925 13.561 4.827 217 H3' DG 143 H3' G 143 5.259 11.898 2.643 218 H2' DG 143 H2' G 143 3.063 11.775 2.017 219 H2'' DG 143 H2" G 143 3.003 10.420 3.100 220 H1' DG 143 H1' G 143 2.059 11.662 4.878 221 H21 DG 143 1H2 G 143 -3.263 11.693 6.853 222 H22 DG 143 2H2 G 143 -1.629 11.186 7.254 223 H5 DC 144 5H C 144 0.798 9.477 1.936 224 H6 DC 144 6H C 144 1.771 8.759 4.059 225 H5' DC 144 H5' C 144 3.093 10.976 6.452 226 H5'' DC 144 H5" C 144 4.326 9.935 7.153 227 H4' DC 144 H4' C 144 2.401 9.482 8.394 228 H3' DC 144 H3' C 144 3.638 7.425 6.908 229 H2' DC 144 H2' C 144 2.047 7.100 5.320 230 H2'' DC 144 H2" C 144 1.187 6.192 6.527 231 H1' DC 144 H1' C 144 -0.303 7.916 7.039 232 H41 DC 144 1H4 C 144 -2.825 9.888 1.618 233 H42 DC 144 2H4 C 144 -1.244 10.188 0.910 234 H8 DA 145 8H A 145 -0.275 4.970 5.981 235 H2 DA 145 2H A 145 -6.319 6.307 4.388 236 H5' DA 145 H5' A 145 0.028 7.249 9.578 237 H5'' DA 145 H5" A 145 0.212 5.935 10.754 238 H4' DA 145 H4' A 145 -2.134 6.296 10.372 239 H3' DA 145 H3' A 145 -0.969 3.753 10.046 240 H2' DA 145 H2' A 145 -1.053 3.768 7.720 241 H2'' DA 145 H2" A 145 -2.685 3.138 7.976 242 H1' DA 145 H1' A 145 -3.683 5.282 7.815 243 H61 DA 145 2H6 A 145 -1.961 5.836 1.558 244 H62 DA 145 1H6 A 145 -3.506 6.399 0.954 245 H8 DG 146 8H G 146 -3.896 1.612 7.147 246 H1 DG 146 1H G 146 -5.809 3.387 1.298 247 H5' DG 146 H5' G 146 -5.216 4.590 9.737 248 H5'' DG 146 H5" G 146 -6.428 4.541 10.992 249 H4' DG 146 H4' G 146 -7.849 3.910 9.437 250 H3' DG 146 H3' G 146 -6.780 1.409 10.317 251 H2' DG 146 H2' G 146 -5.653 0.928 8.361 252 H2'' DG 146 H2" G 146 -7.259 0.431 7.781 253 H1' DG 146 H1' G 146 -7.683 2.514 6.745 254 H21 DG 146 1H2 G 146 -7.970 3.625 1.248 255 H22 DG 146 2H2 G 146 -8.939 3.559 2.697 256 H8 DA 147 8H A 147 -6.919 -1.189 6.433 257 H2 DA 147 2H A 147 -6.500 0.518 0.272 258 H5' DA 147 H5' A 147 -10.083 1.839 7.494 259 H5'' DA 147 H5" A 147 -11.522 0.857 7.823 260 H4' DA 147 H4' A 147 -11.294 1.121 5.431 261 H3' DA 147 H3' A 147 -11.305 -1.488 6.552 262 H2' DA 147 H2' A 147 -9.110 -2.020 6.032 263 H2'' DA 147 H2" A 147 -9.808 -2.434 4.427 264 H1' DA 147 H1' A 147 -9.415 -0.250 3.578 265 H61 DA 147 2H6 A 147 -2.852 -0.721 3.797 266 H62 DA 147 1H6 A 147 -2.542 -0.293 2.125 267 H5 DC 148 5H C 148 -7.018 -3.596 3.241 268 H6 DC 148 6H C 148 -9.321 -3.484 2.414 269 H5' DC 148 H5' C 148 -12.456 -0.756 1.874 270 H5'' DC 148 H5" C 148 -13.893 -1.782 1.616 271 H4' DC 148 H4' C 148 -12.694 -1.679 -0.463 272 H3' DC 148 H3' C 148 -13.154 -4.177 0.839 273 H2' DC 148 H2' C 148 -10.924 -4.539 1.376 274 H2'' DC 148 H2" C 148 -10.860 -5.260 -0.245 275 H1' DC 148 H1' C 148 -10.150 -3.158 -1.238 276 H41 DC 148 1H4 C 148 -4.168 -3.193 0.945 277 H42 DC 148 2H4 C 148 -4.689 -3.532 2.598 278 H8 DG 149 8H G 149 -9.216 -6.732 -1.033 279 H1 DG 149 1H G 149 -2.817 -5.999 -1.115 280 H5' DG 149 H5' G 149 -10.720 -3.542 -3.043 281 H5'' DG 149 H5" G 149 -12.013 -4.031 -4.120 282 H4' DG 149 H4' G 149 -10.148 -4.488 -5.399 283 H3' DG 149 H3' G 149 -11.553 -6.778 -4.615 284 H2' DG 149 H2' G 149 -10.071 -7.353 -2.930 285 H2'' DG 149 H2" G 149 -9.280 -8.264 -4.209 286 H1' DG 149 H1' G 149 -7.648 -6.467 -4.589 287 H21 DG 149 1H2 G 149 -2.141 -5.536 -3.130 288 H22 DG 149 2H2 G 149 -3.263 -5.352 -4.463 289 H5 DC 150 5H C 150 -6.986 -9.306 -1.708 290 H6 DC 150 6H C 150 -7.145 -9.613 -4.122 291 H5' DC 150 H5' C 150 -8.177 -9.061 -5.770 292 H5'' DC 150 H5" C 150 -8.037 -7.432 -6.445 293 H4' DC 150 H4' C 150 -6.620 -8.241 -8.227 294 H3' DC 150 H3' C 150 -7.709 -10.725 -7.684 295 H2' DC 150 H2' C 150 -6.784 -11.095 -5.661 296 H2'' DC 150 H2" C 150 -5.463 -11.718 -6.624 297 H1' DC 150 H1' C 150 -4.132 -9.784 -6.339 298 H41 DC 150 1H4 C 150 -3.754 -9.382 -0.036 299 H42 DC 150 2H4 C 150 -5.500 -9.331 0.148 300 H5 DC 151 5H C 151 -5.110 -12.925 -4.413 301 H6 DC 151 6H C 151 -3.910 -12.897 -6.539 302 H5' DC 151 H5' C 151 -3.480 -10.184 -9.074 303 H5'' DC 151 H5" C 151 -3.237 -11.152 -10.542 304 H4' DC 151 H4' C 151 -1.098 -10.918 -9.481 305 H3' DC 151 H3' C 151 -2.167 -13.449 -10.041 306 H2' DC 151 H2' C 151 -2.789 -13.879 -7.883 307 H2'' DC 151 H2" C 151 -1.213 -14.563 -7.776 308 H1' DC 151 H1' C 151 -0.227 -12.581 -6.773 309 H41 DC 151 1H4 C 151 -3.266 -13.030 -1.253 310 H42 DC 151 2H4 C 151 -4.831 -13.005 -2.040 311 H5 DC 152 5H C 152 -3.093 -15.617 -5.008 312 H6 DC 152 6H C 152 -0.917 -15.795 -6.114 313 H5' DC 152 H5' C 152 1.681 -13.193 -7.495 314 H5'' DC 152 H5" C 152 2.881 -14.051 -8.476 315 H4' DC 152 H4' C 152 3.489 -14.544 -6.280 316 H3' DC 152 H3' C 152 2.537 -16.618 -8.002 317 H2' DC 152 H2' C 152 0.725 -17.201 -6.688 318 H2'' DC 152 H2" C 152 1.923 -18.120 -5.746 319 H1' DC 152 H1' C 152 2.252 -16.335 -4.194 320 H41 DC 152 1H4 C 152 -3.420 -16.242 -1.376 321 H42 DC 152 2H4 C 152 -4.246 -15.972 -2.899 322 H5 DC 153 5H C 153 -1.392 -19.588 -4.719 323 H6 DC 153 6H C 153 1.014 -20.010 -4.507 324 H5' DC 153 H5' C 153 4.525 -17.510 -4.005 325 H5'' DC 153 H5" C 153 5.914 -18.550 -4.363 326 H4' DC 153 H4' C 153 5.190 -19.226 -2.236 327 H3' DC 153 H3' C 153 4.901 -21.162 -4.334 328 H2' DC 153 H2' C 153 2.612 -21.278 -4.200 329 H2'' DC 153 H2" C 153 2.911 -22.353 -2.833 330 H1' DC 153 H1' C 153 2.703 -20.559 -1.202 331 H41 DC 153 1H4 C 153 -3.492 -19.059 -1.745 332 H42 DC 153 2H4 C 153 -3.455 -19.292 -3.484 333 H5 DC 154 5H C 154 -0.110 -22.951 -3.123 334 H6 DC 154 6H C 154 1.733 -23.534 -1.617 335 H5' DC 154 H5' C 154 4.658 -21.779 0.120 336 H5'' DC 154 H5" C 154 5.792 -23.081 0.542 337 H4' DC 154 H4' C 154 4.127 -23.043 2.218 338 H3' DC 154 H3' C 154 4.534 -25.359 0.613 339 H2' DC 154 H2' C 154 2.444 -25.348 -0.396 340 H2'' DC 154 H2" C 154 1.914 -26.059 1.153 341 H1' DC 154 H1' C 154 1.218 -24.024 2.046 342 H41 DC 154 1H4 C 154 -3.555 -22.665 -1.831 343 H42 DC 154 2H4 C 154 -2.492 -22.502 -3.215 344 H8 DG 155 8H G 155 0.557 -27.519 0.969 345 H1 DG 155 1H G 155 -5.515 -25.846 -0.347 346 H5' DG 155 H5' G 155 2.296 -25.619 4.671 347 H5'' DG 155 H5" G 155 2.726 -27.064 5.610 348 H4' DG 155 H4' G 155 0.321 -26.511 5.956 349 H3' DG 155 H3' G 155 1.363 -28.995 4.975 350 H2' DG 155 H2' G 155 0.390 -28.936 2.904 351 H2'' DG 155 H2" G 155 -1.058 -29.500 3.797 352 H1' DG 155 H1' G 155 -1.915 -27.304 4.030 353 H21 DG 155 1H2 G 155 -6.683 -25.796 1.473 354 H22 DG 155 2H2 G 155 -5.985 -26.195 3.035 355 H5 DC 156 5H C 156 -1.608 -30.571 1.138 356 H6 DC 156 6H C 156 -2.508 -30.954 3.390 357 H5' DC 156 H5' C 156 -2.759 -28.679 6.928 358 H5'' DC 156 H5" C 156 -3.040 -29.997 8.082 359 H4' DC 156 H4' C 156 -5.117 -29.401 6.963 360 H3' DC 156 H3' C 156 -4.023 -32.020 7.015 361 H2' DC 156 H2' C 156 -3.648 -32.124 4.738 362 H2'' DC 156 H2" C 156 -5.380 -32.532 4.713 363 H1' DC 156 H1' C 156 -6.082 -30.295 4.275 364 H41 DC 156 1H4 C 156 -3.794 -29.334 -1.561 365 H42 DC 156 2H4 C 156 -2.158 -29.713 -1.066 366 H8 DG 157 8H G 157 -6.403 -34.868 4.621 367 H1 DG 157 1H G 157 -6.901 -32.258 -1.221 368 H5' DG 157 H5' G 157 -8.711 -31.516 7.237 369 H5'' DG 157 H5" G 157 -9.505 -32.727 8.264 370 H4' DG 157 H4' G 157 -10.818 -32.310 6.183 371 H3' DG 157 H3' G 157 -10.147 -34.851 7.104 372 H2' DG 157 H2' G 157 -8.300 -35.199 5.670 373 H2'' DG 157 H2" G 157 -9.591 -35.881 4.625 374 H1' DG 157 H1' G 157 -9.957 -33.809 3.527 375 H21 DG 157 1H2 G 157 -8.995 -31.894 -1.654 376 H22 DG 157 2H2 G 157 -10.235 -32.079 -0.429 377 HA ALA 1 HA ALA 1 15.291 26.281 -5.368 378 H1 ALA 1 HN ALA 1 13.557 27.340 -6.845 379 HB1 ALA 1 1HB ALA 1 17.184 27.899 -7.137 380 HB2 ALA 1 2HB ALA 1 17.650 26.906 -5.736 381 HB3 ALA 1 3HB ALA 1 16.979 26.134 -7.186 382 H SER 2 HN SER 2 13.840 29.122 -6.130 383 HA SER 2 HA SER 2 14.356 30.275 -3.497 384 HG SER 2 HG SER 2 16.544 30.211 -4.258 385 HB2 SER 2 2HB SER 2 15.381 31.664 -6.007 386 HB3 SER 2 3HB SER 2 15.019 32.541 -4.502 387 H GLU 3 HN GLU 3 12.380 30.783 -2.842 388 HA GLU 3 HA GLU 3 10.154 31.422 -2.841 389 HB2 GLU 3 2HB GLU 3 10.619 32.783 -5.570 390 HB3 GLU 3 3HB GLU 3 9.263 32.959 -4.490 391 HG2 GLU 3 2HG GLU 3 10.737 33.909 -2.738 392 HG3 GLU 3 3HG GLU 3 12.118 33.787 -3.836 393 H LYS 4 HN LYS 4 10.784 30.861 -6.351 394 HA LYS 4 HA LYS 4 8.668 28.799 -6.480 395 HB2 LYS 4 2HB LYS 4 9.479 28.580 -8.858 396 HB3 LYS 4 3HB LYS 4 8.866 30.169 -8.419 397 HG2 LYS 4 2HG LYS 4 11.180 31.045 -8.236 398 HG3 LYS 4 3HG LYS 4 11.822 29.457 -8.694 399 HD2 LYS 4 2HD LYS 4 10.652 29.605 -10.866 400 HD3 LYS 4 3HD LYS 4 9.997 31.194 -10.404 401 HE2 LYS 4 2HE LYS 4 12.308 32.067 -10.152 402 HE3 LYS 4 3HE LYS 4 12.957 30.487 -10.623 403 HZ1 LYS 4 3HZ LYS 4 12.892 32.007 -12.477 404 HZ2 LYS 4 1HZ LYS 4 11.267 32.212 -12.312 405 HZ3 LYS 4 2HZ LYS 4 11.870 30.746 -12.754 406 H ARG 5 HN ARG 5 9.026 26.737 -5.939 407 HA ARG 5 HA ARG 5 11.770 25.588 -6.224 408 HE ARG 5 HE ARG 5 10.319 28.088 -3.019 409 HB2 ARG 5 2HB ARG 5 10.063 25.744 -3.721 410 HB3 ARG 5 3HB ARG 5 11.260 24.474 -3.895 411 HG2 ARG 5 2HG ARG 5 13.081 25.905 -3.785 412 HG3 ARG 5 3HG ARG 5 12.184 27.324 -4.318 413 HD2 ARG 5 2HD ARG 5 11.699 26.002 -1.634 414 HD3 ARG 5 3HD ARG 5 12.829 27.346 -1.897 415 HH11 ARG 5 1HH1 ARG 5 11.619 27.615 0.221 416 HH12 ARG 5 2HH1 ARG 5 10.459 28.737 0.905 417 HH21 ARG 5 1HH2 ARG 5 8.958 29.400 -2.144 418 HH22 ARG 5 2HH2 ARG 5 8.939 29.740 -0.409 419 HA PRO 6 HA PRO 6 9.487 22.077 -7.671 420 HB2 PRO 6 2HB PRO 6 11.298 20.050 -7.354 421 HB3 PRO 6 3HB PRO 6 11.580 21.406 -8.487 422 HG2 PRO 6 2HG PRO 6 12.609 21.113 -5.642 423 HG3 PRO 6 3HG PRO 6 13.549 21.508 -7.118 424 HD2 PRO 6 2HD PRO 6 12.628 23.430 -5.407 425 HD3 PRO 6 3HD PRO 6 12.705 23.707 -7.176 426 H PHE 7 HN PHE 7 8.714 19.856 -7.021 427 HA PHE 7 HA PHE 7 7.919 19.830 -4.166 428 HD1 PHE 7 1HD PHE 7 5.091 19.791 -4.149 429 HD2 PHE 7 2HD PHE 7 6.549 19.287 -8.175 430 HE1 PHE 7 1HE PHE 7 3.412 21.415 -4.961 431 HE2 PHE 7 2HE PHE 7 4.867 20.916 -8.988 432 HZ PHE 7 HZ PHE 7 3.307 22.003 -7.378 433 HB2 PHE 7 2HB PHE 7 7.348 17.874 -6.421 434 HB3 PHE 7 3HB PHE 7 6.598 17.859 -4.818 435 H MET 8 HN MET 8 8.291 17.885 -2.822 436 HA MET 8 HA MET 8 10.743 16.344 -3.608 437 HB2 MET 8 2HB MET 8 10.307 17.837 -0.974 438 HB3 MET 8 3HB MET 8 11.592 16.670 -1.261 439 HG2 MET 8 2HG MET 8 12.326 18.130 -3.227 440 HG3 MET 8 3HG MET 8 11.187 19.340 -2.648 441 HE1 MET 8 3HE MET 8 13.743 16.912 -0.662 442 HE2 MET 8 1HE MET 8 14.530 17.472 -2.151 443 HE3 MET 8 2HE MET 8 15.115 18.033 -0.569 444 H CYS 9 HN CYS 9 11.167 14.468 -2.404 445 HA CYS 9 HA CYS 9 8.831 13.410 -0.822 446 HB2 CYS 9 2HB CYS 9 8.940 12.114 -2.897 447 HB3 CYS 9 3HB CYS 9 10.656 11.761 -2.676 448 H ALA 10 HN ALA 10 9.619 11.688 0.798 449 HA ALA 10 HA ALA 10 12.286 12.509 1.904 450 HB1 ALA 10 1HB ALA 10 9.702 12.030 3.452 451 HB2 ALA 10 2HB ALA 10 11.283 12.432 4.160 452 HB3 ALA 10 3HB ALA 10 10.446 13.614 3.132 453 H TYR 11 HN TYR 11 10.470 9.951 0.675 454 HA TYR 11 HA TYR 11 11.148 7.898 2.617 455 HD1 TYR 11 1HD TYR 11 8.870 6.069 2.784 456 HD2 TYR 11 2HD TYR 11 11.347 5.478 -0.681 457 HE1 TYR 11 1HE TYR 11 9.037 3.631 3.309 458 HE2 TYR 11 2HE TYR 11 11.494 3.049 -0.176 459 HH TYR 11 HH TYR 11 9.765 1.499 2.486 460 HB2 TYR 11 2HB TYR 11 9.197 7.855 1.014 461 HB3 TYR 11 3HB TYR 11 10.376 7.617 -0.274 462 HA PRO 12 HA PRO 12 15.365 6.977 1.591 463 HB2 PRO 12 2HB PRO 12 14.382 4.110 1.760 464 HB3 PRO 12 3HB PRO 12 15.855 4.826 2.479 465 HG2 PRO 12 2HG PRO 12 13.691 4.403 4.025 466 HG3 PRO 12 3HG PRO 12 14.561 5.972 4.149 467 HD2 PRO 12 2HD PRO 12 12.021 5.333 2.669 468 HD3 PRO 12 3HD PRO 12 12.423 6.758 3.683 469 H GLY 13 HN GLY 13 16.686 6.197 -0.102 470 HA2 GLY 13 2HA GLY 13 17.223 5.673 -2.300 471 HA3 GLY 13 3HA GLY 13 16.017 4.400 -2.058 472 H CYS 14 HN CYS 14 14.573 7.537 -1.891 473 HA CYS 14 HA CYS 14 13.402 7.210 -4.597 474 HB2 CYS 14 2HB CYS 14 11.901 7.681 -2.675 475 HB3 CYS 14 3HB CYS 14 12.753 9.182 -2.339 476 H ASN 15 HN ASN 15 13.056 9.396 -5.790 477 HA ASN 15 HA ASN 15 15.645 10.664 -6.302 478 HB2 ASN 15 2HB ASN 15 13.773 10.291 -8.010 479 HB3 ASN 15 3HB ASN 15 12.876 11.593 -7.224 480 HD21 ASN 15 1HD2 ASN 15 13.188 13.620 -8.416 481 HD22 ASN 15 2HD2 ASN 15 14.761 13.893 -9.176 482 H LYS 16 HN LYS 16 12.597 11.441 -4.537 483 HA LYS 16 HA LYS 16 12.233 12.870 -2.811 484 HB2 LYS 16 2HB LYS 16 15.246 13.363 -2.736 485 HB3 LYS 16 3HB LYS 16 14.086 13.880 -1.532 486 HG2 LYS 16 2HG LYS 16 13.417 11.520 -1.112 487 HG3 LYS 16 3HG LYS 16 14.595 10.990 -2.311 488 HD2 LYS 16 2HD LYS 16 16.405 12.111 -0.909 489 HD3 LYS 16 3HD LYS 16 15.158 12.378 0.327 490 HE2 LYS 16 2HE LYS 16 16.278 10.341 0.923 491 HE3 LYS 16 3HE LYS 16 14.692 9.892 0.277 492 HZ1 LYS 16 3HZ LYS 16 16.379 8.500 -0.658 493 HZ2 LYS 16 1HZ LYS 16 17.261 9.796 -1.177 494 HZ3 LYS 16 2HZ LYS 16 15.807 9.475 -1.861 495 H ARG 17 HN ARG 17 12.665 13.625 -5.733 496 HA ARG 17 HA ARG 17 11.867 16.381 -5.257 497 HE ARG 17 HE ARG 17 17.410 17.986 -4.613 498 HB2 ARG 17 2HB ARG 17 14.248 15.773 -7.073 499 HB3 ARG 17 3HB ARG 17 13.362 17.301 -7.036 500 HG2 ARG 17 2HG ARG 17 13.965 17.508 -4.592 501 HG3 ARG 17 3HG ARG 17 15.042 16.113 -4.795 502 HD2 ARG 17 2HD ARG 17 16.308 17.312 -6.524 503 HD3 ARG 17 3HD ARG 17 15.226 18.706 -6.391 504 HH11 ARG 17 1HH1 ARG 17 14.354 19.722 -4.647 505 HH12 ARG 17 2HH1 ARG 17 14.764 20.642 -3.216 506 HH21 ARG 17 2HH2 ARG 17 17.884 19.234 -2.831 507 HH22 ARG 17 1HH2 ARG 17 16.721 20.405 -2.258 508 H TYR 18 HN TYR 18 10.034 16.584 -6.344 509 HA TYR 18 HA TYR 18 9.789 15.341 -9.054 510 HD1 TYR 18 2HD TYR 18 9.040 14.274 -5.389 511 HD2 TYR 18 1HD TYR 18 7.422 13.148 -9.231 512 HE1 TYR 18 2HE TYR 18 9.607 11.886 -4.979 513 HE2 TYR 18 1HE TYR 18 8.145 10.830 -8.854 514 HH TYR 18 HH TYR 18 10.001 9.868 -5.921 515 HB2 TYR 18 2HB TYR 18 7.808 15.886 -6.835 516 HB3 TYR 18 3HB TYR 18 7.306 15.461 -8.460 517 H PHE 19 HN PHE 19 8.207 16.434 -10.527 518 HA PHE 19 HA PHE 19 8.658 19.399 -10.364 519 HD1 PHE 19 1HD PHE 19 10.911 20.139 -11.629 520 HD2 PHE 19 2HD PHE 19 10.187 15.988 -12.553 521 HE1 PHE 19 1HE PHE 19 13.328 19.650 -11.345 522 HE2 PHE 19 2HE PHE 19 12.600 15.505 -12.259 523 HZ PHE 19 HZ PHE 19 14.175 17.331 -11.657 524 HB2 PHE 19 2HB PHE 19 8.413 17.593 -12.808 525 HB3 PHE 19 3HB PHE 19 8.771 19.320 -12.821 526 H LYS 20 HN LYS 20 6.214 16.963 -10.509 527 HA LYS 20 HA LYS 20 4.177 19.045 -11.213 528 HB2 LYS 20 2HB LYS 20 4.483 16.202 -12.150 529 HB3 LYS 20 3HB LYS 20 2.849 16.917 -12.074 530 HG2 LYS 20 2HG LYS 20 5.243 18.127 -13.519 531 HG3 LYS 20 3HG LYS 20 4.100 17.048 -14.299 532 HD2 LYS 20 2HD LYS 20 2.367 18.575 -14.311 533 HD3 LYS 20 3HD LYS 20 2.965 19.504 -12.938 534 HE2 LYS 20 2HE LYS 20 4.427 19.406 -15.600 535 HE3 LYS 20 3HE LYS 20 3.178 20.608 -15.237 536 HZ1 LYS 20 3HZ LYS 20 4.471 21.398 -13.418 537 HZ2 LYS 20 1HZ LYS 20 5.432 21.384 -14.755 538 HZ3 LYS 20 2HZ LYS 20 5.599 20.227 -13.589 539 H LEU 21 HN LEU 21 2.605 19.338 -9.764 540 HA LEU 21 HA LEU 21 2.835 18.386 -7.151 541 HG LEU 21 HG LEU 21 0.885 18.866 -5.699 542 HB2 LEU 21 2HB LEU 21 1.576 20.382 -7.873 543 HB3 LEU 21 3HB LEU 21 0.326 19.405 -8.591 544 HD11 LEU 21 1HD1 LEU 21 -0.409 21.463 -6.650 545 HD12 LEU 21 2HD1 LEU 21 1.095 21.310 -5.717 546 HD13 LEU 21 3HD1 LEU 21 -0.449 20.857 -4.984 547 HD21 LEU 21 3HD2 LEU 21 -1.044 17.808 -6.949 548 HD22 LEU 21 1HD2 LEU 21 -1.719 19.421 -7.203 549 HD23 LEU 21 2HD2 LEU 21 -1.560 18.769 -5.559 550 H SER 22 HN SER 22 0.326 17.360 -9.539 551 HA SER 22 HA SER 22 -0.731 15.282 -7.901 552 HG SER 22 HG SER 22 -2.834 16.647 -10.377 553 HB2 SER 22 2HB SER 22 -0.857 15.470 -10.937 554 HB3 SER 22 3HB SER 22 -1.989 14.624 -9.858 555 H HIS 23 HN HIS 23 1.933 15.307 -10.189 556 HA HIS 23 HA HIS 23 2.056 12.409 -10.566 557 HD1 HIS 23 1HD HIS 23 5.670 12.792 -13.092 558 HD2 HIS 23 2HD HIS 23 5.563 15.195 -9.673 559 HE1 HIS 23 1HE HIS 23 7.975 13.853 -12.869 560 HB2 HIS 23 2HB HIS 23 3.424 12.959 -12.131 561 HB3 HIS 23 3HB HIS 23 3.198 14.603 -11.817 562 H LEU 24 HN LEU 24 3.777 14.860 -8.559 563 HA LEU 24 HA LEU 24 5.127 12.986 -6.928 564 HG LEU 24 HG LEU 24 6.529 15.630 -5.024 565 HB2 LEU 24 2HB LEU 24 5.618 15.378 -7.044 566 HB3 LEU 24 3HB LEU 24 4.147 15.786 -6.260 567 HD11 LEU 24 1HD1 LEU 24 4.501 16.599 -4.068 568 HD12 LEU 24 2HD1 LEU 24 5.406 15.639 -2.884 569 HD13 LEU 24 3HD1 LEU 24 3.939 14.962 -3.613 570 HD21 LEU 24 3HD2 LEU 24 7.065 13.804 -3.805 571 HD22 LEU 24 1HD2 LEU 24 6.461 12.996 -5.262 572 HD23 LEU 24 2HD2 LEU 24 5.459 13.131 -3.800 573 H GLN 25 HN GLN 25 1.801 14.354 -6.567 574 HA GLN 25 HA GLN 25 1.253 13.276 -3.968 575 HB2 GLN 25 2HB GLN 25 -0.672 13.724 -6.320 576 HB3 GLN 25 3HB GLN 25 -1.130 13.322 -4.691 577 HG2 GLN 25 2HG GLN 25 -0.393 15.947 -5.783 578 HG3 GLN 25 3HG GLN 25 -1.519 15.507 -4.532 579 HE21 GLN 25 1HE2 GLN 25 1.812 16.358 -5.240 580 HE22 GLN 25 2HE2 GLN 25 2.267 16.595 -3.527 581 H MET 26 HN MET 26 0.670 11.894 -7.260 582 HA MET 26 HA MET 26 -0.277 9.347 -6.370 583 HB2 MET 26 2HB MET 26 -0.436 10.220 -8.712 584 HB3 MET 26 3HB MET 26 1.311 10.015 -8.896 585 HG2 MET 26 2HG MET 26 0.086 8.121 -9.869 586 HG3 MET 26 3HG MET 26 1.077 7.589 -8.515 587 HE1 MET 26 3HE MET 26 -0.990 5.602 -9.609 588 HE2 MET 26 1HE MET 26 -0.057 5.311 -8.119 589 HE3 MET 26 2HE MET 26 -1.817 5.061 -8.130 590 H HIS 27 HN HIS 27 3.036 10.594 -7.048 591 HA HIS 27 HA HIS 27 4.445 8.181 -6.682 592 HD1 HIS 27 1HD HIS 27 7.142 7.793 -6.610 593 HD2 HIS 27 2HD HIS 27 6.780 11.146 -4.059 594 HE1 HIS 27 1HE HIS 27 8.925 7.560 -4.781 595 HB2 HIS 27 2HB HIS 27 5.676 10.077 -7.506 596 HB3 HIS 27 3HB HIS 27 5.222 11.086 -6.140 597 H SER 28 HN SER 28 3.427 10.638 -4.259 598 HA SER 28 HA SER 28 4.645 9.496 -2.017 599 HG SER 28 HG SER 28 1.333 10.889 -2.867 600 HB2 SER 28 2HB SER 28 3.260 10.927 -0.743 601 HB3 SER 28 3HB SER 28 3.320 11.744 -2.333 602 H ARG 29 HN ARG 29 1.562 8.597 -3.639 603 HA ARG 29 HA ARG 29 0.489 6.928 -1.535 604 HE ARG 29 HE ARG 29 -0.120 9.647 -2.171 605 HB2 ARG 29 2HB ARG 29 -0.024 7.251 -4.495 606 HB3 ARG 29 3HB ARG 29 -0.442 5.728 -3.764 607 HG2 ARG 29 2HG ARG 29 -2.389 6.865 -3.620 608 HG3 ARG 29 3HG ARG 29 -1.762 7.064 -1.991 609 HD2 ARG 29 2HD ARG 29 -1.433 9.158 -4.187 610 HD3 ARG 29 3HD ARG 29 -2.874 9.062 -3.188 611 HH11 ARG 29 1HH1 ARG 29 -3.572 9.998 -1.585 612 HH12 ARG 29 2HH1 ARG 29 -3.312 11.291 -0.442 613 HH21 ARG 29 1HH2 ARG 29 0.116 11.285 -0.871 614 HH22 ARG 29 2HH2 ARG 29 -1.221 12.059 -0.029 615 H LYS 30 HN LYS 30 2.899 6.416 -4.118 616 HA LYS 30 HA LYS 30 2.964 3.562 -4.105 617 HB2 LYS 30 2HB LYS 30 4.122 5.164 -5.744 618 HB3 LYS 30 3HB LYS 30 5.329 5.432 -4.481 619 HG2 LYS 30 2HG LYS 30 5.676 2.844 -4.511 620 HG3 LYS 30 3HG LYS 30 4.759 2.890 -6.019 621 HD2 LYS 30 2HD LYS 30 7.090 2.950 -6.573 622 HD3 LYS 30 3HD LYS 30 6.458 4.578 -6.885 623 HE2 LYS 30 2HE LYS 30 7.359 5.329 -4.676 624 HE3 LYS 30 3HE LYS 30 7.951 3.690 -4.367 625 HZ1 LYS 30 3HZ LYS 30 9.663 5.157 -5.220 626 HZ2 LYS 30 1HZ LYS 30 8.815 5.409 -6.607 627 HZ3 LYS 30 2HZ LYS 30 9.396 3.907 -6.254 628 H HIS 31 HN HIS 31 4.512 5.975 -1.938 629 HA HIS 31 HA HIS 31 6.293 3.947 -0.789 630 HD1 HIS 31 1HD HIS 31 8.195 4.159 -1.616 631 HD2 HIS 31 2HD HIS 31 7.694 8.351 -1.417 632 HE1 HIS 31 1HE HIS 31 10.103 5.185 -2.927 633 HB2 HIS 31 2HB HIS 31 5.773 6.883 -0.197 634 HB3 HIS 31 3HB HIS 31 6.850 5.887 0.795 635 H THR 32 HN THR 32 3.169 5.448 0.122 636 HA THR 32 HA THR 32 2.883 4.634 2.708 637 HB THR 32 HB THR 32 0.507 4.395 2.364 638 HG1 THR 32 1HG THR 32 0.979 4.308 -0.463 639 HG21 THR 32 3HG2 THR 32 -0.069 6.459 1.211 640 HG22 THR 32 1HG2 THR 32 1.515 6.510 0.424 641 HG23 THR 32 2HG2 THR 32 1.396 6.681 2.181 642 H GLY 33 HN GLY 33 3.183 2.443 -0.044 643 HA2 GLY 33 2HA GLY 33 2.356 0.100 1.598 644 HA3 GLY 33 3HA GLY 33 2.683 0.097 -0.136 645 H GLU 34 HN GLU 34 5.101 1.865 1.425 646 HA GLU 34 HA GLU 34 6.902 -0.533 1.523 647 HB2 GLU 34 2HB GLU 34 7.530 2.251 0.437 648 HB3 GLU 34 3HB GLU 34 8.639 0.869 0.491 649 HG2 GLU 34 2HG GLU 34 7.189 -0.422 -1.011 650 HG3 GLU 34 3HG GLU 34 6.064 0.931 -1.126 651 H LYS 35 HN LYS 35 5.515 1.754 3.489 652 HA LYS 35 HA LYS 35 7.781 2.806 4.940 653 HB2 LYS 35 2HB LYS 35 5.471 3.767 4.918 654 HB3 LYS 35 3HB LYS 35 4.906 2.429 5.915 655 HG2 LYS 35 2HG LYS 35 7.291 4.077 6.831 656 HG3 LYS 35 3HG LYS 35 5.690 4.792 6.930 657 HD2 LYS 35 2HD LYS 35 4.870 3.134 8.401 658 HD3 LYS 35 3HD LYS 35 6.281 2.095 8.220 659 HE2 LYS 35 2HE LYS 35 6.362 4.882 9.435 660 HE3 LYS 35 3HE LYS 35 6.171 3.383 10.363 661 HZ1 LYS 35 3HZ LYS 35 8.459 4.043 10.293 662 HZ2 LYS 35 1HZ LYS 35 8.474 4.013 8.644 663 HZ3 LYS 35 2HZ LYS 35 8.258 2.616 9.497 664 HA PRO 36 HA PRO 36 8.790 -1.112 6.799 665 HB2 PRO 36 2HB PRO 36 10.909 -0.288 8.377 666 HB3 PRO 36 3HB PRO 36 10.990 -0.466 6.602 667 HG2 PRO 36 2HG PRO 36 10.521 2.071 8.191 668 HG3 PRO 36 3HG PRO 36 11.670 1.799 6.839 669 HD2 PRO 36 2HD PRO 36 9.249 2.940 6.446 670 HD3 PRO 36 3HD PRO 36 9.930 1.801 5.240 671 H TYR 37 HN TYR 37 7.622 -2.099 8.320 672 HA TYR 37 HA TYR 37 7.457 -0.833 11.062 673 HD1 TYR 37 1HD TYR 37 4.980 -0.264 12.518 674 HD2 TYR 37 2HD TYR 37 4.614 -0.430 8.223 675 HE1 TYR 37 1HE TYR 37 3.378 1.628 12.597 676 HE2 TYR 37 2HE TYR 37 3.019 1.492 8.299 677 HH TYR 37 HH TYR 37 2.264 3.263 11.171 678 HB2 TYR 37 2HB TYR 37 5.377 -2.349 9.459 679 HB3 TYR 37 3HB TYR 37 5.343 -2.371 11.188 680 H GLN 38 HN GLN 38 7.056 -2.562 12.807 681 HA GLN 38 HA GLN 38 8.143 -5.243 12.090 682 HB2 GLN 38 2HB GLN 38 9.591 -5.350 13.942 683 HB3 GLN 38 3HB GLN 38 9.957 -3.823 13.157 684 HG2 GLN 38 2HG GLN 38 8.342 -4.221 15.729 685 HG3 GLN 38 3HG GLN 38 9.980 -3.621 15.597 686 HE21 GLN 38 1HE2 GLN 38 6.528 -2.742 15.099 687 HE22 GLN 38 2HE2 GLN 38 6.923 -1.007 15.004 688 H CYS 39 HN CYS 39 7.391 -6.955 13.422 689 HA CYS 39 HA CYS 39 4.724 -6.849 14.234 690 HB2 CYS 39 2HB CYS 39 6.047 -8.956 13.862 691 HB3 CYS 39 3HB CYS 39 6.830 -8.698 15.444 692 H ASP 40 HN ASP 40 3.591 -6.388 16.072 693 HA ASP 40 HA ASP 40 5.108 -4.996 18.232 694 HB2 ASP 40 2HB ASP 40 2.120 -4.949 17.662 695 HB3 ASP 40 3HB ASP 40 3.011 -3.881 18.749 696 H PHE 41 HN PHE 41 4.412 -8.076 17.767 697 HA PHE 41 HA PHE 41 2.672 -8.696 20.038 698 HD1 PHE 41 1HD PHE 41 1.247 -10.716 20.273 699 HD2 PHE 41 2HD PHE 41 4.924 -12.536 18.957 700 HE1 PHE 41 1HE PHE 41 0.693 -12.784 21.540 701 HE2 PHE 41 2HE PHE 41 4.365 -14.595 20.202 702 HZ PHE 41 HZ PHE 41 2.259 -14.717 21.518 703 HB2 PHE 41 2HB PHE 41 2.735 -10.086 18.011 704 HB3 PHE 41 3HB PHE 41 4.443 -10.403 18.258 705 H LYS 42 HN LYS 42 3.461 -10.257 21.758 706 HA LYS 42 HA LYS 42 5.589 -9.006 23.225 707 HB2 LYS 42 2HB LYS 42 3.559 -10.173 24.181 708 HB3 LYS 42 3HB LYS 42 4.290 -11.718 23.742 709 HG2 LYS 42 2HG LYS 42 6.254 -11.150 25.242 710 HG3 LYS 42 3HG LYS 42 5.457 -9.626 25.638 711 HD2 LYS 42 2HD LYS 42 4.992 -11.080 27.452 712 HD3 LYS 42 3HD LYS 42 3.498 -10.979 26.524 713 HE2 LYS 42 2HE LYS 42 3.799 -13.274 27.134 714 HE3 LYS 42 3HE LYS 42 4.139 -13.168 25.398 715 HZ1 LYS 42 3HZ LYS 42 5.758 -14.487 26.607 716 HZ2 LYS 42 1HZ LYS 42 6.202 -13.178 27.510 717 HZ3 LYS 42 2HZ LYS 42 6.461 -13.205 25.877 718 H ASP 43 HN ASP 43 5.454 -11.892 21.150 719 HA ASP 43 HA ASP 43 8.375 -12.345 21.654 720 HB2 ASP 43 2HB ASP 43 6.311 -14.570 21.326 721 HB3 ASP 43 3HB ASP 43 8.007 -14.729 21.774 722 H CYS 44 HN CYS 44 7.788 -10.836 19.508 723 HA CYS 44 HA CYS 44 8.484 -12.674 17.305 724 HB2 CYS 44 2HB CYS 44 5.997 -12.280 17.151 725 HB3 CYS 44 3HB CYS 44 6.329 -10.550 16.975 726 H GLU 45 HN GLU 45 9.309 -11.437 15.382 727 HA GLU 45 HA GLU 45 10.342 -8.724 15.947 728 HB2 GLU 45 2HB GLU 45 12.709 -9.380 15.661 729 HB3 GLU 45 3HB GLU 45 11.982 -10.138 17.052 730 HG2 GLU 45 2HG GLU 45 13.238 -11.856 16.216 731 HG3 GLU 45 3HG GLU 45 11.658 -12.252 15.575 732 H ARG 46 HN ARG 46 8.546 -10.111 13.943 733 HA ARG 46 HA ARG 46 10.107 -10.201 11.440 734 HE ARG 46 HE ARG 46 8.108 -12.732 13.488 735 HB2 ARG 46 2HB ARG 46 7.314 -10.874 12.307 736 HB3 ARG 46 3HB ARG 46 7.471 -10.282 10.666 737 HG2 ARG 46 2HG ARG 46 7.595 -12.764 10.858 738 HG3 ARG 46 3HG ARG 46 8.926 -12.003 9.995 739 HD2 ARG 46 2HD ARG 46 9.750 -13.820 11.368 740 HD3 ARG 46 3HD ARG 46 10.409 -12.287 11.938 741 HH11 ARG 46 1HH1 ARG 46 11.313 -14.109 13.253 742 HH12 ARG 46 2HH1 ARG 46 11.108 -15.017 14.743 743 HH21 ARG 46 1HH2 ARG 46 8.027 -13.602 15.369 744 HH22 ARG 46 2HH2 ARG 46 9.264 -14.696 15.996 745 H ARG 47 HN ARG 47 9.362 -8.893 9.548 746 HA ARG 47 HA ARG 47 8.608 -6.144 10.435 747 HE ARG 47 HE ARG 47 12.987 -7.539 8.960 748 HB2 ARG 47 2HB ARG 47 10.728 -6.971 8.412 749 HB3 ARG 47 3HB ARG 47 10.115 -5.341 8.588 750 HG2 ARG 47 2HG ARG 47 12.108 -5.278 9.745 751 HG3 ARG 47 3HG ARG 47 10.876 -5.337 10.998 752 HD2 ARG 47 2HD ARG 47 12.852 -6.728 11.526 753 HD3 ARG 47 3HD ARG 47 11.386 -7.683 11.430 754 HH11 ARG 47 2HH2 ARG 47 12.399 -9.495 11.869 755 HH12 ARG 47 1HH2 ARG 47 13.104 -10.906 11.142 756 HH21 ARG 47 1HH1 ARG 47 13.836 -9.396 8.111 757 HH22 ARG 47 2HH1 ARG 47 13.849 -10.858 9.076 758 H PHE 48 HN PHE 48 7.625 -4.795 8.857 759 HA PHE 48 HA PHE 48 6.318 -6.224 6.586 760 HD1 PHE 48 1HD PHE 48 4.198 -7.766 6.880 761 HD2 PHE 48 2HD PHE 48 5.217 -5.963 10.669 762 HE1 PHE 48 1HE PHE 48 4.296 -9.995 7.920 763 HE2 PHE 48 2HE PHE 48 5.291 -8.220 11.717 764 HZ PHE 48 HZ PHE 48 4.978 -10.223 10.297 765 HB2 PHE 48 2HB PHE 48 4.887 -4.574 8.723 766 HB3 PHE 48 3HB PHE 48 4.140 -5.218 7.267 767 H SER 49 HN SER 49 5.216 -4.647 5.094 768 HA SER 49 HA SER 49 6.951 -2.231 4.896 769 HG SER 49 HG SER 49 4.781 -2.596 1.891 770 HB2 SER 49 2HB SER 49 6.707 -2.388 2.568 771 HB3 SER 49 3HB SER 49 6.772 -4.079 3.058 772 H ARG 50 HN ARG 50 3.985 -2.848 6.176 773 HA ARG 50 HA ARG 50 3.058 -0.111 5.803 774 HE ARG 50 HE ARG 50 -0.579 -2.459 3.257 775 HB2 ARG 50 2HB ARG 50 2.323 -1.277 3.686 776 HB3 ARG 50 3HB ARG 50 1.359 -2.369 4.681 777 HG2 ARG 50 2HG ARG 50 -0.173 -0.650 5.260 778 HG3 ARG 50 3HG ARG 50 0.940 0.636 4.772 779 HD2 ARG 50 2HD ARG 50 -0.945 0.224 3.196 780 HD3 ARG 50 3HD ARG 50 0.623 0.186 2.490 781 HH11 ARG 50 1HH2 ARG 50 0.068 -0.340 0.643 782 HH12 ARG 50 2HH2 ARG 50 0.340 -1.645 -0.483 783 HH21 ARG 50 1HH1 ARG 50 -0.475 -4.056 1.739 784 HH22 ARG 50 2HH1 ARG 50 -0.215 -3.591 0.051 785 H SER 51 HN SER 51 1.200 0.401 7.122 786 HA SER 51 HA SER 51 1.066 -0.909 9.643 787 HG SER 51 HG SER 51 0.994 2.048 9.414 788 HB2 SER 51 2HB SER 51 -1.292 0.623 8.561 789 HB3 SER 51 3HB SER 51 -0.577 0.675 10.176 790 H ASP 52 HN ASP 52 -0.974 -1.169 6.713 791 HA ASP 52 HA ASP 52 -2.948 -2.860 7.808 792 HB2 ASP 52 2HB ASP 52 -3.000 -1.585 5.618 793 HB3 ASP 52 3HB ASP 52 -1.985 -2.832 4.915 794 H GLN 53 HN GLN 53 0.178 -3.689 6.200 795 HA GLN 53 HA GLN 53 -0.166 -6.553 6.224 796 HB2 GLN 53 2HB GLN 53 2.223 -4.683 6.048 797 HB3 GLN 53 3HB GLN 53 2.451 -6.396 6.385 798 HG2 GLN 53 2HG GLN 53 2.769 -6.285 4.127 799 HG3 GLN 53 3HG GLN 53 1.141 -6.938 4.301 800 HE21 GLN 53 1HE2 GLN 53 3.093 -4.310 2.848 801 HE22 GLN 53 2HE2 GLN 53 1.628 -3.530 2.269 802 H LEU 54 HN LEU 54 1.472 -4.283 8.494 803 HA LEU 54 HA LEU 54 2.253 -6.240 10.409 804 HG LEU 54 HG LEU 54 1.422 -3.911 12.862 805 HB2 LEU 54 2HB LEU 54 3.212 -4.051 10.418 806 HB3 LEU 54 3HB LEU 54 1.647 -3.273 10.557 807 HD11 LEU 54 1HD1 LEU 54 2.569 -6.129 12.800 808 HD12 LEU 54 2HD1 LEU 54 3.223 -5.078 14.069 809 HD13 LEU 54 3HD1 LEU 54 4.114 -5.310 12.555 810 HD21 LEU 54 3HD2 LEU 54 4.268 -2.979 12.813 811 HD22 LEU 54 1HD2 LEU 54 2.884 -2.319 13.641 812 HD23 LEU 54 2HD2 LEU 54 3.051 -1.992 11.923 813 H LYS 55 HN LYS 55 -0.702 -4.160 10.248 814 HA LYS 55 HA LYS 55 -1.983 -5.112 12.606 815 HB2 LYS 55 2HB LYS 55 -2.662 -3.137 11.280 816 HB3 LYS 55 3HB LYS 55 -3.227 -4.188 9.975 817 HG2 LYS 55 2HG LYS 55 -4.881 -5.169 11.666 818 HG3 LYS 55 3HG LYS 55 -4.381 -3.889 12.776 819 HD2 LYS 55 2HD LYS 55 -5.696 -3.539 10.034 820 HD3 LYS 55 3HD LYS 55 -6.449 -3.319 11.607 821 HE2 LYS 55 2HE LYS 55 -6.056 -1.142 10.972 822 HE3 LYS 55 3HE LYS 55 -4.660 -1.471 12.009 823 HZ1 LYS 55 3HZ LYS 55 -3.376 -1.880 10.003 824 HZ2 LYS 55 1HZ LYS 55 -4.048 -0.377 9.944 825 HZ3 LYS 55 2HZ LYS 55 -4.696 -1.604 9.057 826 H ARG 56 HN ARG 56 -2.197 -6.275 9.195 827 HA ARG 56 HA ARG 56 -3.963 -8.465 9.653 828 HE ARG 56 HE ARG 56 -3.610 -8.085 5.513 829 HB2 ARG 56 2HB ARG 56 -3.345 -7.668 7.433 830 HB3 ARG 56 3HB ARG 56 -1.669 -8.141 7.680 831 HG2 ARG 56 2HG ARG 56 -2.466 -10.564 7.884 832 HG3 ARG 56 3HG ARG 56 -4.061 -9.988 7.363 833 HD2 ARG 56 2HD ARG 56 -1.416 -9.690 5.853 834 HD3 ARG 56 3HD ARG 56 -2.691 -10.851 5.479 835 HH11 ARG 56 1HH2 ARG 56 -2.203 -10.525 3.403 836 HH12 ARG 56 2HH2 ARG 56 -2.546 -9.611 1.963 837 HH21 ARG 56 1HH1 ARG 56 -4.145 -7.024 3.729 838 HH22 ARG 56 2HH1 ARG 56 -3.863 -7.671 2.150 839 H HIS 57 HN HIS 57 -0.373 -8.276 9.800 840 HA HIS 57 HA HIS 57 0.088 -11.005 10.360 841 HD1 HIS 57 1HD HIS 57 2.714 -12.166 10.158 842 HD2 HIS 57 2HD HIS 57 3.110 -9.330 13.259 843 HE1 HIS 57 1HE HIS 57 4.206 -13.213 11.948 844 HB2 HIS 57 2HB HIS 57 1.865 -9.439 9.721 845 HB3 HIS 57 3HB HIS 57 1.685 -8.540 11.227 846 H GLN 58 HN GLN 58 -0.554 -8.255 12.604 847 HA GLN 58 HA GLN 58 -0.244 -9.620 15.058 848 HB2 GLN 58 2HB GLN 58 -2.214 -7.401 14.299 849 HB3 GLN 58 3HB GLN 58 -1.994 -8.028 15.913 850 HG2 GLN 58 2HG GLN 58 -0.025 -6.413 14.302 851 HG3 GLN 58 3HG GLN 58 -0.684 -6.096 15.893 852 HE21 GLN 58 1HE2 GLN 58 1.998 -7.329 14.208 853 HE22 GLN 58 2HE2 GLN 58 2.771 -8.205 15.534 854 H ARG 59 HN ARG 59 -2.981 -9.717 12.718 855 HA ARG 59 HA ARG 59 -4.937 -10.951 14.418 856 HE ARG 59 HE ARG 59 -6.329 -7.375 11.106 857 HB2 ARG 59 2HB ARG 59 -4.573 -11.405 11.421 858 HB3 ARG 59 3HB ARG 59 -5.999 -11.719 12.368 859 HG2 ARG 59 2HG ARG 59 -6.242 -9.313 12.926 860 HG3 ARG 59 3HG ARG 59 -4.792 -8.974 11.986 861 HD2 ARG 59 2HD ARG 59 -6.027 -10.063 9.999 862 HD3 ARG 59 3HD ARG 59 -7.497 -9.838 10.969 863 HH11 ARG 59 1HH1 ARG 59 -7.195 -9.283 8.287 864 HH12 ARG 59 2HH1 ARG 59 -6.840 -7.952 7.186 865 HH21 ARG 59 2HH2 ARG 59 -6.001 -5.736 9.690 866 HH22 ARG 59 1HH2 ARG 59 -6.254 -5.965 7.977 867 H ARG 60 HN ARG 60 -2.116 -12.291 12.698 868 HA ARG 60 HA ARG 60 -2.882 -15.089 12.959 869 HE ARG 60 HE ARG 60 2.506 -17.092 10.739 870 HB2 ARG 60 2HB ARG 60 -1.206 -14.220 11.322 871 HB3 ARG 60 3HB ARG 60 -0.109 -13.851 12.662 872 HG2 ARG 60 2HG ARG 60 0.043 -16.247 13.248 873 HG3 ARG 60 3HG ARG 60 -1.124 -16.615 11.955 874 HD2 ARG 60 2HD ARG 60 0.490 -15.546 10.327 875 HD3 ARG 60 3HD ARG 60 1.581 -15.222 11.641 876 HH11 ARG 60 1HH2 ARG 60 -0.687 -18.270 11.793 877 HH12 ARG 60 2HH2 ARG 60 -0.207 -19.905 11.421 878 HH21 ARG 60 1HH1 ARG 60 2.940 -19.133 10.342 879 HH22 ARG 60 2HH1 ARG 60 1.741 -20.367 10.650 880 H HIS 61 HN HIS 61 -1.246 -12.737 15.073 881 HA HIS 61 HA HIS 61 -0.377 -14.840 16.979 882 HD1 HIS 61 1HD HIS 61 2.115 -14.893 17.632 883 HD2 HIS 61 2HD HIS 61 2.080 -11.143 15.706 884 HE1 HIS 61 1HE HIS 61 4.456 -14.532 16.634 885 HB2 HIS 61 2HB HIS 61 -0.157 -11.800 16.913 886 HB3 HIS 61 3HB HIS 61 0.243 -12.737 18.341 887 H THR 62 HN THR 62 -2.906 -12.388 16.588 888 HA THR 62 HA THR 62 -3.862 -12.743 19.355 889 HB THR 62 HB THR 62 -5.496 -10.934 18.684 890 HG1 THR 62 1HG THR 62 -3.915 -10.786 16.354 891 HG21 THR 62 3HG2 THR 62 -2.571 -10.318 18.005 892 HG22 THR 62 1HG2 THR 62 -3.325 -10.234 19.603 893 HG23 THR 62 2HG2 THR 62 -3.850 -9.127 18.327 894 H GLY 63 HN GLY 63 -4.529 -14.168 16.290 895 HA2 GLY 63 2HA GLY 63 -6.143 -15.726 15.672 896 HA3 GLY 63 3HA GLY 63 -6.778 -15.691 17.328 897 H VAL 64 HN VAL 64 -6.534 -12.563 15.894 898 HA VAL 64 HA VAL 64 -9.359 -12.123 16.101 899 HB VAL 64 HB VAL 64 -7.044 -10.518 14.963 900 HG11 VAL 64 1HG1 VAL 64 -8.609 -8.517 14.981 901 HG12 VAL 64 2HG1 VAL 64 -8.812 -9.613 13.630 902 HG13 VAL 64 3HG1 VAL 64 -9.966 -9.660 14.994 903 HG21 VAL 64 3HG2 VAL 64 -7.406 -9.172 16.943 904 HG22 VAL 64 1HG2 VAL 64 -8.939 -10.000 17.302 905 HG23 VAL 64 2HG2 VAL 64 -7.405 -10.860 17.465 906 H LYS 65 HN LYS 65 -10.751 -13.202 14.818 907 HA LYS 65 HA LYS 65 -10.402 -12.909 11.859 908 HB2 LYS 65 2HB LYS 65 -11.683 -15.176 13.425 909 HB3 LYS 65 3HB LYS 65 -11.782 -15.010 11.672 910 HG2 LYS 65 2HG LYS 65 -9.407 -15.277 11.414 911 HG3 LYS 65 3HG LYS 65 -9.129 -15.248 13.156 912 HD2 LYS 65 2HD LYS 65 -10.614 -17.393 11.587 913 HD3 LYS 65 3HD LYS 65 -8.983 -17.520 12.224 914 HE2 LYS 65 2HE LYS 65 -11.498 -17.190 13.918 915 HE3 LYS 65 3HE LYS 65 -10.672 -18.717 13.598 916 HZ1 LYS 65 3HZ LYS 65 -9.473 -16.403 14.996 917 HZ2 LYS 65 1HZ LYS 65 -8.725 -17.839 14.689 918 HZ3 LYS 65 2HZ LYS 65 -10.018 -17.781 15.706 919 HA PRO 66 HA PRO 66 -14.189 -10.735 13.268 920 HB2 PRO 66 2HB PRO 66 -13.806 -8.307 12.101 921 HB3 PRO 66 3HB PRO 66 -12.846 -8.826 13.519 922 HG2 PRO 66 2HG PRO 66 -12.052 -8.947 10.590 923 HG3 PRO 66 3HG PRO 66 -11.102 -8.311 11.969 924 HD2 PRO 66 2HD PRO 66 -10.814 -10.865 10.971 925 HD3 PRO 66 3HD PRO 66 -10.540 -10.459 12.689 926 H PHE 67 HN PHE 67 -12.979 -11.439 10.042 927 HA PHE 67 HA PHE 67 -15.347 -10.358 8.651 928 HD1 PHE 67 2HD PHE 67 -14.511 -9.028 6.175 929 HD2 PHE 67 1HD PHE 67 -11.225 -10.608 8.463 930 HE1 PHE 67 2HE PHE 67 -13.284 -6.886 5.903 931 HE2 PHE 67 1HE PHE 67 -9.972 -8.492 8.142 932 HZ PHE 67 HZ PHE 67 -11.011 -6.619 6.865 933 HB2 PHE 67 2HB PHE 67 -12.997 -12.065 7.712 934 HB3 PHE 67 3HB PHE 67 -14.229 -11.488 6.648 935 H GLN 68 HN GLN 68 -16.946 -11.636 9.979 936 HA GLN 68 HA GLN 68 -17.030 -14.473 9.553 937 HB2 GLN 68 2HB GLN 68 -17.847 -13.351 11.596 938 HB3 GLN 68 3HB GLN 68 -19.101 -12.526 10.672 939 HG2 GLN 68 2HG GLN 68 -20.186 -14.664 10.134 940 HG3 GLN 68 3HG GLN 68 -18.865 -15.530 10.939 941 HE21 GLN 68 1HE2 GLN 68 -22.088 -15.171 11.517 942 HE22 GLN 68 2HE2 GLN 68 -21.908 -14.798 13.225 943 H CYS 69 HN CYS 69 -17.972 -15.680 8.046 944 HA CYS 69 HA CYS 69 -19.174 -14.538 5.728 945 HB2 CYS 69 2HB CYS 69 -18.111 -16.707 5.606 946 HB3 CYS 69 3HB CYS 69 -19.190 -17.369 6.848 947 H LYS 70 HN LYS 70 -21.137 -13.677 5.466 948 HA LYS 70 HA LYS 70 -23.196 -13.637 7.311 949 HB2 LYS 70 2HB LYS 70 -24.668 -12.965 5.444 950 HB3 LYS 70 3HB LYS 70 -23.157 -12.086 5.468 951 HG2 LYS 70 2HG LYS 70 -23.642 -14.459 3.594 952 HG3 LYS 70 3HG LYS 70 -24.124 -12.823 3.222 953 HD2 LYS 70 2HD LYS 70 -22.164 -12.532 2.251 954 HD3 LYS 70 3HD LYS 70 -21.483 -12.382 3.858 955 HE2 LYS 70 2HE LYS 70 -20.125 -13.894 2.557 956 HE3 LYS 70 3HE LYS 70 -20.939 -14.860 3.796 957 HZ1 LYS 70 3HZ LYS 70 -21.884 -14.609 1.021 958 HZ2 LYS 70 1HZ LYS 70 -22.486 -15.607 2.203 959 HZ3 LYS 70 2HZ LYS 70 -20.987 -15.863 1.623 960 H THR 71 HN THR 71 -22.427 -16.256 5.075 961 HA THR 71 HA THR 71 -25.079 -17.556 5.551 962 HB THR 71 HB THR 71 -23.521 -19.231 3.878 963 HG1 THR 71 1HG THR 71 -22.174 -17.978 2.968 964 HG21 THR 71 3HG2 THR 71 -25.025 -18.531 2.097 965 HG22 THR 71 1HG2 THR 71 -25.544 -17.128 3.054 966 HG23 THR 71 2HG2 THR 71 -25.918 -18.778 3.610 967 H CYS 72 HN CYS 72 -21.617 -18.573 5.395 968 HA CYS 72 HA CYS 72 -22.137 -21.013 6.834 969 HB2 CYS 72 2HB CYS 72 -19.544 -19.558 6.096 970 HB3 CYS 72 3HB CYS 72 -19.633 -21.190 6.800 971 H GLN 73 HN GLN 73 -21.488 -17.761 7.871 972 HA GLN 73 HA GLN 73 -21.002 -16.804 9.917 973 HB2 GLN 73 2HB GLN 73 -21.435 -19.495 11.297 974 HB3 GLN 73 3HB GLN 73 -21.533 -17.878 11.967 975 HG2 GLN 73 2HG GLN 73 -23.505 -19.247 10.132 976 HG3 GLN 73 3HG GLN 73 -23.777 -18.564 11.729 977 HE21 GLN 73 1HE2 GLN 73 -24.475 -18.072 8.533 978 HE22 GLN 73 2HE2 GLN 73 -24.632 -16.321 8.537 979 H ARG 74 HN ARG 74 -19.150 -18.945 8.321 980 HA ARG 74 HA ARG 74 -17.069 -19.569 10.147 981 HE ARG 74 HE ARG 74 -12.757 -21.214 7.081 982 HB2 ARG 74 2HB ARG 74 -17.412 -20.659 7.929 983 HB3 ARG 74 3HB ARG 74 -16.881 -19.174 7.112 984 HG2 ARG 74 2HG ARG 74 -14.661 -19.346 8.114 985 HG3 ARG 74 3HG ARG 74 -15.201 -20.628 9.211 986 HD2 ARG 74 2HD ARG 74 -15.576 -22.116 7.233 987 HD3 ARG 74 3HD ARG 74 -14.915 -20.855 6.197 988 HH11 ARG 74 1HH2 ARG 74 -15.018 -23.255 8.846 989 HH12 ARG 74 2HH2 ARG 74 -13.734 -24.249 9.498 990 HH21 ARG 74 1HH1 ARG 74 -11.171 -22.604 7.892 991 HH22 ARG 74 2HH1 ARG 74 -11.656 -23.853 9.008 992 H LYS 75 HN LYS 75 -15.694 -18.281 11.149 993 HA LYS 75 HA LYS 75 -15.467 -15.501 10.336 994 HB2 LYS 75 2HB LYS 75 -14.322 -17.122 12.654 995 HB3 LYS 75 3HB LYS 75 -14.021 -15.401 12.418 996 HG2 LYS 75 2HG LYS 75 -16.467 -14.957 12.457 997 HG3 LYS 75 3HG LYS 75 -16.762 -16.681 12.747 998 HD2 LYS 75 2HD LYS 75 -15.488 -16.517 14.888 999 HD3 LYS 75 3HD LYS 75 -15.197 -14.798 14.567 1000 HE2 LYS 75 2HE LYS 75 -17.051 -14.966 16.105 1001 HE3 LYS 75 3HE LYS 75 -17.667 -14.407 14.541 1002 HZ1 LYS 75 3HZ LYS 75 -19.066 -16.092 15.449 1003 HZ2 LYS 75 1HZ LYS 75 -17.819 -17.174 15.554 1004 HZ3 LYS 75 2HZ LYS 75 -18.363 -16.654 14.082 1005 H PHE 76 HN PHE 76 -13.975 -14.654 9.077 1006 HA PHE 76 HA PHE 76 -11.380 -16.105 8.707 1007 HD1 PHE 76 1HD PHE 76 -11.154 -17.448 6.231 1008 HD2 PHE 76 2HD PHE 76 -14.886 -15.273 6.311 1009 HE1 PHE 76 1HE PHE 76 -12.292 -19.338 5.097 1010 HE2 PHE 76 2HE PHE 76 -16.013 -17.178 5.208 1011 HZ PHE 76 HZ PHE 76 -14.720 -19.218 4.611 1012 HB2 PHE 76 2HB PHE 76 -12.825 -14.156 6.846 1013 HB3 PHE 76 3HB PHE 76 -11.279 -14.910 6.519 1014 H SER 77 HN SER 77 -9.488 -14.692 8.305 1015 HA SER 77 HA SER 77 -9.602 -12.331 10.106 1016 HG SER 77 HG SER 77 -6.434 -14.726 9.170 1017 HB2 SER 77 2HB SER 77 -7.061 -12.583 10.013 1018 HB3 SER 77 3HB SER 77 -7.917 -13.954 10.722 1019 H ARG 78 HN ARG 78 -9.717 -12.965 6.775 1020 HA ARG 78 HA ARG 78 -8.686 -10.226 6.176 1021 HE ARG 78 HE ARG 78 -6.008 -12.679 3.240 1022 HB2 ARG 78 2HB ARG 78 -8.120 -12.646 4.404 1023 HB3 ARG 78 3HB ARG 78 -7.512 -10.994 4.247 1024 HG2 ARG 78 2HG ARG 78 -6.530 -11.503 6.700 1025 HG3 ARG 78 3HG ARG 78 -6.663 -13.179 6.142 1026 HD2 ARG 78 2HD ARG 78 -5.116 -10.868 4.926 1027 HD3 ARG 78 3HD ARG 78 -4.466 -12.285 5.769 1028 HH11 ARG 78 1HH2 ARG 78 -2.903 -12.860 4.849 1029 HH12 ARG 78 2HH2 ARG 78 -2.094 -13.294 3.346 1030 HH21 ARG 78 2HH1 ARG 78 -5.005 -13.266 1.484 1031 HH22 ARG 78 1HH1 ARG 78 -3.275 -13.581 1.422 1032 H SER 79 HN SER 79 -9.727 -9.116 4.576 1033 HA SER 79 HA SER 79 -12.429 -9.858 3.931 1034 HG SER 79 HG SER 79 -10.310 -6.647 2.603 1035 HB2 SER 79 2HB SER 79 -12.271 -7.872 2.375 1036 HB3 SER 79 3HB SER 79 -11.835 -7.522 4.055 1037 H ASP 80 HN ASP 80 -9.333 -9.932 2.095 1038 HA ASP 80 HA ASP 80 -10.424 -10.755 -0.385 1039 HB2 ASP 80 2HB ASP 80 -8.130 -11.503 -0.923 1040 HB3 ASP 80 3HB ASP 80 -8.216 -9.908 -0.172 1041 H HIS 81 HN HIS 81 -9.546 -12.693 2.488 1042 HA HIS 81 HA HIS 81 -9.949 -15.332 1.243 1043 HD1 HIS 81 1HD HIS 81 -7.534 -15.287 1.477 1044 HD2 HIS 81 2HD HIS 81 -8.058 -15.848 5.615 1045 HE1 HIS 81 1HE HIS 81 -5.348 -15.971 2.347 1046 HB2 HIS 81 2HB HIS 81 -9.948 -14.389 4.153 1047 HB3 HIS 81 3HB HIS 81 -10.268 -16.043 3.681 1048 H LEU 82 HN LEU 82 -11.965 -13.095 3.272 1049 HA LEU 82 HA LEU 82 -14.273 -14.783 3.332 1050 HG LEU 82 HG LEU 82 -16.364 -13.633 3.780 1051 HB2 LEU 82 2HB LEU 82 -13.936 -12.918 4.847 1052 HB3 LEU 82 3HB LEU 82 -14.037 -11.737 3.545 1053 HD11 LEU 82 1HD1 LEU 82 -16.100 -11.370 5.770 1054 HD12 LEU 82 2HD1 LEU 82 -15.816 -13.125 6.105 1055 HD13 LEU 82 3HD1 LEU 82 -17.395 -12.550 5.615 1056 HD21 LEU 82 3HD2 LEU 82 -16.217 -10.598 3.440 1057 HD22 LEU 82 1HD2 LEU 82 -17.688 -11.592 3.360 1058 HD23 LEU 82 2HD2 LEU 82 -16.449 -11.769 2.125 1059 H LYS 83 HN LYS 83 -13.368 -12.102 1.095 1060 HA LYS 83 HA LYS 83 -15.745 -12.242 -0.533 1061 HB2 LYS 83 2HB LYS 83 -14.115 -10.340 -0.451 1062 HB3 LYS 83 3HB LYS 83 -12.922 -11.329 -1.297 1063 HG2 LYS 83 2HG LYS 83 -14.371 -11.431 -3.283 1064 HG3 LYS 83 3HG LYS 83 -15.670 -10.591 -2.410 1065 HD2 LYS 83 2HD LYS 83 -14.204 -8.612 -2.136 1066 HD3 LYS 83 3HD LYS 83 -12.914 -9.417 -3.040 1067 HE2 LYS 83 2HE LYS 83 -15.694 -8.794 -4.139 1068 HE3 LYS 83 3HE LYS 83 -14.276 -7.762 -4.367 1069 HZ1 LYS 83 3HZ LYS 83 -14.507 -10.550 -5.285 1070 HZ2 LYS 83 1HZ LYS 83 -13.189 -9.582 -5.491 1071 HZ3 LYS 83 2HZ LYS 83 -14.612 -9.215 -6.239 1072 H THR 84 HN THR 84 -12.604 -13.953 -0.597 1073 HA THR 84 HA THR 84 -13.036 -15.318 -3.096 1074 HB THR 84 HB THR 84 -11.359 -15.892 -0.651 1075 HG1 THR 84 1HG THR 84 -10.580 -14.268 -1.645 1076 HG21 THR 84 3HG2 THR 84 -11.629 -18.098 -1.645 1077 HG22 THR 84 1HG2 THR 84 -10.004 -17.430 -1.775 1078 HG23 THR 84 2HG2 THR 84 -11.083 -17.435 -3.216 1079 H HIS 85 HN HIS 85 -13.537 -16.306 0.327 1080 HA HIS 85 HA HIS 85 -14.743 -18.826 -0.229 1081 HD1 HIS 85 1HD HIS 85 -15.636 -20.732 1.982 1082 HD2 HIS 85 2HD HIS 85 -17.280 -16.995 3.057 1083 HE1 HIS 85 1HE HIS 85 -18.014 -21.173 2.868 1084 HB2 HIS 85 2HB HIS 85 -13.953 -18.380 1.987 1085 HB3 HIS 85 3HB HIS 85 -14.889 -16.893 2.109 1086 H THR 86 HN THR 86 -16.064 -15.529 -0.046 1087 HA THR 86 HA THR 86 -18.821 -16.055 -0.019 1088 HB THR 86 HB THR 86 -17.283 -13.849 -1.436 1089 HG1 THR 86 1HG THR 86 -17.081 -13.969 0.821 1090 HG21 THR 86 3HG2 THR 86 -19.241 -12.478 -1.308 1091 HG22 THR 86 1HG2 THR 86 -20.235 -13.868 -0.792 1092 HG23 THR 86 2HG2 THR 86 -19.507 -13.822 -2.425 1093 H ARG 87 HN ARG 87 -16.512 -16.161 -2.786 1094 HA ARG 87 HA ARG 87 -18.507 -16.327 -4.871 1095 HE ARG 87 HE ARG 87 -13.325 -16.116 -6.780 1096 HB2 ARG 87 2HB ARG 87 -15.598 -17.289 -4.813 1097 HB3 ARG 87 3HB ARG 87 -16.630 -17.248 -6.246 1098 HG2 ARG 87 2HG ARG 87 -17.051 -14.775 -5.758 1099 HG3 ARG 87 3HG ARG 87 -15.757 -14.857 -4.578 1100 HD2 ARG 87 2HD ARG 87 -15.422 -15.501 -7.533 1101 HD3 ARG 87 3HD ARG 87 -15.169 -13.903 -6.841 1102 HH11 ARG 87 1HH1 ARG 87 -14.136 -13.252 -4.907 1103 HH12 ARG 87 2HH1 ARG 87 -12.474 -13.092 -4.346 1104 HH21 ARG 87 1HH2 ARG 87 -11.410 -15.907 -6.016 1105 HH22 ARG 87 2HH2 ARG 87 -11.009 -14.733 -4.746 1106 H THR 88 HN THR 88 -17.290 -18.641 -2.567 1107 HA THR 88 HA THR 88 -17.909 -21.138 -3.818 1108 HB THR 88 HB THR 88 -18.512 -20.557 -0.896 1109 HG1 THR 88 1HG THR 88 -16.638 -19.818 -0.972 1110 HG21 THR 88 3HG2 THR 88 -17.512 -23.016 -2.363 1111 HG22 THR 88 1HG2 THR 88 -19.107 -22.802 -1.616 1112 HG23 THR 88 2HG2 THR 88 -17.659 -22.871 -0.597 1113 H HIS 89 HN HIS 89 -20.040 -18.777 -2.123 1114 HA HIS 89 HA HIS 89 -22.426 -20.493 -2.572 1115 HD1 HIS 89 1HD HIS 89 -20.336 -17.254 -0.393 1116 HD2 HIS 89 2HD HIS 89 -22.825 -20.310 1.068 1117 HE1 HIS 89 1HE HIS 89 -19.596 -17.688 2.017 1118 HB2 HIS 89 2HB HIS 89 -22.610 -17.640 -1.650 1119 HB3 HIS 89 3HB HIS 89 -23.584 -19.019 -1.193 1120 H THR 90 HN THR 90 -20.710 -17.860 -4.078 1121 HA THR 90 HA THR 90 -23.079 -16.827 -5.474 1122 HB THR 90 HB THR 90 -20.200 -15.989 -5.935 1123 HG1 THR 90 1HG THR 90 -20.636 -15.927 -3.635 1124 HG21 THR 90 3HG2 THR 90 -21.157 -13.727 -6.196 1125 HG22 THR 90 1HG2 THR 90 -22.788 -14.401 -6.000 1126 HG23 THR 90 2HG2 THR 90 -21.790 -14.842 -7.407 1127 H GLY 91 HN GLY 91 -20.834 -19.340 -6.104 1128 HA2 GLY 91 2HA GLY 91 -20.465 -20.634 -7.994 1129 HA3 GLY 91 3HA GLY 91 -21.891 -19.876 -8.727 1130 H GLU 92 HN GLU 92 -19.456 -17.658 -7.675 1131 HA GLU 92 HA GLU 92 -19.110 -16.758 -10.416 1132 HB2 GLU 92 2HB GLU 92 -19.429 -15.268 -8.432 1133 HB3 GLU 92 3HB GLU 92 -17.840 -15.717 -7.836 1134 HG2 GLU 92 2HG GLU 92 -16.804 -14.730 -9.867 1135 HG3 GLU 92 3HG GLU 92 -18.408 -14.386 -10.528 1136 H LYS 93 HN LYS 93 -17.874 -18.223 -11.583 1137 HA LYS 93 HA LYS 93 -15.033 -18.536 -10.676 1138 HB2 LYS 93 2HB LYS 93 -16.674 -20.476 -12.370 1139 HB3 LYS 93 3HB LYS 93 -14.986 -20.667 -11.888 1140 HG2 LYS 93 2HG LYS 93 -15.894 -20.501 -9.447 1141 HG3 LYS 93 3HG LYS 93 -17.478 -20.809 -10.158 1142 HD2 LYS 93 2HD LYS 93 -15.007 -22.583 -10.346 1143 HD3 LYS 93 3HD LYS 93 -16.409 -22.871 -9.315 1144 HE2 LYS 93 2HE LYS 93 -17.853 -23.226 -11.231 1145 HE3 LYS 93 3HE LYS 93 -16.576 -22.707 -12.350 1146 HZ1 LYS 93 3HZ LYS 93 -15.273 -24.562 -11.722 1147 HZ2 LYS 93 1HZ LYS 93 -16.749 -25.105 -12.220 1148 HZ3 LYS 93 2HZ LYS 93 -16.385 -25.073 -10.611 1149 HA PRO 94 HA PRO 94 -15.081 -16.241 -14.652 1150 HB2 PRO 94 2HB PRO 94 -13.441 -14.166 -14.005 1151 HB3 PRO 94 3HB PRO 94 -15.120 -14.267 -13.397 1152 HG2 PRO 94 2HG PRO 94 -12.569 -15.063 -11.959 1153 HG3 PRO 94 3HG PRO 94 -13.920 -14.061 -11.343 1154 HD2 PRO 94 2HD PRO 94 -13.674 -16.751 -10.859 1155 HD3 PRO 94 3HD PRO 94 -15.261 -15.932 -10.964 1156 H PHE 95 HN PHE 95 -12.428 -17.628 -12.765 1157 HA PHE 95 HA PHE 95 -10.376 -17.066 -14.809 1158 HD1 PHE 95 2HD PHE 95 -8.136 -16.070 -13.520 1159 HD2 PHE 95 1HD PHE 95 -11.047 -17.412 -10.657 1160 HE1 PHE 95 2HE PHE 95 -7.713 -14.041 -12.148 1161 HE2 PHE 95 1HE PHE 95 -10.627 -15.378 -9.275 1162 HZ PHE 95 HZ PHE 95 -8.960 -13.698 -10.023 1163 HB2 PHE 95 2HB PHE 95 -10.299 -18.899 -12.367 1164 HB3 PHE 95 3HB PHE 95 -8.936 -18.458 -13.380 1165 H SER 96 HN SER 96 -11.654 -18.033 -16.614 1166 HA SER 96 HA SER 96 -11.904 -20.950 -16.714 1167 HG SER 96 HG SER 96 -11.086 -18.757 -19.339 1168 HB2 SER 96 2HB SER 96 -12.586 -20.554 -19.049 1169 HB3 SER 96 3HB SER 96 -13.455 -19.467 -17.945 1170 H CYS 97 HN CYS 97 -10.654 -22.419 -17.839 1171 HA CYS 97 HA CYS 97 -7.877 -21.793 -18.231 1172 HB2 CYS 97 2HB CYS 97 -8.900 -24.059 -17.633 1173 HB3 CYS 97 3HB CYS 97 -9.404 -24.186 -19.315 1174 H ARG 98 HN ARG 98 -6.680 -22.182 -20.258 1175 HA ARG 98 HA ARG 98 -8.167 -21.096 -22.623 1176 HE ARG 98 HE ARG 98 -7.976 -18.421 -18.575 1177 HB2 ARG 98 2HB ARG 98 -5.322 -20.346 -21.777 1178 HB3 ARG 98 3HB ARG 98 -6.225 -19.728 -23.156 1179 HG2 ARG 98 2HG ARG 98 -6.588 -17.988 -21.744 1180 HG3 ARG 98 3HG ARG 98 -7.976 -18.977 -21.294 1181 HD2 ARG 98 2HD ARG 98 -6.468 -19.937 -19.412 1182 HD3 ARG 98 3HD ARG 98 -5.311 -18.677 -19.822 1183 HH11 ARG 98 1HH2 ARG 98 -5.223 -16.605 -19.823 1184 HH12 ARG 98 2HH2 ARG 98 -5.750 -15.120 -19.055 1185 HH21 ARG 98 1HH1 ARG 98 -8.579 -16.518 -17.675 1186 HH22 ARG 98 2HH1 ARG 98 -7.605 -15.071 -17.865 1187 H TRP 99 HN TRP 99 -6.816 -23.807 -21.503 1188 HA TRP 99 HA TRP 99 -4.831 -24.484 -23.470 1189 HD1 TRP 99 1HD TRP 99 -4.741 -24.073 -20.253 1190 HE1 TRP 99 1HE TRP 99 -2.408 -24.497 -19.299 1191 HE3 TRP 99 3HE TRP 99 -3.645 -28.415 -22.728 1192 HZ2 TRP 99 2HZ TRP 99 -0.285 -26.419 -19.637 1193 HZ3 TRP 99 3HZ TRP 99 -1.445 -29.516 -22.399 1194 HH2 TRP 99 2HH TRP 99 0.245 -28.524 -20.876 1195 HB2 TRP 99 2HB TRP 99 -6.529 -26.006 -21.484 1196 HB3 TRP 99 3HB TRP 99 -5.672 -26.901 -22.723 1197 HA PRO 100 HA PRO 100 -7.135 -25.127 -27.069 1198 HB2 PRO 100 2HB PRO 100 -5.829 -27.237 -28.323 1199 HB3 PRO 100 3HB PRO 100 -5.137 -25.608 -28.108 1200 HG2 PRO 100 2HG PRO 100 -4.710 -28.048 -26.356 1201 HG3 PRO 100 3HG PRO 100 -3.468 -26.962 -27.065 1202 HD2 PRO 100 2HD PRO 100 -4.297 -26.632 -24.523 1203 HD3 PRO 100 3HD PRO 100 -4.034 -25.201 -25.567 1204 H SER 101 HN SER 101 -7.552 -27.290 -24.586 1205 HA SER 101 HA SER 101 -9.832 -28.573 -25.953 1206 HG SER 101 HG SER 101 -8.286 -30.366 -23.405 1207 HB2 SER 101 2HB SER 101 -9.220 -30.814 -25.392 1208 HB3 SER 101 3HB SER 101 -7.799 -30.114 -26.183 1209 H CYS 102 HN CYS 102 -9.468 -26.487 -23.836 1210 HA CYS 102 HA CYS 102 -11.134 -27.795 -21.756 1211 HB2 CYS 102 2HB CYS 102 -8.771 -27.952 -20.960 1212 HB3 CYS 102 3HB CYS 102 -8.637 -26.182 -21.097 1213 H GLN 103 HN GLN 103 -12.409 -26.393 -20.556 1214 HA GLN 103 HA GLN 103 -12.154 -23.494 -20.924 1215 HB2 GLN 103 2HB GLN 103 -14.644 -25.039 -21.770 1216 HB3 GLN 103 3HB GLN 103 -14.728 -23.345 -21.305 1217 HG2 GLN 103 2HG GLN 103 -13.084 -24.383 -23.634 1218 HG3 GLN 103 3HG GLN 103 -14.650 -23.593 -23.721 1219 HE21 GLN 103 1HE2 GLN 103 -11.206 -23.070 -23.003 1220 HE22 GLN 103 2HE2 GLN 103 -11.326 -21.298 -23.043 1221 H LYS 104 HN LYS 104 -11.814 -25.640 -18.815 1222 HA LYS 104 HA LYS 104 -14.059 -25.467 -16.957 1223 HB2 LYS 104 2HB LYS 104 -11.158 -26.376 -16.643 1224 HB3 LYS 104 3HB LYS 104 -12.364 -26.465 -15.353 1225 HG2 LYS 104 2HG LYS 104 -13.830 -27.868 -16.763 1226 HG3 LYS 104 3HG LYS 104 -12.648 -27.843 -18.072 1227 HD2 LYS 104 2HD LYS 104 -12.104 -28.935 -15.281 1228 HD3 LYS 104 3HD LYS 104 -12.643 -29.929 -16.633 1229 HE2 LYS 104 2HE LYS 104 -10.100 -28.258 -16.715 1230 HE3 LYS 104 3HE LYS 104 -10.152 -29.949 -16.162 1231 HZ1 LYS 104 3HZ LYS 104 -11.114 -30.452 -18.395 1232 HZ2 LYS 104 1HZ LYS 104 -9.549 -29.901 -18.417 1233 HZ3 LYS 104 2HZ LYS 104 -10.745 -28.883 -18.819 1234 H LYS 105 HN LYS 105 -14.243 -24.228 -15.096 1235 HA LYS 105 HA LYS 105 -12.488 -21.818 -15.109 1236 HB2 LYS 105 2HB LYS 105 -15.429 -21.800 -14.347 1237 HB3 LYS 105 3HB LYS 105 -14.353 -20.462 -14.793 1238 HG2 LYS 105 2HG LYS 105 -14.199 -21.564 -17.110 1239 HG3 LYS 105 3HG LYS 105 -15.566 -22.570 -16.605 1240 HD2 LYS 105 2HD LYS 105 -16.857 -20.442 -16.143 1241 HD3 LYS 105 3HD LYS 105 -15.522 -19.532 -16.860 1242 HE2 LYS 105 2HE LYS 105 -17.247 -21.653 -18.218 1243 HE3 LYS 105 3HE LYS 105 -17.295 -19.909 -18.515 1244 HZ1 LYS 105 3HZ LYS 105 -15.045 -21.723 -19.115 1245 HZ2 LYS 105 1HZ LYS 105 -15.019 -20.083 -19.343 1246 HZ3 LYS 105 2HZ LYS 105 -16.050 -21.026 -20.212 1247 H PHE 106 HN PHE 106 -11.901 -20.853 -13.259 1248 HA PHE 106 HA PHE 106 -12.693 -22.224 -10.701 1249 HD1 PHE 106 1HD PHE 106 -10.721 -24.235 -9.792 1250 HD2 PHE 106 2HD PHE 106 -9.653 -22.251 -13.468 1251 HE1 PHE 106 1HE PHE 106 -10.359 -26.431 -10.890 1252 HE2 PHE 106 2HE PHE 106 -9.353 -24.441 -14.574 1253 HZ PHE 106 HZ PHE 106 -9.725 -26.539 -13.289 1254 HB2 PHE 106 2HB PHE 106 -9.992 -20.962 -11.383 1255 HB3 PHE 106 3HB PHE 106 -10.430 -21.771 -9.879 1256 H ALA 107 HN ALA 107 -12.414 -20.802 -8.739 1257 HA ALA 107 HA ALA 107 -13.375 -18.070 -9.414 1258 HB1 ALA 107 1HB ALA 107 -14.791 -19.470 -7.905 1259 HB2 ALA 107 2HB ALA 107 -13.433 -19.619 -6.773 1260 HB3 ALA 107 3HB ALA 107 -14.186 -18.039 -7.078 1261 H ARG 108 HN ARG 108 -10.464 -19.529 -8.878 1262 HA ARG 108 HA ARG 108 -9.342 -17.053 -7.656 1263 HE ARG 108 HE ARG 108 -7.278 -19.522 -4.638 1264 HB2 ARG 108 2HB ARG 108 -8.746 -19.921 -6.886 1265 HB3 ARG 108 3HB ARG 108 -7.699 -18.574 -6.459 1266 HG2 ARG 108 2HG ARG 108 -9.311 -17.618 -5.010 1267 HG3 ARG 108 3HG ARG 108 -10.638 -18.573 -5.687 1268 HD2 ARG 108 2HD ARG 108 -9.987 -19.415 -3.497 1269 HD3 ARG 108 3HD ARG 108 -9.789 -20.621 -4.765 1270 HH11 ARG 108 2HH1 ARG 108 -9.374 -20.670 -2.103 1271 HH12 ARG 108 1HH1 ARG 108 -8.032 -21.291 -1.158 1272 HH21 ARG 108 2HH2 ARG 108 -5.632 -20.391 -3.515 1273 HH22 ARG 108 1HH2 ARG 108 -5.930 -21.178 -1.968 1274 H SER 109 HN SER 109 -7.535 -16.308 -8.610 1275 HA SER 109 HA SER 109 -6.777 -17.161 -11.189 1276 HG SER 109 HG SER 109 -5.684 -14.540 -8.569 1277 HB2 SER 109 2HB SER 109 -4.717 -15.716 -10.741 1278 HB3 SER 109 3HB SER 109 -6.270 -14.912 -10.503 1279 H ASP 110 HN ASP 110 -5.267 -17.800 -7.992 1280 HA ASP 110 HA ASP 110 -3.076 -19.329 -9.040 1281 HB2 ASP 110 2HB ASP 110 -2.878 -20.140 -6.673 1282 HB3 ASP 110 3HB ASP 110 -2.815 -18.406 -6.905 1283 H GLU 111 HN GLU 111 -6.436 -20.217 -8.123 1284 HA GLU 111 HA GLU 111 -6.072 -23.096 -8.129 1285 HB2 GLU 111 2HB GLU 111 -8.473 -21.274 -8.518 1286 HB3 GLU 111 3HB GLU 111 -8.569 -22.967 -8.921 1287 HG2 GLU 111 2HG GLU 111 -7.892 -23.627 -6.664 1288 HG3 GLU 111 3HG GLU 111 -7.895 -21.938 -6.161 1289 H LEU 112 HN LEU 112 -6.814 -20.652 -10.675 1290 HA LEU 112 HA LEU 112 -7.003 -22.576 -12.824 1291 HG LEU 112 HG LEU 112 -5.538 -20.721 -14.945 1292 HB2 LEU 112 2HB LEU 112 -7.884 -20.328 -13.038 1293 HB3 LEU 112 3HB LEU 112 -6.278 -19.610 -12.860 1294 HD11 LEU 112 1HD1 LEU 112 -8.450 -21.570 -15.321 1295 HD12 LEU 112 2HD1 LEU 112 -7.113 -22.687 -14.932 1296 HD13 LEU 112 3HD1 LEU 112 -7.085 -21.801 -16.421 1297 HD21 LEU 112 3HD2 LEU 112 -6.722 -19.350 -16.514 1298 HD22 LEU 112 1HD2 LEU 112 -6.501 -18.434 -15.014 1299 HD23 LEU 112 2HD2 LEU 112 -8.088 -19.148 -15.408 1300 H VAL 113 HN VAL 113 -4.240 -20.529 -11.627 1301 HA VAL 113 HA VAL 113 -2.237 -21.497 -13.347 1302 HB VAL 113 HB VAL 113 -2.001 -20.809 -10.378 1303 HG11 VAL 113 1HG1 VAL 113 0.181 -21.030 -12.483 1304 HG12 VAL 113 2HG1 VAL 113 0.387 -20.305 -10.873 1305 HG13 VAL 113 3HG1 VAL 113 0.007 -22.020 -11.018 1306 HG21 VAL 113 3HG2 VAL 113 -2.825 -18.926 -11.928 1307 HG22 VAL 113 1HG2 VAL 113 -1.358 -18.600 -10.995 1308 HG23 VAL 113 2HG2 VAL 113 -1.265 -19.029 -12.716 1309 H ARG 114 HN ARG 114 -3.455 -22.923 -10.322 1310 HA ARG 114 HA ARG 114 -1.672 -25.196 -10.269 1311 HE ARG 114 HE ARG 114 -2.125 -25.772 -6.630 1312 HB2 ARG 114 2HB ARG 114 -2.954 -24.553 -8.303 1313 HB3 ARG 114 3HB ARG 114 -4.491 -24.867 -9.119 1314 HG2 ARG 114 2HG ARG 114 -4.023 -27.236 -9.314 1315 HG3 ARG 114 3HG ARG 114 -2.352 -27.021 -8.775 1316 HD2 ARG 114 2HD ARG 114 -4.817 -26.476 -7.078 1317 HD3 ARG 114 3HD ARG 114 -3.888 -27.991 -7.075 1318 HH11 ARG 114 1HH2 ARG 114 -4.568 -27.684 -4.930 1319 HH12 ARG 114 2HH2 ARG 114 -3.908 -27.266 -3.374 1320 HH21 ARG 114 2HH1 ARG 114 -1.344 -25.287 -4.558 1321 HH22 ARG 114 1HH1 ARG 114 -2.280 -25.904 -3.189 1322 H HIS 115 HN HIS 115 -5.052 -24.829 -11.529 1323 HA HIS 115 HA HIS 115 -5.388 -27.377 -12.586 1324 HD1 HIS 115 1HD HIS 115 -7.321 -28.465 -13.841 1325 HD2 HIS 115 2HD HIS 115 -7.049 -25.018 -16.250 1326 HE1 HIS 115 1HE HIS 115 -7.980 -29.143 -16.221 1327 HB2 HIS 115 2HB HIS 115 -7.169 -25.742 -12.603 1328 HB3 HIS 115 3HB HIS 115 -6.314 -24.709 -13.746 1329 H HIS 116 HN HIS 116 -3.915 -24.552 -14.285 1330 HA HIS 116 HA HIS 116 -3.234 -25.890 -16.683 1331 HD1 HIS 116 1HD HIS 116 -4.838 -24.325 -17.625 1332 HD2 HIS 116 2HD HIS 116 -2.326 -21.198 -16.265 1333 HE1 HIS 116 1HE HIS 116 -5.837 -22.188 -18.422 1334 HB2 HIS 116 2HB HIS 116 -1.834 -23.627 -15.208 1335 HB3 HIS 116 3HB HIS 116 -1.416 -24.154 -16.830 1336 H ASN 117 HN ASN 117 -1.584 -25.828 -13.494 1337 HA ASN 117 HA ASN 117 0.905 -26.997 -14.444 1338 HB2 ASN 117 2HB ASN 117 0.357 -25.660 -12.243 1339 HB3 ASN 117 3HB ASN 117 -0.119 -27.225 -11.590 1340 HD21 ASN 117 1HD2 ASN 117 1.966 -28.873 -12.815 1341 HD22 ASN 117 2HD2 ASN 117 3.473 -28.275 -12.074 1342 H MET 118 HN MET 118 -2.262 -28.276 -13.749 1343 HA MET 118 HA MET 118 -1.175 -31.064 -13.574 1344 HB2 MET 118 2HB MET 118 -3.966 -29.997 -12.984 1345 HB3 MET 118 3HB MET 118 -3.429 -31.667 -12.763 1346 HG2 MET 118 2HG MET 118 -1.748 -30.880 -11.097 1347 HG3 MET 118 3HG MET 118 -2.398 -29.252 -11.236 1348 HE1 MET 118 3HE MET 118 -5.710 -30.147 -11.450 1349 HE2 MET 118 1HE MET 118 -6.056 -29.717 -9.763 1350 HE3 MET 118 2HE MET 118 -4.985 -28.685 -10.741 1351 H HIS 119 HN HIS 119 -2.171 -28.895 -15.899 1352 HA HIS 119 HA HIS 119 -4.216 -30.363 -17.255 1353 HD1 HIS 119 1HD HIS 119 -4.569 -30.257 -20.105 1354 HD2 HIS 119 2HD HIS 119 -5.503 -26.769 -17.964 1355 HE1 HIS 119 1HE HIS 119 -7.030 -29.637 -20.679 1356 HB2 HIS 119 2HB HIS 119 -3.291 -27.844 -17.404 1357 HB3 HIS 119 3HB HIS 119 -2.446 -28.505 -18.803 Start of MODEL 2 1 H5 DC 124 5H C 124 -3.980 -31.163 -5.025 2 H6 DC 124 6H C 124 -5.896 -30.876 -6.520 3 H5' DC 124 H5' C 124 -9.031 -32.523 -9.777 4 H5'' DC 124 H5" C 124 -7.547 -32.272 -8.840 5 H4' DC 124 H4' C 124 -10.355 -32.444 -7.725 6 H3' DC 124 H3' C 124 -9.122 -30.268 -8.994 7 H2' DC 124 H2' C 124 -7.391 -29.976 -7.473 8 H2'' DC 124 H2" C 124 -8.613 -29.008 -6.602 9 H1' DC 124 H1' C 124 -9.388 -30.828 -5.305 10 H41 DC 124 1H4 C 124 -4.469 -32.312 -1.564 11 H42 DC 124 2H4 C 124 -3.327 -31.919 -2.834 12 H8 DG 125 8H G 125 -9.105 -26.907 -5.692 13 H1 DG 125 1H G 125 -6.400 -29.088 -0.249 14 H5' DG 125 H5' G 125 -12.920 -29.653 -6.348 15 H5'' DG 125 H5" G 125 -13.982 -28.313 -6.840 16 H4' DG 125 H4' G 125 -13.836 -28.548 -4.365 17 H3' DG 125 H3' G 125 -13.498 -26.118 -5.764 18 H2' DG 125 H2' G 125 -11.163 -26.030 -5.432 19 H2'' DG 125 H2" G 125 -11.667 -25.221 -3.924 20 H1' DG 125 H1' G 125 -11.551 -27.290 -2.662 21 H21 DG 125 1H2 G 125 -7.914 -29.331 1.294 22 H22 DG 125 2H2 G 125 -9.615 -29.026 0.980 23 H5 DC 126 5H C 126 -8.100 -23.994 -4.296 24 H6 DC 126 6H C 126 -10.054 -23.569 -2.899 25 H5' DC 126 H5' C 126 -13.617 -26.211 -1.065 26 H5'' DC 126 H5" C 126 -14.620 -24.885 -0.432 27 H4' DC 126 H4' C 126 -12.623 -25.183 0.979 28 H3' DC 126 H3' C 126 -13.334 -22.670 -0.234 29 H2' DC 126 H2' C 126 -11.396 -22.698 -1.600 30 H2'' DC 126 H2" C 126 -10.679 -21.925 -0.172 31 H1' DC 126 H1' C 126 -10.105 -24.186 0.783 32 H41 DC 126 1H4 C 126 -5.087 -25.519 -2.922 33 H42 DC 126 2H4 C 126 -5.926 -24.957 -4.348 34 H8 DG 127 8H G 127 -9.632 -21.785 1.578 35 H1 DG 127 1H G 127 -3.362 -22.913 0.693 36 H5' DG 127 H5' G 127 -12.063 -23.666 3.867 37 H5'' DG 127 H5" G 127 -12.569 -22.640 5.232 38 H4' DG 127 H4' G 127 -10.473 -23.705 5.828 39 H3' DG 127 H3' G 127 -10.697 -20.872 5.711 40 H2' DG 127 H2' G 127 -9.168 -20.505 4.034 41 H2'' DG 127 H2" G 127 -7.936 -20.776 5.303 42 H1' DG 127 H1' G 127 -7.592 -22.982 4.670 43 H21 DG 127 1H2 G 127 -2.421 -23.378 2.615 44 H22 DG 127 2H2 G 127 -3.316 -23.261 4.118 45 H8 DG 128 8H G 128 -7.457 -18.633 4.192 46 H1 DG 128 1H G 128 -2.658 -19.714 0.061 47 H5' DG 128 H5' G 128 -6.766 -21.909 7.643 48 H5'' DG 128 H5" G 128 -6.622 -21.050 9.187 49 H4' DG 128 H4' G 128 -4.547 -20.718 8.044 50 H3' DG 128 H3' G 128 -6.182 -18.478 8.618 51 H2' DG 128 H2' G 128 -6.790 -18.102 6.357 52 H2'' DG 128 H2" G 128 -5.301 -17.085 6.455 53 H1' DG 128 H1' G 128 -3.907 -19.001 5.779 54 H21 DG 128 1H2 G 128 -0.817 -19.989 1.124 55 H22 DG 128 2H2 G 128 -0.762 -20.072 2.874 56 H8 DG 129 8H G 129 -3.489 -16.319 5.641 57 H1 DG 129 1H G 129 -1.118 -16.470 -0.324 58 H5' DG 129 H5' G 129 -1.606 -18.346 8.677 59 H5'' DG 129 H5" G 129 -0.974 -17.335 9.959 60 H4' DG 129 H4' G 129 0.669 -17.311 8.181 61 H3' DG 129 H3' G 129 -0.689 -14.840 8.750 62 H2' DG 129 H2' G 129 -1.876 -14.805 6.771 63 H2'' DG 129 H2" G 129 -0.403 -14.054 6.121 64 H1' DG 129 H1' G 129 0.429 -16.181 5.338 65 H21 DG 129 1H2 G 129 1.064 -16.504 -0.262 66 H22 DG 129 2H2 G 129 1.951 -16.525 1.253 67 H8 DG 130 8H G 130 0.606 -13.516 4.202 68 H1 DG 130 1H G 130 -0.635 -12.754 -2.019 69 H5' DG 130 H5' G 130 2.952 -15.490 5.586 70 H5'' DG 130 H5" G 130 4.033 -14.603 6.662 71 H4' DG 130 H4' G 130 5.095 -14.412 4.628 72 H3' DG 130 H3' G 130 4.128 -12.099 5.833 73 H2' DG 130 H2' G 130 2.300 -11.756 4.448 74 H2'' DG 130 H2" G 130 3.494 -10.934 3.447 75 H1' DG 130 H1' G 130 3.683 -12.714 1.943 76 H21 DG 130 1H2 G 130 1.177 -12.371 -3.147 77 H22 DG 130 2H2 G 130 2.734 -12.184 -2.352 78 H8 DG 131 8H G 131 2.645 -9.562 2.350 79 H1 DG 131 1H G 131 -1.901 -9.406 -2.157 80 H5' DG 131 H5' G 131 5.995 -11.737 1.665 81 H5'' DG 131 H5" G 131 7.394 -10.659 1.845 82 H4' DG 131 H4' G 131 6.639 -10.318 -0.380 83 H3' DG 131 H3' G 131 6.563 -8.182 1.478 84 H2' DG 131 H2' G 131 4.272 -8.119 1.659 85 H2'' DG 131 H2" G 131 4.397 -7.058 0.255 86 H1' DG 131 H1' G 131 3.901 -8.866 -1.276 87 H21 DG 131 1H2 G 131 -1.046 -8.994 -4.121 88 H22 DG 131 2H2 G 131 0.666 -8.651 -4.322 89 H5 DC 132 5H C 132 1.330 -6.444 1.601 90 H6 DC 132 6H C 132 2.802 -5.731 -0.213 91 H5' DC 132 H5' C 132 5.163 -7.663 -2.757 92 H5'' DC 132 H5" C 132 6.261 -6.474 -3.472 93 H4' DC 132 H4' C 132 4.251 -6.157 -4.628 94 H3' DC 132 H3' C 132 5.217 -4.071 -2.939 95 H2' DC 132 H2' C 132 3.457 -4.107 -1.465 96 H2'' DC 132 H2" C 132 2.646 -3.139 -2.700 97 H1' DC 132 H1' C 132 1.547 -5.043 -3.664 98 H41 DC 132 1H4 C 132 -2.318 -6.565 1.125 99 H42 DC 132 2H4 C 132 -0.983 -6.878 2.214 100 H8 DG 133 8H G 133 1.238 -1.809 -3.089 101 H1 DG 133 1H G 133 -4.907 -2.852 -1.551 102 H5' DG 133 H5' G 133 2.611 -3.329 -6.658 103 H5'' DG 133 H5" G 133 3.288 -1.933 -7.518 104 H4' DG 133 H4' G 133 0.932 -2.052 -8.011 105 H3' DG 133 H3' G 133 2.068 0.259 -6.872 106 H2' DG 133 H2' G 133 1.231 -0.150 -4.711 107 H2'' DG 133 H2" G 133 -0.136 0.793 -5.326 108 H1' DG 133 H1' G 133 -1.371 -1.222 -5.936 109 H21 DG 133 1H2 G 133 -6.196 -2.386 -3.212 110 H22 DG 133 2H2 G 133 -5.569 -1.847 -4.754 111 H5' DT 134 H5' T 134 -2.421 -0.111 -7.328 112 H5'' DT 134 H5" T 134 -2.836 1.108 -8.538 113 H4' DT 134 H4' T 134 -4.760 1.071 -7.153 114 H3' DT 134 H3' T 134 -3.102 3.355 -7.262 115 H2' DT 134 H2' T 134 -2.241 3.107 -5.141 116 H2'' DT 134 H2" T 134 -3.666 4.076 -4.744 117 H1' DT 134 H1' T 134 -5.036 2.073 -4.320 118 H3 DT 134 3H T 134 -4.179 0.329 -0.207 119 H71 DT 134 1H7 T 134 0.301 2.009 -0.711 120 H72 DT 134 2H7 T 134 0.522 0.363 -1.348 121 H73 DT 134 3H7 T 134 0.579 1.757 -2.451 122 H6 DT 134 6H T 134 -1.348 1.960 -3.752 123 H5 DC 135 5H C 135 -3.642 4.942 -2.785 124 H6 DC 135 6H C 135 -5.515 5.292 -4.324 125 H5' DC 135 H5' C 135 -7.459 3.627 -7.385 126 H5'' DC 135 H5" C 135 -8.224 5.033 -8.147 127 H4' DC 135 H4' C 135 -9.597 4.282 -6.301 128 H3' DC 135 H3' C 135 -8.644 6.928 -6.469 129 H2' DC 135 H2' C 135 -7.062 6.641 -4.798 130 H2'' DC 135 H2" C 135 -8.380 7.178 -3.780 131 H1' DC 135 H1' C 135 -9.068 4.888 -3.270 132 H41 DC 135 1H4 C 135 -4.144 3.398 0.492 133 H42 DC 135 2H4 C 135 -3.008 3.998 -0.687 134 H5' DT 136 H5' T 136 -10.998 5.357 -2.628 135 H5'' DT 136 H5" T 136 -12.468 6.261 -3.004 136 H4' DT 136 H4' T 136 -12.566 6.066 -0.699 137 H3' DT 136 H3' T 136 -12.285 8.636 -1.783 138 H2' DT 136 H2' T 136 -10.124 9.019 -1.274 139 H2'' DT 136 H2" T 136 -10.703 9.489 0.286 140 H1' DT 136 H1' T 136 -10.277 7.427 1.329 141 H3 DT 136 3H T 136 -5.895 6.607 1.860 142 H71 DT 136 1H7 T 136 -5.250 7.591 -2.767 143 H72 DT 136 2H7 T 136 -6.649 8.634 -3.106 144 H73 DT 136 3H7 T 136 -5.304 9.246 -2.117 145 H6 DT 136 6H T 136 -8.524 8.058 -1.875 146 H8 DG 137 8H G 137 -9.688 10.388 1.750 147 H1 DG 137 1H G 137 -3.791 9.328 4.020 148 H5' DG 137 H5' G 137 -12.134 7.484 2.440 149 H5'' DG 137 H5" G 137 -13.626 8.194 3.061 150 H4' DG 137 H4' G 137 -12.363 7.896 4.980 151 H3' DG 137 H3' G 137 -13.014 10.511 4.213 152 H2' DG 137 H2' G 137 -10.943 11.055 3.390 153 H2'' DG 137 H2" G 137 -10.626 11.539 5.033 154 H1' DG 137 H1' G 137 -9.431 9.514 5.533 155 H21 DG 137 1H2 G 137 -3.868 8.787 6.126 156 H22 DG 137 2H2 G 137 -5.390 8.726 7.004 157 H5 DC 138 5H C 138 -8.593 13.020 4.026 158 H6 DC 138 6H C 138 -9.178 12.286 6.282 159 H5' DC 138 H5' C 138 -10.331 9.216 7.650 160 H5'' DC 138 H5" C 138 -11.296 9.755 9.033 161 H4' DC 138 H4' C 138 -9.119 9.574 9.867 162 H3' DC 138 H3' C 138 -10.412 12.054 9.906 163 H2' DC 138 H2' C 138 -9.237 13.060 8.221 164 H2'' DC 138 H2" C 138 -8.088 13.444 9.472 165 H1' DC 138 H1' C 138 -6.618 11.672 8.921 166 H41 DC 138 1H4 C 138 -5.091 13.250 2.974 167 H42 DC 138 2H4 C 138 -6.774 13.378 2.512 168 H8 DG 139 8H G 139 -6.417 14.616 9.669 169 H1 DG 139 1H G 139 -2.160 15.817 5.041 170 H5' DG 139 H5' G 139 -6.185 11.136 11.093 171 H5'' DG 139 H5" G 139 -6.269 11.368 12.840 172 H4' DG 139 H4' G 139 -3.997 11.466 12.348 173 H3' DG 139 H3' G 139 -5.198 13.677 13.523 174 H2' DG 139 H2' G 139 -5.334 14.992 11.631 175 H2'' DG 139 H2" G 139 -3.715 15.497 12.100 176 H1' DG 139 H1' G 139 -2.667 14.044 10.567 177 H21 DG 139 1H2 G 139 -0.151 15.353 5.709 178 H22 DG 139 2H2 G 139 0.177 14.868 7.367 179 H5 DC 140 5H C 140 -4.183 17.635 10.540 180 H6 DC 140 6H C 140 -2.157 16.907 11.697 181 H5' DC 140 H5' C 140 -0.770 13.405 12.197 182 H5'' DC 140 H5" C 140 0.147 13.759 13.665 183 H4' DC 140 H4' C 140 1.522 14.202 11.734 184 H3' DC 140 H3' C 140 1.235 16.047 13.776 185 H2' DC 140 H2' C 140 -0.330 17.422 12.699 186 H2'' DC 140 H2" C 140 1.162 18.219 12.122 187 H1' DC 140 H1' C 140 1.208 16.988 10.092 188 H41 DC 140 1H4 C 140 -4.028 18.980 7.143 189 H42 DC 140 2H4 C 140 -5.040 18.508 8.489 190 H8 DG 141 8H G 141 -3.437 21.678 0.932 191 H1 DG 141 1H G 141 -1.609 18.754 6.343 192 H5' DG 141 H5' G 141 -0.778 24.588 -0.764 193 H5'' DG 141 H5" G 141 -1.057 23.813 -2.332 194 H4' DG 141 H4' G 141 0.850 22.885 -0.953 195 H3' DG 141 H3' G 141 -0.911 21.407 -2.544 196 H2' DG 141 H2' G 141 -2.198 20.605 -0.791 197 H2'' DG 141 H2" G 141 -0.995 19.310 -0.778 198 H1' DG 141 H1' G 141 0.243 20.354 1.005 199 H21 DG 141 1H2 G 141 0.516 18.329 6.310 200 H22 DG 141 2H2 G 141 1.498 18.621 4.883 201 H5 DC 142 5H C 142 -2.618 17.883 0.493 202 H6 DC 142 6H C 142 -0.265 17.419 0.055 203 H5' DC 142 H5' C 142 2.115 19.713 0.392 204 H5'' DC 142 H5" C 142 3.287 19.242 -0.830 205 H4' DC 142 H4' C 142 3.954 18.055 1.016 206 H3' DC 142 H3' C 142 3.122 16.602 -1.203 207 H2' DC 142 H2' C 142 1.090 15.956 -0.447 208 H2'' DC 142 H2" C 142 1.939 14.621 0.254 209 H1' DC 142 H1' C 142 1.913 15.559 2.440 210 H41 DC 142 1H4 C 142 -4.194 16.813 3.623 211 H42 DC 142 2H4 C 142 -4.364 17.704 2.121 212 H8 DG 143 8H G 143 1.517 13.000 1.308 213 H1 DG 143 1H G 143 -3.727 12.384 4.943 214 H5' DG 143 H5' G 143 4.081 15.397 3.315 215 H5'' DG 143 H5" G 143 5.600 14.589 2.900 216 H4' DG 143 H4' G 143 4.881 13.590 4.920 217 H3' DG 143 H3' G 143 5.315 11.992 2.686 218 H2' DG 143 H2' G 143 3.112 11.795 2.034 219 H2'' DG 143 H2" G 143 3.085 10.411 3.079 220 H1' DG 143 H1' G 143 2.076 11.582 4.869 221 H21 DG 143 1H2 G 143 -3.203 11.704 6.947 222 H22 DG 143 2H2 G 143 -1.538 11.347 7.389 223 H5 DC 144 5H C 144 0.757 9.486 1.964 224 H6 DC 144 6H C 144 1.763 8.880 4.105 225 H5' DC 144 H5' C 144 3.072 11.017 6.450 226 H5'' DC 144 H5" C 144 4.329 10.023 7.147 227 H4' DC 144 H4' C 144 2.497 9.505 8.398 228 H3' DC 144 H3' C 144 3.714 7.455 6.922 229 H2' DC 144 H2' C 144 2.111 7.244 5.329 230 H2'' DC 144 H2" C 144 1.278 6.232 6.468 231 H1' DC 144 H1' C 144 -0.269 7.900 7.087 232 H41 DC 144 1H4 C 144 -2.883 9.766 1.630 233 H42 DC 144 2H4 C 144 -1.316 9.998 0.883 234 H8 DA 145 8H A 145 -0.233 4.975 5.966 235 H2 DA 145 2H A 145 -6.311 6.205 4.408 236 H5' DA 145 H5' A 145 0.014 7.299 9.614 237 H5'' DA 145 H5" A 145 0.218 5.974 10.775 238 H4' DA 145 H4' A 145 -2.125 6.304 10.402 239 H3' DA 145 H3' A 145 -0.973 3.789 10.127 240 H2' DA 145 H2' A 145 -0.870 3.876 7.752 241 H2'' DA 145 H2" A 145 -2.450 3.100 7.922 242 H1' DA 145 H1' A 145 -3.642 5.181 7.809 243 H61 DA 145 2H6 A 145 -1.948 5.861 1.522 244 H62 DA 145 1H6 A 145 -3.516 6.343 0.910 245 H8 DG 146 8H G 146 -3.868 1.692 7.229 246 H1 DG 146 1H G 146 -5.787 3.387 1.338 247 H5' DG 146 H5' G 146 -5.302 4.664 9.783 248 H5'' DG 146 H5" G 146 -6.477 4.513 11.073 249 H4' DG 146 H4' G 146 -7.925 3.938 9.466 250 H3' DG 146 H3' G 146 -6.829 1.440 10.359 251 H2' DG 146 H2' G 146 -5.611 1.004 8.443 252 H2'' DG 146 H2" G 146 -7.183 0.436 7.821 253 H1' DG 146 H1' G 146 -7.670 2.488 6.782 254 H21 DG 146 1H2 G 146 -7.890 3.813 1.332 255 H22 DG 146 2H2 G 146 -8.817 3.887 2.809 256 H8 DA 147 8H A 147 -6.893 -1.199 6.408 257 H2 DA 147 2H A 147 -6.469 0.440 0.210 258 H5' DA 147 H5' A 147 -10.225 1.864 7.450 259 H5'' DA 147 H5" A 147 -11.598 0.776 7.739 260 H4' DA 147 H4' A 147 -11.298 1.114 5.333 261 H3' DA 147 H3' A 147 -11.322 -1.450 6.575 262 H2' DA 147 H2' A 147 -9.092 -1.918 6.129 263 H2'' DA 147 H2" A 147 -9.759 -2.475 4.560 264 H1' DA 147 H1' A 147 -9.408 -0.311 3.546 265 H61 DA 147 2H6 A 147 -2.832 -0.587 3.797 266 H62 DA 147 1H6 A 147 -2.527 -0.224 2.108 267 H5 DC 148 5H C 148 -7.075 -3.478 3.264 268 H6 DC 148 6H C 148 -9.368 -3.434 2.411 269 H5' DC 148 H5' C 148 -12.339 -0.786 1.941 270 H5'' DC 148 H5" C 148 -13.785 -1.797 1.747 271 H4' DC 148 H4' C 148 -12.726 -1.719 -0.378 272 H3' DC 148 H3' C 148 -13.137 -4.180 0.903 273 H2' DC 148 H2' C 148 -10.900 -4.486 1.468 274 H2'' DC 148 H2" C 148 -10.857 -5.284 -0.112 275 H1' DC 148 H1' C 148 -10.134 -3.278 -1.249 276 H41 DC 148 1H4 C 148 -4.232 -3.152 0.962 277 H42 DC 148 2H4 C 148 -4.755 -3.455 2.617 278 H8 DG 149 8H G 149 -9.211 -6.871 -0.955 279 H1 DG 149 1H G 149 -2.862 -5.843 -1.082 280 H5' DG 149 H5' G 149 -10.870 -3.573 -3.162 281 H5'' DG 149 H5" G 149 -12.062 -4.306 -4.234 282 H4' DG 149 H4' G 149 -10.065 -4.552 -5.399 283 H3' DG 149 H3' G 149 -11.491 -6.795 -4.484 284 H2' DG 149 H2' G 149 -10.029 -7.443 -2.861 285 H2'' DG 149 H2" G 149 -9.225 -8.303 -4.171 286 H1' DG 149 H1' G 149 -7.609 -6.525 -4.485 287 H21 DG 149 1H2 G 149 -2.191 -5.544 -3.109 288 H22 DG 149 2H2 G 149 -3.318 -5.450 -4.446 289 H5 DC 150 5H C 150 -6.949 -9.395 -1.656 290 H6 DC 150 6H C 150 -7.127 -9.613 -4.081 291 H5' DC 150 H5' C 150 -8.136 -9.017 -5.780 292 H5'' DC 150 H5" C 150 -7.975 -7.344 -6.374 293 H4' DC 150 H4' C 150 -6.625 -8.153 -8.264 294 H3' DC 150 H3' C 150 -7.693 -10.666 -7.765 295 H2' DC 150 H2' C 150 -6.781 -11.029 -5.683 296 H2'' DC 150 H2" C 150 -5.444 -11.653 -6.624 297 H1' DC 150 H1' C 150 -4.128 -9.724 -6.343 298 H41 DC 150 1H4 C 150 -3.694 -9.295 -0.013 299 H42 DC 150 2H4 C 150 -5.433 -9.192 0.180 300 H5 DC 151 5H C 151 -5.128 -12.897 -4.389 301 H6 DC 151 6H C 151 -3.901 -12.904 -6.513 302 H5' DC 151 H5' C 151 -3.389 -10.201 -9.298 303 H5'' DC 151 H5" C 151 -3.082 -11.304 -10.654 304 H4' DC 151 H4' C 151 -0.996 -10.891 -9.419 305 H3' DC 151 H3' C 151 -2.045 -13.467 -9.960 306 H2' DC 151 H2' C 151 -2.610 -13.977 -7.797 307 H2'' DC 151 H2" C 151 -0.937 -14.485 -7.672 308 H1' DC 151 H1' C 151 -0.221 -12.398 -6.697 309 H41 DC 151 1H4 C 151 -3.306 -12.957 -1.215 310 H42 DC 151 2H4 C 151 -4.863 -12.977 -2.013 311 H5 DC 152 5H C 152 -3.172 -15.928 -4.995 312 H6 DC 152 6H C 152 -0.977 -15.941 -6.084 313 H5' DC 152 H5' C 152 1.577 -13.281 -7.463 314 H5'' DC 152 H5" C 152 2.930 -13.905 -8.416 315 H4' DC 152 H4' C 152 3.544 -14.578 -6.289 316 H3' DC 152 H3' C 152 2.603 -16.704 -7.971 317 H2' DC 152 H2' C 152 0.730 -17.175 -6.693 318 H2'' DC 152 H2" C 152 1.874 -18.120 -5.709 319 H1' DC 152 H1' C 152 2.241 -16.295 -4.176 320 H41 DC 152 1H4 C 152 -3.472 -16.170 -1.337 321 H42 DC 152 2H4 C 152 -4.307 -16.025 -2.873 322 H5 DC 153 5H C 153 -1.357 -19.523 -4.666 323 H6 DC 153 6H C 153 1.064 -19.864 -4.434 324 H5' DC 153 H5' C 153 4.733 -17.616 -4.043 325 H5'' DC 153 H5" C 153 5.973 -18.837 -4.386 326 H4' DC 153 H4' C 153 5.185 -19.239 -2.165 327 H3' DC 153 H3' C 153 4.822 -21.187 -4.269 328 H2' DC 153 H2' C 153 2.582 -21.284 -4.052 329 H2'' DC 153 H2" C 153 2.906 -22.303 -2.654 330 H1' DC 153 H1' C 153 2.708 -20.474 -1.102 331 H41 DC 153 1H4 C 153 -3.511 -19.165 -1.707 332 H42 DC 153 2H4 C 153 -3.440 -19.303 -3.455 333 H5 DC 154 5H C 154 -0.206 -22.903 -3.121 334 H6 DC 154 6H C 154 1.645 -23.550 -1.652 335 H5' DC 154 H5' C 154 4.738 -21.837 0.126 336 H5'' DC 154 H5" C 154 5.792 -23.204 0.524 337 H4' DC 154 H4' C 154 4.094 -23.024 2.202 338 H3' DC 154 H3' C 154 4.537 -25.368 0.658 339 H2' DC 154 H2' C 154 2.492 -25.357 -0.390 340 H2'' DC 154 H2" C 154 1.952 -26.103 1.142 341 H1' DC 154 H1' C 154 1.196 -24.036 2.043 342 H41 DC 154 1H4 C 154 -3.646 -22.708 -1.817 343 H42 DC 154 2H4 C 154 -2.600 -22.597 -3.218 344 H8 DG 155 8H G 155 0.550 -27.549 0.987 345 H1 DG 155 1H G 155 -5.550 -25.917 -0.289 346 H5' DG 155 H5' G 155 2.194 -25.442 4.513 347 H5'' DG 155 H5" G 155 2.751 -26.712 5.635 348 H4' DG 155 H4' G 155 0.370 -26.521 5.928 349 H3' DG 155 H3' G 155 1.469 -28.970 5.035 350 H2' DG 155 H2' G 155 0.566 -28.849 2.904 351 H2'' DG 155 H2" G 155 -0.845 -29.569 3.727 352 H1' DG 155 H1' G 155 -1.878 -27.417 4.055 353 H21 DG 155 1H2 G 155 -6.731 -25.886 1.554 354 H22 DG 155 2H2 G 155 -6.007 -26.252 3.115 355 H5 DC 156 5H C 156 -1.628 -30.597 1.096 356 H6 DC 156 6H C 156 -2.442 -30.860 3.391 357 H5' DC 156 H5' C 156 -2.659 -28.676 6.877 358 H5'' DC 156 H5" C 156 -2.955 -29.931 8.092 359 H4' DC 156 H4' C 156 -5.059 -29.368 7.019 360 H3' DC 156 H3' C 156 -3.979 -31.999 7.025 361 H2' DC 156 H2' C 156 -3.581 -32.080 4.747 362 H2'' DC 156 H2" C 156 -5.309 -32.504 4.721 363 H1' DC 156 H1' C 156 -6.022 -30.284 4.328 364 H41 DC 156 1H4 C 156 -3.872 -29.361 -1.567 365 H42 DC 156 2H4 C 156 -2.230 -29.770 -1.112 366 H8 DG 157 8H G 157 -6.399 -34.761 4.697 367 H1 DG 157 1H G 157 -6.900 -32.287 -1.198 368 H5' DG 157 H5' G 157 -8.714 -31.515 7.270 369 H5'' DG 157 H5" G 157 -9.535 -32.702 8.304 370 H4' DG 157 H4' G 157 -10.783 -32.331 6.224 371 H3' DG 157 H3' G 157 -10.187 -34.884 7.140 372 H2' DG 157 H2' G 157 -8.323 -35.209 5.698 373 H2'' DG 157 H2" G 157 -9.621 -35.897 4.669 374 H1' DG 157 H1' G 157 -9.986 -33.814 3.552 375 H21 DG 157 1H2 G 157 -8.954 -31.756 -1.617 376 H22 DG 157 2H2 G 157 -10.194 -31.839 -0.380 377 HA ALA 1 HA ALA 1 25.665 25.975 -3.270 378 H1 ALA 1 HN ALA 1 23.867 27.604 -2.451 379 HB1 ALA 1 1HB ALA 1 24.629 25.705 -1.033 380 HB2 ALA 1 2HB ALA 1 23.281 24.799 -1.764 381 HB3 ALA 1 3HB ALA 1 24.928 24.130 -1.794 382 H SER 2 HN SER 2 22.766 26.097 -4.976 383 HA SER 2 HA SER 2 23.611 23.922 -6.763 384 HG SER 2 HG SER 2 20.264 22.595 -6.862 385 HB2 SER 2 2HB SER 2 22.235 22.685 -5.130 386 HB3 SER 2 3HB SER 2 20.913 23.847 -5.341 387 H GLU 3 HN GLU 3 22.635 24.049 -8.841 388 HA GLU 3 HA GLU 3 21.745 26.703 -9.635 389 HB2 GLU 3 2HB GLU 3 23.088 25.331 -11.128 390 HB3 GLU 3 3HB GLU 3 21.907 24.032 -11.091 391 HG2 GLU 3 2HG GLU 3 21.921 25.304 -13.212 392 HG3 GLU 3 3HG GLU 3 20.353 25.255 -12.434 393 H LYS 4 HN LYS 4 20.171 23.692 -8.679 394 HA LYS 4 HA LYS 4 17.540 25.057 -8.830 395 HB2 LYS 4 2HB LYS 4 18.032 22.290 -10.023 396 HB3 LYS 4 3HB LYS 4 16.454 23.043 -9.843 397 HG2 LYS 4 2HG LYS 4 18.688 24.068 -11.619 398 HG3 LYS 4 3HG LYS 4 17.334 23.103 -12.160 399 HD2 LYS 4 2HD LYS 4 15.782 24.833 -11.961 400 HD3 LYS 4 3HD LYS 4 16.713 25.692 -10.734 401 HE2 LYS 4 2HE LYS 4 16.793 26.950 -12.796 402 HE3 LYS 4 3HE LYS 4 18.397 26.361 -12.368 403 HZ1 LYS 4 3HZ LYS 4 17.947 26.051 -14.688 404 HZ2 LYS 4 1HZ LYS 4 16.602 25.147 -14.373 405 HZ3 LYS 4 2HZ LYS 4 18.097 24.581 -13.963 406 H ARG 5 HN ARG 5 15.841 23.796 -7.621 407 HA ARG 5 HA ARG 5 17.061 22.178 -5.410 408 HE ARG 5 HE ARG 5 15.529 20.523 -3.478 409 HB2 ARG 5 2HB ARG 5 16.427 24.436 -4.657 410 HB3 ARG 5 3HB ARG 5 14.792 24.215 -5.256 411 HG2 ARG 5 2HG ARG 5 14.960 24.013 -2.821 412 HG3 ARG 5 3HG ARG 5 14.326 22.538 -3.522 413 HD2 ARG 5 2HD ARG 5 17.269 22.864 -2.839 414 HD3 ARG 5 3HD ARG 5 16.074 22.367 -1.633 415 HH11 ARG 5 1HH2 ARG 5 18.729 21.478 -2.335 416 HH12 ARG 5 2HH2 ARG 5 19.380 19.890 -2.692 417 HH21 ARG 5 1HH1 ARG 5 16.383 18.635 -3.866 418 HH22 ARG 5 2HH1 ARG 5 18.074 18.282 -3.516 419 HA PRO 6 HA PRO 6 13.787 19.647 -7.468 420 HB2 PRO 6 2HB PRO 6 15.164 17.279 -7.595 421 HB3 PRO 6 3HB PRO 6 15.446 18.613 -8.750 422 HG2 PRO 6 2HG PRO 6 17.035 17.958 -6.250 423 HG3 PRO 6 3HG PRO 6 17.654 18.266 -7.904 424 HD2 PRO 6 2HD PRO 6 17.575 20.211 -5.993 425 HD3 PRO 6 3HD PRO 6 17.277 20.579 -7.720 426 H PHE 7 HN PHE 7 12.677 17.652 -6.701 427 HA PHE 7 HA PHE 7 12.638 17.541 -3.722 428 HD1 PHE 7 1HD PHE 7 10.015 18.427 -2.960 429 HD2 PHE 7 2HD PHE 7 10.194 17.930 -7.235 430 HE1 PHE 7 1HE PHE 7 8.809 20.573 -3.270 431 HE2 PHE 7 2HE PHE 7 8.948 20.060 -7.538 432 HZ PHE 7 HZ PHE 7 8.265 21.390 -5.552 433 HB2 PHE 7 2HB PHE 7 10.880 16.155 -5.787 434 HB3 PHE 7 3HB PHE 7 10.584 16.205 -4.055 435 H MET 8 HN MET 8 12.528 15.378 -2.655 436 HA MET 8 HA MET 8 13.615 13.140 -4.253 437 HB2 MET 8 2HB MET 8 14.791 13.956 -1.566 438 HB3 MET 8 3HB MET 8 15.045 12.409 -2.347 439 HG2 MET 8 2HG MET 8 16.966 13.529 -2.875 440 HG3 MET 8 3HG MET 8 16.009 13.643 -4.340 441 HE1 MET 8 3HE MET 8 15.757 15.898 -0.987 442 HE2 MET 8 1HE MET 8 17.471 15.465 -1.207 443 HE3 MET 8 2HE MET 8 16.934 17.148 -1.423 444 H CYS 9 HN CYS 9 13.034 11.110 -3.516 445 HA CYS 9 HA CYS 9 10.529 10.923 -2.114 446 HB2 CYS 9 2HB CYS 9 10.888 9.180 -3.584 447 HB3 CYS 9 3HB CYS 9 12.585 9.026 -3.215 448 H ALA 10 HN ALA 10 10.154 9.658 -0.112 449 HA ALA 10 HA ALA 10 12.355 9.964 1.889 450 HB1 ALA 10 1HB ALA 10 10.569 11.627 2.304 451 HB2 ALA 10 2HB ALA 10 9.353 10.333 2.341 452 HB3 ALA 10 3HB ALA 10 10.612 10.413 3.596 453 H TYR 11 HN TYR 11 12.596 7.686 0.709 454 HA TYR 11 HA TYR 11 11.557 5.714 2.634 455 HD1 TYR 11 1HD TYR 11 9.229 4.483 2.761 456 HD2 TYR 11 2HD TYR 11 11.530 2.939 -0.526 457 HE1 TYR 11 1HE TYR 11 8.761 2.150 3.532 458 HE2 TYR 11 2HE TYR 11 11.012 0.603 0.210 459 HH TYR 11 HH TYR 11 8.900 -0.139 2.930 460 HB2 TYR 11 2HB TYR 11 9.905 5.864 0.685 461 HB3 TYR 11 3HB TYR 11 11.197 5.249 -0.341 462 HA PRO 12 HA PRO 12 15.801 4.542 2.243 463 HB2 PRO 12 2HB PRO 12 15.640 1.904 3.189 464 HB3 PRO 12 3HB PRO 12 15.659 3.373 4.199 465 HG2 PRO 12 2HG PRO 12 13.260 1.778 3.276 466 HG3 PRO 12 3HG PRO 12 13.612 2.416 4.916 467 HD2 PRO 12 2HD PRO 12 11.943 3.702 3.263 468 HD3 PRO 12 3HD PRO 12 13.106 4.644 4.243 469 H GLY 13 HN GLY 13 13.326 2.303 0.922 470 HA2 GLY 13 2HA GLY 13 15.166 0.935 -0.830 471 HA3 GLY 13 3HA GLY 13 13.396 0.862 -0.894 472 H CYS 14 HN CYS 14 14.387 4.122 -1.026 473 HA CYS 14 HA CYS 14 14.783 4.200 -3.954 474 HB2 CYS 14 2HB CYS 14 12.354 4.097 -3.781 475 HB3 CYS 14 3HB CYS 14 12.382 5.324 -2.519 476 H ASN 15 HN ASN 15 13.372 6.836 -2.027 477 HA ASN 15 HA ASN 15 14.181 8.911 -1.451 478 HB2 ASN 15 2HB ASN 15 15.824 7.287 -0.144 479 HB3 ASN 15 3HB ASN 15 17.030 7.876 -1.278 480 HD21 ASN 15 1HD2 ASN 15 16.716 10.483 -1.487 481 HD22 ASN 15 2HD2 ASN 15 16.706 11.271 0.130 482 H LYS 16 HN LYS 16 14.103 8.021 -4.292 483 HA LYS 16 HA LYS 16 16.441 9.271 -5.599 484 HB2 LYS 16 2HB LYS 16 13.851 8.046 -6.673 485 HB3 LYS 16 3HB LYS 16 15.113 8.730 -7.703 486 HG2 LYS 16 2HG LYS 16 16.778 7.169 -6.755 487 HG3 LYS 16 3HG LYS 16 15.535 6.402 -5.771 488 HD2 LYS 16 2HD LYS 16 15.440 6.571 -8.815 489 HD3 LYS 16 3HD LYS 16 16.156 5.220 -7.937 490 HE2 LYS 16 2HE LYS 16 13.249 6.077 -7.611 491 HE3 LYS 16 3HE LYS 16 13.806 4.834 -8.750 492 HZ1 LYS 16 3HZ LYS 16 14.764 3.696 -6.761 493 HZ2 LYS 16 1HZ LYS 16 13.109 3.785 -6.781 494 HZ3 LYS 16 2HZ LYS 16 13.947 4.801 -5.827 495 H ARG 17 HN ARG 17 15.910 10.856 -7.445 496 HA ARG 17 HA ARG 17 14.569 13.066 -6.037 497 HE ARG 17 HE ARG 17 17.528 13.658 -11.726 498 HB2 ARG 17 2HB ARG 17 15.885 14.521 -7.517 499 HB3 ARG 17 3HB ARG 17 16.893 13.332 -6.720 500 HG2 ARG 17 2HG ARG 17 17.824 13.152 -8.769 501 HG3 ARG 17 3HG ARG 17 16.540 11.977 -9.019 502 HD2 ARG 17 2HD ARG 17 15.173 13.962 -10.027 503 HD3 ARG 17 3HD ARG 17 16.670 14.878 -9.944 504 HH11 ARG 17 2HH1 ARG 17 14.595 11.956 -10.652 505 HH12 ARG 17 1HH1 ARG 17 14.635 10.912 -12.057 506 HH21 ARG 17 1HH2 ARG 17 17.459 12.290 -13.461 507 HH22 ARG 17 2HH2 ARG 17 16.178 11.108 -13.590 508 H TYR 18 HN TYR 18 12.864 14.155 -6.698 509 HA TYR 18 HA TYR 18 11.632 13.471 -9.338 510 HD1 TYR 18 2HD TYR 18 11.408 11.998 -5.828 511 HD2 TYR 18 1HD TYR 18 8.670 12.239 -9.163 512 HE1 TYR 18 2HE TYR 18 11.148 9.542 -5.829 513 HE2 TYR 18 1HE TYR 18 8.529 9.782 -9.223 514 HH TYR 18 HH TYR 18 10.130 7.749 -6.838 515 HB2 TYR 18 2HB TYR 18 10.462 14.209 -6.640 516 HB3 TYR 18 3HB TYR 18 9.514 14.277 -8.113 517 H PHE 19 HN PHE 19 10.274 15.243 -10.288 518 HA PHE 19 HA PHE 19 11.716 17.858 -9.950 519 HD1 PHE 19 2HD PHE 19 13.532 18.464 -12.024 520 HD2 PHE 19 1HD PHE 19 11.617 14.657 -12.697 521 HE1 PHE 19 2HE PHE 19 15.708 17.485 -12.704 522 HE2 PHE 19 1HE PHE 19 13.794 13.685 -13.372 523 HZ PHE 19 HZ PHE 19 15.840 15.101 -13.391 524 HB2 PHE 19 2HB PHE 19 10.281 16.661 -12.360 525 HB3 PHE 19 3HB PHE 19 11.041 18.247 -12.320 526 H LYS 20 HN LYS 20 8.728 16.364 -9.349 527 HA LYS 20 HA LYS 20 7.416 19.037 -9.132 528 HB2 LYS 20 2HB LYS 20 6.439 16.617 -10.589 529 HB3 LYS 20 3HB LYS 20 5.234 17.519 -9.626 530 HG2 LYS 20 2HG LYS 20 5.878 19.583 -10.869 531 HG3 LYS 20 3HG LYS 20 7.070 18.649 -11.780 532 HD2 LYS 20 2HD LYS 20 5.144 18.883 -13.182 533 HD3 LYS 20 3HD LYS 20 5.235 17.200 -12.671 534 HE2 LYS 20 2HE LYS 20 2.932 17.899 -12.577 535 HE3 LYS 20 3HE LYS 20 3.492 17.683 -10.913 536 HZ1 LYS 20 3HZ LYS 20 2.240 19.716 -11.193 537 HZ2 LYS 20 1HZ LYS 20 3.289 20.258 -12.340 538 HZ3 LYS 20 2HZ LYS 20 3.797 20.071 -10.786 539 H LEU 21 HN LEU 21 5.874 19.182 -7.423 540 HA LEU 21 HA LEU 21 6.677 17.544 -5.123 541 HG LEU 21 HG LEU 21 6.923 19.124 -3.305 542 HB2 LEU 21 2HB LEU 21 5.992 20.140 -5.290 543 HB3 LEU 21 3HB LEU 21 4.390 19.504 -4.962 544 HD11 LEU 21 1HD1 LEU 21 4.396 20.663 -2.662 545 HD12 LEU 21 2HD1 LEU 21 5.957 21.353 -3.138 546 HD13 LEU 21 3HD1 LEU 21 5.815 20.475 -1.610 547 HD21 LEU 21 3HD2 LEU 21 5.863 17.102 -2.896 548 HD22 LEU 21 1HD2 LEU 21 4.266 17.839 -2.773 549 HD23 LEU 21 2HD2 LEU 21 5.489 18.128 -1.521 550 H SER 22 HN SER 22 3.630 18.171 -6.967 551 HA SER 22 HA SER 22 2.041 16.227 -5.547 552 HG SER 22 HG SER 22 1.101 18.124 -9.009 553 HB2 SER 22 2HB SER 22 0.504 16.479 -7.540 554 HB3 SER 22 3HB SER 22 0.940 17.994 -6.727 555 H HIS 23 HN HIS 23 4.133 16.038 -8.374 556 HA HIS 23 HA HIS 23 3.226 13.386 -9.216 557 HD1 HIS 23 1HD HIS 23 6.172 13.285 -12.521 558 HD2 HIS 23 2HD HIS 23 7.514 14.759 -8.854 559 HE1 HIS 23 1HE HIS 23 8.705 13.553 -12.721 560 HB2 HIS 23 2HB HIS 23 4.350 13.850 -10.976 561 HB3 HIS 23 3HB HIS 23 4.752 15.378 -10.389 562 H LEU 24 HN LEU 24 6.137 14.646 -7.457 563 HA LEU 24 HA LEU 24 6.994 12.197 -6.443 564 HG LEU 24 HG LEU 24 9.469 13.948 -4.548 565 HB2 LEU 24 2HB LEU 24 8.187 14.313 -6.282 566 HB3 LEU 24 3HB LEU 24 7.057 14.930 -5.124 567 HD11 LEU 24 1HD1 LEU 24 8.080 15.200 -3.022 568 HD12 LEU 24 2HD1 LEU 24 8.781 13.788 -2.213 569 HD13 LEU 24 3HD1 LEU 24 7.076 13.765 -2.707 570 HD21 LEU 24 3HD2 LEU 24 8.527 11.518 -5.183 571 HD22 LEU 24 1HD2 LEU 24 8.023 11.579 -3.480 572 HD23 LEU 24 2HD2 LEU 24 9.702 11.817 -3.908 573 H GLN 25 HN GLN 25 4.295 14.241 -5.238 574 HA GLN 25 HA GLN 25 3.866 12.849 -2.790 575 HB2 GLN 25 2HB GLN 25 2.806 14.995 -3.192 576 HB3 GLN 25 3HB GLN 25 1.913 14.344 -4.570 577 HG2 GLN 25 2HG GLN 25 0.647 12.822 -3.121 578 HG3 GLN 25 3HG GLN 25 1.503 13.447 -1.711 579 HE21 GLN 25 1HE2 GLN 25 -1.245 13.545 -1.640 580 HE22 GLN 25 2HE2 GLN 25 -1.738 15.221 -1.947 581 H MET 26 HN MET 26 2.500 12.328 -6.069 582 HA MET 26 HA MET 26 0.905 10.053 -5.418 583 HB2 MET 26 2HB MET 26 0.799 11.253 -7.587 584 HB3 MET 26 3HB MET 26 2.416 10.676 -8.005 585 HG2 MET 26 2HG MET 26 0.662 9.317 -9.071 586 HG3 MET 26 3HG MET 26 1.648 8.359 -7.974 587 HE1 MET 26 3HE MET 26 -1.612 6.407 -7.482 588 HE2 MET 26 1HE MET 26 -0.833 6.980 -8.975 589 HE3 MET 26 2HE MET 26 0.154 6.328 -7.643 590 H HIS 27 HN HIS 27 4.350 10.340 -6.471 591 HA HIS 27 HA HIS 27 4.974 7.576 -6.404 592 HD1 HIS 27 1HD HIS 27 7.221 6.285 -6.770 593 HD2 HIS 27 2HD HIS 27 8.641 9.400 -4.305 594 HE1 HIS 27 1HE HIS 27 9.164 5.332 -5.368 595 HB2 HIS 27 2HB HIS 27 6.566 9.139 -7.348 596 HB3 HIS 27 3HB HIS 27 6.696 10.046 -5.839 597 H SER 28 HN SER 28 5.088 10.036 -3.781 598 HA SER 28 HA SER 28 6.185 8.399 -1.755 599 HG SER 28 HG SER 28 5.992 11.311 -2.672 600 HB2 SER 28 2HB SER 28 4.148 10.651 -1.412 601 HB3 SER 28 3HB SER 28 5.274 10.044 -0.195 602 H ARG 29 HN ARG 29 2.831 8.680 -2.981 603 HA ARG 29 HA ARG 29 1.563 7.233 -0.790 604 HE ARG 29 HE ARG 29 -3.230 9.724 -1.776 605 HB2 ARG 29 2HB ARG 29 0.749 7.960 -3.632 606 HB3 ARG 29 3HB ARG 29 -0.165 6.752 -2.738 607 HG2 ARG 29 2HG ARG 29 -0.656 8.254 -0.957 608 HG3 ARG 29 3HG ARG 29 0.515 9.455 -1.521 609 HD2 ARG 29 2HD ARG 29 -0.854 10.138 -3.335 610 HD3 ARG 29 3HD ARG 29 -1.846 8.683 -3.241 611 HH11 ARG 29 2HH2 ARG 29 -0.179 11.395 -1.304 612 HH12 ARG 29 1HH2 ARG 29 -0.871 12.365 0.004 613 HH21 ARG 29 1HH1 ARG 29 -3.991 11.064 -0.172 614 HH22 ARG 29 2HH1 ARG 29 -2.983 12.324 0.452 615 H LYS 30 HN LYS 30 3.245 6.303 -3.809 616 HA LYS 30 HA LYS 30 2.526 3.508 -3.788 617 HB2 LYS 30 2HB LYS 30 3.809 4.999 -5.572 618 HB3 LYS 30 3HB LYS 30 5.254 4.477 -4.708 619 HG2 LYS 30 2HG LYS 30 3.431 2.209 -5.280 620 HG3 LYS 30 3HG LYS 30 3.807 3.123 -6.724 621 HD2 LYS 30 2HD LYS 30 5.349 1.348 -6.602 622 HD3 LYS 30 3HD LYS 30 6.256 2.826 -6.255 623 HE2 LYS 30 2HE LYS 30 6.280 2.291 -3.864 624 HE3 LYS 30 3HE LYS 30 5.171 0.940 -4.112 625 HZ1 LYS 30 3HZ LYS 30 7.901 1.119 -5.216 626 HZ2 LYS 30 1HZ LYS 30 6.858 -0.149 -5.422 627 HZ3 LYS 30 2HZ LYS 30 7.440 0.205 -3.925 628 H HIS 31 HN HIS 31 4.866 5.442 -1.896 629 HA HIS 31 HA HIS 31 6.192 2.988 -0.874 630 HD1 HIS 31 1HD HIS 31 8.256 2.439 -1.450 631 HD2 HIS 31 2HD HIS 31 8.839 6.577 -2.069 632 HE1 HIS 31 1HE HIS 31 10.351 2.682 -2.850 633 HB2 HIS 31 2HB HIS 31 6.722 5.959 -0.600 634 HB3 HIS 31 3HB HIS 31 7.443 4.808 0.524 635 H THR 32 HN THR 32 3.933 5.574 0.352 636 HA THR 32 HA THR 32 3.726 4.921 2.958 637 HB THR 32 HB THR 32 2.171 6.414 1.435 638 HG1 THR 32 1HG THR 32 0.572 5.741 3.421 639 HG21 THR 32 3HG2 THR 32 0.054 4.366 2.133 640 HG22 THR 32 1HG2 THR 32 0.778 4.314 0.558 641 HG23 THR 32 2HG2 THR 32 -0.041 5.797 1.076 642 H GLY 33 HN GLY 33 2.711 2.787 0.325 643 HA2 GLY 33 2HA GLY 33 1.456 0.877 2.175 644 HA3 GLY 33 3HA GLY 33 1.619 0.708 0.430 645 H GLU 34 HN GLU 34 4.555 1.624 1.935 646 HA GLU 34 HA GLU 34 5.474 -1.223 2.097 647 HB2 GLU 34 2HB GLU 34 6.951 1.127 0.812 648 HB3 GLU 34 3HB GLU 34 7.585 -0.514 1.035 649 HG2 GLU 34 2HG GLU 34 5.754 -1.443 -0.352 650 HG3 GLU 34 3HG GLU 34 5.206 0.205 -0.705 651 H LYS 35 HN LYS 35 4.819 1.331 3.990 652 HA LYS 35 HA LYS 35 7.272 1.904 5.381 653 HB2 LYS 35 2HB LYS 35 4.366 2.055 6.273 654 HB3 LYS 35 3HB LYS 35 5.716 2.727 7.189 655 HG2 LYS 35 2HG LYS 35 5.050 3.554 4.324 656 HG3 LYS 35 3HG LYS 35 4.401 4.359 5.742 657 HD2 LYS 35 2HD LYS 35 6.679 4.928 6.504 658 HD3 LYS 35 3HD LYS 35 7.373 4.164 5.064 659 HE2 LYS 35 2HE LYS 35 5.319 6.410 4.948 660 HE3 LYS 35 3HE LYS 35 7.062 6.709 4.978 661 HZ1 LYS 35 3HZ LYS 35 5.749 5.034 2.944 662 HZ2 LYS 35 1HZ LYS 35 7.308 5.550 2.956 663 HZ3 LYS 35 2HZ LYS 35 6.096 6.640 2.743 664 HA PRO 36 HA PRO 36 7.586 -2.138 7.135 665 HB2 PRO 36 2HB PRO 36 9.949 -1.866 8.507 666 HB3 PRO 36 3HB PRO 36 9.846 -1.886 6.723 667 HG2 PRO 36 2HG PRO 36 9.978 0.539 8.545 668 HG3 PRO 36 3HG PRO 36 10.971 0.191 7.090 669 HD2 PRO 36 2HD PRO 36 8.764 1.775 6.978 670 HD3 PRO 36 3HD PRO 36 9.167 0.649 5.638 671 H TYR 37 HN TYR 37 6.969 -3.264 8.926 672 HA TYR 37 HA TYR 37 7.217 -1.984 11.616 673 HD1 TYR 37 2HD TYR 37 4.429 -1.601 8.789 674 HD2 TYR 37 1HD TYR 37 4.546 -0.493 12.952 675 HE1 TYR 37 2HE TYR 37 3.437 0.625 8.238 676 HE2 TYR 37 1HE TYR 37 3.496 1.688 12.410 677 HH TYR 37 HH TYR 37 2.864 3.140 10.651 678 HB2 TYR 37 2HB TYR 37 4.627 -3.318 10.686 679 HB3 TYR 37 3HB TYR 37 5.006 -2.691 12.296 680 H GLN 38 HN GLN 38 6.545 -3.773 13.349 681 HA GLN 38 HA GLN 38 7.202 -6.525 12.399 682 HB2 GLN 38 2HB GLN 38 9.255 -5.438 13.454 683 HB3 GLN 38 3HB GLN 38 8.325 -5.287 14.937 684 HG2 GLN 38 2HG GLN 38 8.097 -8.021 14.415 685 HG3 GLN 38 3HG GLN 38 9.666 -7.653 13.732 686 HE21 GLN 38 1HE2 GLN 38 7.658 -7.493 16.806 687 HE22 GLN 38 2HE2 GLN 38 9.141 -7.457 17.771 688 H CYS 39 HN CYS 39 6.112 -8.166 13.520 689 HA CYS 39 HA CYS 39 3.629 -7.680 14.660 690 HB2 CYS 39 2HB CYS 39 4.524 -9.928 13.934 691 HB3 CYS 39 3HB CYS 39 5.432 -9.993 15.458 692 H ASP 40 HN ASP 40 2.750 -7.453 16.706 693 HA ASP 40 HA ASP 40 4.676 -6.529 18.801 694 HB2 ASP 40 2HB ASP 40 2.907 -5.165 19.665 695 HB3 ASP 40 3HB ASP 40 2.982 -4.882 17.935 696 H PHE 41 HN PHE 41 3.714 -9.396 18.128 697 HA PHE 41 HA PHE 41 2.049 -10.150 20.423 698 HD1 PHE 41 1HD PHE 41 0.469 -12.158 20.461 699 HD2 PHE 41 2HD PHE 41 4.071 -13.909 18.910 700 HE1 PHE 41 1HE PHE 41 -0.101 -14.318 21.560 701 HE2 PHE 41 2HE PHE 41 3.547 -16.049 20.031 702 HZ PHE 41 HZ PHE 41 1.442 -16.259 21.365 703 HB2 PHE 41 2HB PHE 41 1.898 -11.328 18.282 704 HB3 PHE 41 3HB PHE 41 3.597 -11.747 18.351 705 H LYS 42 HN LYS 42 2.896 -12.028 21.843 706 HA LYS 42 HA LYS 42 5.066 -11.016 23.409 707 HB2 LYS 42 2HB LYS 42 3.283 -12.280 24.438 708 HB3 LYS 42 3HB LYS 42 3.584 -13.675 23.408 709 HG2 LYS 42 2HG LYS 42 4.370 -14.060 25.694 710 HG3 LYS 42 3HG LYS 42 5.657 -14.151 24.513 711 HD2 LYS 42 2HD LYS 42 6.212 -11.676 25.198 712 HD3 LYS 42 3HD LYS 42 5.120 -11.965 26.554 713 HE2 LYS 42 2HE LYS 42 7.391 -12.384 27.263 714 HE3 LYS 42 3HE LYS 42 6.551 -13.944 27.195 715 HZ1 LYS 42 3HZ LYS 42 8.262 -12.888 25.029 716 HZ2 LYS 42 1HZ LYS 42 7.608 -14.386 25.111 717 HZ3 LYS 42 2HZ LYS 42 8.784 -13.955 26.179 718 H ASP 43 HN ASP 43 4.886 -13.704 21.035 719 HA ASP 43 HA ASP 43 7.851 -13.654 20.821 720 HB2 ASP 43 2HB ASP 43 6.198 -16.111 21.558 721 HB3 ASP 43 3HB ASP 43 7.775 -16.238 20.777 722 H CYS 44 HN CYS 44 7.639 -12.749 18.769 723 HA CYS 44 HA CYS 44 6.740 -14.636 16.667 724 HB2 CYS 44 2HB CYS 44 4.738 -13.362 16.944 725 HB3 CYS 44 3HB CYS 44 5.605 -11.822 17.056 726 H GLU 45 HN GLU 45 7.553 -11.110 16.677 727 HA GLU 45 HA GLU 45 9.333 -9.937 15.824 728 HB2 GLU 45 2HB GLU 45 10.897 -12.593 15.862 729 HB3 GLU 45 3HB GLU 45 11.534 -11.002 15.549 730 HG2 GLU 45 2HG GLU 45 12.074 -11.358 17.763 731 HG3 GLU 45 3HG GLU 45 10.722 -10.238 17.808 732 H ARG 46 HN ARG 46 7.269 -11.402 14.122 733 HA ARG 46 HA ARG 46 8.698 -11.722 11.535 734 HE ARG 46 HE ARG 46 5.676 -16.435 11.394 735 HB2 ARG 46 2HB ARG 46 5.737 -11.769 12.259 736 HB3 ARG 46 3HB ARG 46 6.363 -11.993 10.635 737 HG2 ARG 46 2HG ARG 46 7.464 -14.047 11.173 738 HG3 ARG 46 3HG ARG 46 7.230 -13.821 12.911 739 HD2 ARG 46 2HD ARG 46 4.749 -13.908 12.555 740 HD3 ARG 46 3HD ARG 46 5.029 -14.256 10.848 741 HH11 ARG 46 1HH2 ARG 46 5.348 -14.645 14.466 742 HH12 ARG 46 2HH2 ARG 46 5.454 -16.116 15.390 743 HH21 ARG 46 1HH1 ARG 46 5.788 -18.232 12.681 744 HH22 ARG 46 2HH1 ARG 46 5.666 -18.052 14.421 745 H ARG 47 HN ARG 47 8.779 -10.201 9.958 746 HA ARG 47 HA ARG 47 7.896 -7.485 10.773 747 HE ARG 47 HE ARG 47 10.863 -9.867 10.419 748 HB2 ARG 47 2HB ARG 47 9.604 -6.653 9.303 749 HB3 ARG 47 3HB ARG 47 10.301 -7.843 10.374 750 HG2 ARG 47 2HG ARG 47 9.713 -8.142 7.404 751 HG3 ARG 47 3HG ARG 47 11.278 -8.015 8.187 752 HD2 ARG 47 2HD ARG 47 9.411 -10.385 8.115 753 HD3 ARG 47 3HD ARG 47 11.068 -10.255 7.528 754 HH11 ARG 47 1HH2 ARG 47 11.321 -12.336 7.957 755 HH12 ARG 47 2HH2 ARG 47 11.780 -13.534 9.149 756 HH21 ARG 47 1HH1 ARG 47 11.248 -11.517 11.889 757 HH22 ARG 47 2HH1 ARG 47 11.828 -13.048 11.277 758 H PHE 48 HN PHE 48 7.001 -6.034 9.265 759 HA PHE 48 HA PHE 48 5.726 -7.257 6.854 760 HD1 PHE 48 1HD PHE 48 3.337 -8.497 6.930 761 HD2 PHE 48 2HD PHE 48 4.505 -7.130 10.857 762 HE1 PHE 48 1HE PHE 48 3.145 -10.791 7.784 763 HE2 PHE 48 2HE PHE 48 4.341 -9.459 11.703 764 HZ PHE 48 HZ PHE 48 3.777 -11.293 10.141 765 HB2 PHE 48 2HB PHE 48 4.332 -5.568 8.989 766 HB3 PHE 48 3HB PHE 48 3.615 -6.073 7.460 767 H SER 49 HN SER 49 4.854 -5.555 5.371 768 HA SER 49 HA SER 49 6.638 -3.157 5.479 769 HG SER 49 HG SER 49 4.309 -4.530 3.013 770 HB2 SER 49 2HB SER 49 6.227 -3.113 2.959 771 HB3 SER 49 3HB SER 49 7.125 -4.499 3.563 772 H ARG 50 HN ARG 50 3.803 -3.590 6.691 773 HA ARG 50 HA ARG 50 2.981 -0.884 6.226 774 HE ARG 50 HE ARG 50 1.560 -1.282 2.296 775 HB2 ARG 50 2HB ARG 50 2.061 -2.376 4.177 776 HB3 ARG 50 3HB ARG 50 0.785 -2.743 5.321 777 HG2 ARG 50 2HG ARG 50 0.379 -0.269 5.594 778 HG3 ARG 50 3HG ARG 50 1.686 0.046 4.439 779 HD2 ARG 50 2HD ARG 50 -0.894 -1.467 3.910 780 HD3 ARG 50 3HD ARG 50 -0.491 0.158 3.320 781 HH11 ARG 50 2HH1 ARG 50 -1.799 -2.146 2.236 782 HH12 ARG 50 1HH1 ARG 50 -1.593 -3.103 0.797 783 HH21 ARG 50 2HH2 ARG 50 1.834 -2.327 0.589 784 HH22 ARG 50 1HH2 ARG 50 0.456 -3.013 -0.295 785 H SER 51 HN SER 51 1.209 -0.225 7.590 786 HA SER 51 HA SER 51 0.917 -1.663 10.064 787 HG SER 51 HG SER 51 -1.800 1.064 8.965 788 HB2 SER 51 2HB SER 51 -0.877 -0.019 10.523 789 HB3 SER 51 3HB SER 51 0.586 0.775 9.921 790 H ASP 52 HN ASP 52 -0.981 -1.478 7.052 791 HA ASP 52 HA ASP 52 -3.240 -2.950 7.939 792 HB2 ASP 52 2HB ASP 52 -3.071 -1.589 5.848 793 HB3 ASP 52 3HB ASP 52 -2.022 -2.818 5.156 794 H GLN 53 HN GLN 53 -0.158 -4.033 6.428 795 HA GLN 53 HA GLN 53 -0.850 -6.820 6.242 796 HB2 GLN 53 2HB GLN 53 1.812 -5.370 6.417 797 HB3 GLN 53 3HB GLN 53 1.659 -7.117 6.150 798 HG2 GLN 53 2HG GLN 53 0.528 -6.750 4.034 799 HG3 GLN 53 3HG GLN 53 0.430 -5.008 4.322 800 HE21 GLN 53 1HE2 GLN 53 3.074 -7.602 4.266 801 HE22 GLN 53 2HE2 GLN 53 4.136 -6.484 3.388 802 H LEU 54 HN LEU 54 0.952 -4.887 8.678 803 HA LEU 54 HA LEU 54 1.445 -7.011 10.520 804 HG LEU 54 HG LEU 54 0.653 -4.713 13.034 805 HB2 LEU 54 2HB LEU 54 2.621 -4.943 10.723 806 HB3 LEU 54 3HB LEU 54 1.142 -4.003 10.774 807 HD11 LEU 54 1HD1 LEU 54 2.292 -6.043 14.319 808 HD12 LEU 54 2HD1 LEU 54 3.220 -6.359 12.829 809 HD13 LEU 54 3HD1 LEU 54 1.585 -7.015 13.032 810 HD21 LEU 54 3HD2 LEU 54 2.403 -3.547 14.145 811 HD22 LEU 54 1HD2 LEU 54 2.374 -2.844 12.516 812 HD23 LEU 54 2HD2 LEU 54 3.605 -4.067 12.971 813 H LYS 55 HN LYS 55 -1.320 -4.693 10.232 814 HA LYS 55 HA LYS 55 -2.798 -5.571 12.496 815 HB2 LYS 55 2HB LYS 55 -3.326 -3.525 11.291 816 HB3 LYS 55 3HB LYS 55 -3.725 -4.428 9.829 817 HG2 LYS 55 2HG LYS 55 -5.706 -5.391 10.917 818 HG3 LYS 55 3HG LYS 55 -5.252 -4.642 12.454 819 HD2 LYS 55 2HD LYS 55 -7.056 -3.393 11.292 820 HD3 LYS 55 3HD LYS 55 -5.617 -2.418 11.573 821 HE2 LYS 55 2HE LYS 55 -6.517 -1.961 9.355 822 HE3 LYS 55 3HE LYS 55 -4.920 -2.709 9.229 823 HZ1 LYS 55 3HZ LYS 55 -6.097 -4.835 8.877 824 HZ2 LYS 55 1HZ LYS 55 -6.307 -3.743 7.675 825 HZ3 LYS 55 2HZ LYS 55 -7.521 -4.007 8.774 826 H ARG 56 HN ARG 56 -2.980 -6.681 9.048 827 HA ARG 56 HA ARG 56 -4.929 -8.749 9.450 828 HE ARG 56 HE ARG 56 -2.373 -7.885 5.517 829 HB2 ARG 56 2HB ARG 56 -2.600 -8.485 7.498 830 HB3 ARG 56 3HB ARG 56 -3.726 -9.836 7.470 831 HG2 ARG 56 2HG ARG 56 -5.619 -8.231 7.114 832 HG3 ARG 56 3HG ARG 56 -4.444 -6.931 6.945 833 HD2 ARG 56 2HD ARG 56 -4.800 -9.373 5.172 834 HD3 ARG 56 3HD ARG 56 -5.036 -7.675 4.731 835 HH11 ARG 56 1HH2 ARG 56 -4.267 -9.350 2.901 836 HH12 ARG 56 2HH2 ARG 56 -2.805 -9.695 1.975 837 HH21 ARG 56 2HH1 ARG 56 -0.615 -8.508 4.322 838 HH22 ARG 56 1HH1 ARG 56 -0.830 -9.252 2.751 839 H HIS 57 HN HIS 57 -1.331 -8.812 9.628 840 HA HIS 57 HA HIS 57 -1.059 -11.568 10.193 841 HD1 HIS 57 1HD HIS 57 1.191 -12.961 10.257 842 HD2 HIS 57 2HD HIS 57 1.968 -10.017 13.160 843 HE1 HIS 57 1HE HIS 57 2.530 -14.097 12.148 844 HB2 HIS 57 2HB HIS 57 0.840 -10.193 9.559 845 HB3 HIS 57 3HB HIS 57 0.683 -9.198 11.013 846 H GLN 58 HN GLN 58 -1.598 -8.797 12.402 847 HA GLN 58 HA GLN 58 -1.212 -10.052 14.867 848 HB2 GLN 58 2HB GLN 58 -1.846 -7.602 14.305 849 HB3 GLN 58 3HB GLN 58 -3.527 -8.154 14.367 850 HG2 GLN 58 2HG GLN 58 -3.122 -8.990 16.685 851 HG3 GLN 58 3HG GLN 58 -1.439 -8.457 16.586 852 HE21 GLN 58 1HE2 GLN 58 -0.994 -6.360 17.351 853 HE22 GLN 58 2HE2 GLN 58 -2.294 -5.191 17.595 854 H ARG 59 HN ARG 59 -4.012 -10.305 12.636 855 HA ARG 59 HA ARG 59 -5.880 -11.546 14.407 856 HE ARG 59 HE ARG 59 -7.035 -7.588 12.631 857 HB2 ARG 59 2HB ARG 59 -5.564 -12.104 11.441 858 HB3 ARG 59 3HB ARG 59 -6.986 -12.334 12.449 859 HG2 ARG 59 2HG ARG 59 -5.749 -9.651 11.730 860 HG3 ARG 59 3HG ARG 59 -7.215 -10.320 11.053 861 HD2 ARG 59 2HD ARG 59 -8.480 -9.568 12.744 862 HD3 ARG 59 3HD ARG 59 -7.413 -10.230 13.967 863 HH11 ARG 59 1HH1 ARG 59 -6.422 -9.511 15.618 864 HH12 ARG 59 2HH1 ARG 59 -5.564 -8.116 16.266 865 HH21 ARG 59 1HH2 ARG 59 -5.939 -6.003 13.706 866 HH22 ARG 59 2HH2 ARG 59 -5.283 -6.353 15.304 867 H ARG 60 HN ARG 60 -3.071 -12.853 12.658 868 HA ARG 60 HA ARG 60 -3.654 -15.654 12.857 869 HE ARG 60 HE ARG 60 0.749 -18.248 12.270 870 HB2 ARG 60 2HB ARG 60 -1.813 -14.636 11.492 871 HB3 ARG 60 3HB ARG 60 -0.942 -14.267 12.993 872 HG2 ARG 60 2HG ARG 60 -0.738 -16.657 13.518 873 HG3 ARG 60 3HG ARG 60 -1.596 -17.060 12.023 874 HD2 ARG 60 2HD ARG 60 0.230 -15.784 10.762 875 HD3 ARG 60 3HD ARG 60 1.039 -15.560 12.315 876 HH11 ARG 60 2HH2 ARG 60 2.178 -16.122 9.798 877 HH12 ARG 60 1HH2 ARG 60 3.344 -17.350 9.367 878 HH21 ARG 60 1HH1 ARG 60 2.224 -19.720 11.571 879 HH22 ARG 60 2HH1 ARG 60 3.344 -19.315 10.293 880 H HIS 61 HN HIS 61 -2.318 -13.329 15.221 881 HA HIS 61 HA HIS 61 -1.689 -15.525 17.127 882 HD1 HIS 61 1HD HIS 61 0.794 -15.801 17.693 883 HD2 HIS 61 2HD HIS 61 0.960 -12.024 15.827 884 HE1 HIS 61 1HE HIS 61 3.092 -15.623 16.561 885 HB2 HIS 61 2HB HIS 61 -1.235 -12.510 17.176 886 HB3 HIS 61 3HB HIS 61 -0.889 -13.568 18.542 887 H THR 62 HN THR 62 -3.925 -12.780 16.718 888 HA THR 62 HA THR 62 -5.063 -13.081 19.395 889 HB THR 62 HB THR 62 -6.711 -11.363 18.580 890 HG1 THR 62 1HG THR 62 -5.077 -11.284 16.295 891 HG21 THR 62 3HG2 THR 62 -5.075 -9.538 18.206 892 HG22 THR 62 1HG2 THR 62 -3.776 -10.738 17.986 893 HG23 THR 62 2HG2 THR 62 -4.596 -10.588 19.546 894 H GLY 63 HN GLY 63 -5.668 -14.511 16.258 895 HA2 GLY 63 2HA GLY 63 -7.148 -16.224 15.696 896 HA3 GLY 63 3HA GLY 63 -7.755 -16.229 17.362 897 H VAL 64 HN VAL 64 -7.864 -13.063 16.229 898 HA VAL 64 HA VAL 64 -10.724 -13.002 16.302 899 HB VAL 64 HB VAL 64 -8.578 -10.996 15.538 900 HG11 VAL 64 1HG1 VAL 64 -10.358 -10.091 14.266 901 HG12 VAL 64 2HG1 VAL 64 -11.579 -10.506 15.508 902 HG13 VAL 64 3HG1 VAL 64 -10.389 -9.215 15.780 903 HG21 VAL 64 3HG2 VAL 64 -10.543 -11.103 17.859 904 HG22 VAL 64 1HG2 VAL 64 -8.877 -11.698 17.927 905 HG23 VAL 64 2HG2 VAL 64 -9.181 -9.978 17.659 906 H LYS 65 HN LYS 65 -12.036 -13.819 14.796 907 HA LYS 65 HA LYS 65 -11.391 -13.344 11.901 908 HB2 LYS 65 2HB LYS 65 -12.828 -15.684 13.217 909 HB3 LYS 65 3HB LYS 65 -12.749 -15.426 11.472 910 HG2 LYS 65 2HG LYS 65 -10.433 -15.847 11.375 911 HG3 LYS 65 3HG LYS 65 -10.241 -15.708 13.133 912 HD2 LYS 65 2HD LYS 65 -11.733 -17.782 13.335 913 HD3 LYS 65 3HD LYS 65 -11.633 -17.918 11.568 914 HE2 LYS 65 2HE LYS 65 -9.931 -19.353 12.450 915 HE3 LYS 65 3HE LYS 65 -9.101 -17.922 11.812 916 HZ1 LYS 65 3HZ LYS 65 -9.750 -18.452 14.642 917 HZ2 LYS 65 1HZ LYS 65 -9.088 -17.057 14.096 918 HZ3 LYS 65 2HZ LYS 65 -8.248 -18.474 13.964 919 HA PRO 66 HA PRO 66 -15.336 -11.236 13.000 920 HB2 PRO 66 2HB PRO 66 -14.855 -8.782 11.907 921 HB3 PRO 66 3HB PRO 66 -14.091 -9.306 13.438 922 HG2 PRO 66 2HG PRO 66 -12.900 -9.355 10.649 923 HG3 PRO 66 3HG PRO 66 -12.157 -8.742 12.160 924 HD2 PRO 66 2HD PRO 66 -11.696 -11.262 11.156 925 HD3 PRO 66 3HD PRO 66 -11.673 -10.908 12.903 926 H PHE 67 HN PHE 67 -13.710 -11.728 9.896 927 HA PHE 67 HA PHE 67 -15.982 -10.782 8.281 928 HD1 PHE 67 2HD PHE 67 -14.891 -9.285 5.965 929 HD2 PHE 67 1HD PHE 67 -11.798 -10.877 8.498 930 HE1 PHE 67 2HE PHE 67 -13.664 -7.128 5.833 931 HE2 PHE 67 1HE PHE 67 -10.534 -8.750 8.309 932 HZ PHE 67 HZ PHE 67 -11.484 -6.862 6.986 933 HB2 PHE 67 2HB PHE 67 -13.454 -12.327 7.559 934 HB3 PHE 67 3HB PHE 67 -14.580 -11.762 6.388 935 H GLN 68 HN GLN 68 -17.513 -12.257 9.584 936 HA GLN 68 HA GLN 68 -17.430 -15.066 8.850 937 HB2 GLN 68 2HB GLN 68 -19.529 -15.179 10.194 938 HB3 GLN 68 3HB GLN 68 -18.164 -14.445 11.014 939 HG2 GLN 68 2HG GLN 68 -19.468 -12.193 10.004 940 HG3 GLN 68 3HG GLN 68 -20.792 -13.284 10.392 941 HE21 GLN 68 1HE2 GLN 68 -18.054 -11.366 11.770 942 HE22 GLN 68 2HE2 GLN 68 -18.636 -11.652 13.421 943 H CYS 69 HN CYS 69 -18.564 -16.190 7.382 944 HA CYS 69 HA CYS 69 -19.535 -14.844 5.106 945 HB2 CYS 69 2HB CYS 69 -18.675 -17.122 4.981 946 HB3 CYS 69 3HB CYS 69 -19.950 -17.717 6.043 947 H LYS 70 HN LYS 70 -21.409 -13.913 4.587 948 HA LYS 70 HA LYS 70 -23.696 -13.828 6.279 949 HB2 LYS 70 2HB LYS 70 -24.796 -12.706 4.439 950 HB3 LYS 70 3HB LYS 70 -23.174 -12.084 4.627 951 HG2 LYS 70 2HG LYS 70 -24.014 -14.067 2.447 952 HG3 LYS 70 3HG LYS 70 -24.014 -12.324 2.289 953 HD2 LYS 70 2HD LYS 70 -21.989 -12.606 1.362 954 HD3 LYS 70 3HD LYS 70 -21.428 -12.615 3.034 955 HE2 LYS 70 2HE LYS 70 -21.817 -15.188 2.918 956 HE3 LYS 70 3HE LYS 70 -21.980 -14.986 1.185 957 HZ1 LYS 70 3HZ LYS 70 -19.728 -14.153 1.112 958 HZ2 LYS 70 1HZ LYS 70 -19.757 -15.581 1.948 959 HZ3 LYS 70 2HZ LYS 70 -19.614 -14.172 2.759 960 H THR 71 HN THR 71 -22.610 -16.484 4.528 961 HA THR 71 HA THR 71 -25.380 -17.506 3.996 962 HB THR 71 HB THR 71 -23.153 -19.146 2.943 963 HG1 THR 71 1HG THR 71 -22.106 -17.322 2.623 964 HG21 THR 71 3HG2 THR 71 -24.441 -19.063 0.901 965 HG22 THR 71 1HG2 THR 71 -25.483 -17.787 1.570 966 HG23 THR 71 2HG2 THR 71 -25.502 -19.424 2.280 967 H CYS 72 HN CYS 72 -22.152 -18.965 4.822 968 HA CYS 72 HA CYS 72 -23.618 -20.895 6.591 969 HB2 CYS 72 2HB CYS 72 -21.662 -22.351 6.238 970 HB3 CYS 72 3HB CYS 72 -22.350 -21.837 4.676 971 H GLN 73 HN GLN 73 -22.053 -18.041 6.995 972 HA GLN 73 HA GLN 73 -21.045 -16.987 8.769 973 HB2 GLN 73 2HB GLN 73 -22.185 -19.413 10.274 974 HB3 GLN 73 3HB GLN 73 -21.304 -18.117 11.056 975 HG2 GLN 73 2HG GLN 73 -23.578 -17.561 11.255 976 HG3 GLN 73 3HG GLN 73 -22.878 -16.433 10.104 977 HE21 GLN 73 1HE2 GLN 73 -23.553 -16.628 7.757 978 HE22 GLN 73 2HE2 GLN 73 -24.999 -17.638 7.451 979 H ARG 74 HN ARG 74 -19.592 -19.374 7.207 980 HA ARG 74 HA ARG 74 -17.364 -20.201 8.728 981 HE ARG 74 HE ARG 74 -14.699 -20.022 7.390 982 HB2 ARG 74 2HB ARG 74 -17.972 -19.748 5.862 983 HB3 ARG 74 3HB ARG 74 -16.335 -19.426 6.213 984 HG2 ARG 74 2HG ARG 74 -17.192 -21.974 7.450 985 HG3 ARG 74 3HG ARG 74 -17.397 -21.930 5.702 986 HD2 ARG 74 2HD ARG 74 -15.185 -22.820 6.413 987 HD3 ARG 74 3HD ARG 74 -15.086 -21.443 5.315 988 HH11 ARG 74 1HH2 ARG 74 -13.541 -23.346 7.346 989 HH12 ARG 74 2HH2 ARG 74 -12.285 -22.988 8.513 990 HH21 ARG 74 1HH1 ARG 74 -13.108 -19.661 8.898 991 HH22 ARG 74 2HH1 ARG 74 -12.088 -20.999 9.372 992 H LYS 75 HN LYS 75 -16.258 -18.916 10.109 993 HA LYS 75 HA LYS 75 -15.996 -16.105 9.568 994 HB2 LYS 75 2HB LYS 75 -14.822 -17.794 11.836 995 HB3 LYS 75 3HB LYS 75 -14.927 -16.028 11.763 996 HG2 LYS 75 2HG LYS 75 -17.515 -16.576 11.300 997 HG3 LYS 75 3HG LYS 75 -17.112 -18.032 12.212 998 HD2 LYS 75 2HD LYS 75 -16.378 -16.615 14.116 999 HD3 LYS 75 3HD LYS 75 -16.679 -15.153 13.145 1000 HE2 LYS 75 2HE LYS 75 -19.072 -15.874 12.878 1001 HE3 LYS 75 3HE LYS 75 -18.759 -17.215 13.991 1002 HZ1 LYS 75 3HZ LYS 75 -18.157 -15.548 15.658 1003 HZ2 LYS 75 1HZ LYS 75 -19.706 -15.335 15.121 1004 HZ3 LYS 75 2HZ LYS 75 -18.521 -14.338 14.590 1005 H PHE 76 HN PHE 76 -14.327 -14.918 8.918 1006 HA PHE 76 HA PHE 76 -11.685 -16.262 8.522 1007 HD1 PHE 76 1HD PHE 76 -11.301 -17.564 6.132 1008 HD2 PHE 76 2HD PHE 76 -15.019 -15.386 5.834 1009 HE1 PHE 76 1HE PHE 76 -12.337 -19.466 4.925 1010 HE2 PHE 76 2HE PHE 76 -16.053 -17.296 4.701 1011 HZ PHE 76 HZ PHE 76 -14.711 -19.346 4.213 1012 HB2 PHE 76 2HB PHE 76 -13.069 -14.287 6.638 1013 HB3 PHE 76 3HB PHE 76 -11.480 -14.984 6.405 1014 H SER 77 HN SER 77 -9.856 -14.751 8.408 1015 HA SER 77 HA SER 77 -10.322 -12.318 10.086 1016 HG SER 77 HG SER 77 -9.038 -13.379 12.048 1017 HB2 SER 77 2HB SER 77 -7.824 -13.964 9.517 1018 HB3 SER 77 3HB SER 77 -7.820 -12.443 10.405 1019 H ARG 78 HN ARG 78 -10.099 -13.115 6.870 1020 HA ARG 78 HA ARG 78 -8.840 -10.493 6.178 1021 HE ARG 78 HE ARG 78 -6.007 -12.533 3.268 1022 HB2 ARG 78 2HB ARG 78 -8.208 -13.258 5.101 1023 HB3 ARG 78 3HB ARG 78 -7.998 -11.840 4.070 1024 HG2 ARG 78 2HG ARG 78 -6.437 -10.829 5.588 1025 HG3 ARG 78 3HG ARG 78 -6.793 -11.997 6.858 1026 HD2 ARG 78 2HD ARG 78 -4.642 -12.455 5.908 1027 HD3 ARG 78 3HD ARG 78 -5.748 -13.796 5.608 1028 HH11 ARG 78 2HH2 ARG 78 -2.990 -13.127 4.999 1029 HH12 ARG 78 1HH2 ARG 78 -2.108 -13.274 3.473 1030 HH21 ARG 78 1HH1 ARG 78 -4.885 -12.824 1.492 1031 HH22 ARG 78 2HH1 ARG 78 -3.158 -13.167 1.507 1032 H SER 79 HN SER 79 -9.861 -9.335 4.648 1033 HA SER 79 HA SER 79 -12.563 -10.033 3.900 1034 HG SER 79 HG SER 79 -10.409 -6.767 2.774 1035 HB2 SER 79 2HB SER 79 -12.360 -7.969 2.457 1036 HB3 SER 79 3HB SER 79 -11.970 -7.704 4.165 1037 H ASP 80 HN ASP 80 -9.407 -9.997 2.176 1038 HA ASP 80 HA ASP 80 -10.388 -10.752 -0.370 1039 HB2 ASP 80 2HB ASP 80 -8.051 -11.469 -0.817 1040 HB3 ASP 80 3HB ASP 80 -8.191 -9.883 -0.051 1041 H HIS 81 HN HIS 81 -9.624 -12.756 2.487 1042 HA HIS 81 HA HIS 81 -9.920 -15.369 1.148 1043 HD1 HIS 81 1HD HIS 81 -7.486 -15.108 1.556 1044 HD2 HIS 81 2HD HIS 81 -8.283 -16.141 5.554 1045 HE1 HIS 81 1HE HIS 81 -5.328 -15.641 2.544 1046 HB2 HIS 81 2HB HIS 81 -10.078 -14.517 4.079 1047 HB3 HIS 81 3HB HIS 81 -10.361 -16.155 3.541 1048 H LEU 82 HN LEU 82 -12.064 -13.147 3.043 1049 HA LEU 82 HA LEU 82 -14.359 -14.863 2.981 1050 HG LEU 82 HG LEU 82 -16.467 -13.766 3.276 1051 HB2 LEU 82 2HB LEU 82 -14.124 -12.996 4.512 1052 HB3 LEU 82 3HB LEU 82 -14.180 -11.815 3.205 1053 HD11 LEU 82 1HD1 LEU 82 -16.361 -11.566 5.344 1054 HD12 LEU 82 2HD1 LEU 82 -16.084 -13.333 5.623 1055 HD13 LEU 82 3HD1 LEU 82 -17.635 -12.751 5.070 1056 HD21 LEU 82 3HD2 LEU 82 -17.819 -11.757 2.811 1057 HD22 LEU 82 1HD2 LEU 82 -16.495 -11.870 1.656 1058 HD23 LEU 82 2HD2 LEU 82 -16.388 -10.726 3.007 1059 H LYS 83 HN LYS 83 -13.378 -12.135 0.822 1060 HA LYS 83 HA LYS 83 -15.645 -12.323 -0.952 1061 HB2 LYS 83 2HB LYS 83 -14.024 -10.399 -0.781 1062 HB3 LYS 83 3HB LYS 83 -12.795 -11.382 -1.590 1063 HG2 LYS 83 2HG LYS 83 -14.224 -11.536 -3.605 1064 HG3 LYS 83 3HG LYS 83 -15.529 -10.678 -2.761 1065 HD2 LYS 83 2HD LYS 83 -14.052 -8.673 -2.559 1066 HD3 LYS 83 3HD LYS 83 -12.784 -9.538 -3.460 1067 HE2 LYS 83 2HE LYS 83 -14.329 -9.791 -5.384 1068 HE3 LYS 83 3HE LYS 83 -15.600 -8.950 -4.482 1069 HZ1 LYS 83 3HZ LYS 83 -13.013 -7.795 -5.284 1070 HZ2 LYS 83 1HZ LYS 83 -14.178 -7.003 -4.422 1071 HZ3 LYS 83 2HZ LYS 83 -14.470 -7.466 -5.974 1072 H THR 84 HN THR 84 -12.484 -13.990 -0.817 1073 HA THR 84 HA THR 84 -12.732 -15.381 -3.330 1074 HB THR 84 HB THR 84 -11.235 -15.949 -0.754 1075 HG1 THR 84 1HG THR 84 -10.399 -14.294 -1.686 1076 HG21 THR 84 3HG2 THR 84 -10.874 -17.473 -3.305 1077 HG22 THR 84 1HG2 THR 84 -11.407 -18.128 -1.727 1078 HG23 THR 84 2HG2 THR 84 -9.781 -17.460 -1.874 1079 H HIS 85 HN HIS 85 -13.465 -16.357 0.076 1080 HA HIS 85 HA HIS 85 -14.592 -18.905 -0.545 1081 HD1 HIS 85 1HD HIS 85 -15.731 -20.779 1.617 1082 HD2 HIS 85 2HD HIS 85 -17.300 -16.993 2.621 1083 HE1 HIS 85 1HE HIS 85 -18.138 -21.148 2.453 1084 HB2 HIS 85 2HB HIS 85 -13.970 -18.488 1.712 1085 HB3 HIS 85 3HB HIS 85 -14.863 -16.974 1.774 1086 H THR 86 HN THR 86 -15.966 -15.640 -0.481 1087 HA THR 86 HA THR 86 -18.713 -16.211 -0.582 1088 HB THR 86 HB THR 86 -17.130 -14.020 -1.983 1089 HG1 THR 86 1HG THR 86 -16.996 -14.082 0.278 1090 HG21 THR 86 3HG2 THR 86 -20.104 -14.051 -1.465 1091 HG22 THR 86 1HG2 THR 86 -19.279 -13.964 -3.053 1092 HG23 THR 86 2HG2 THR 86 -19.094 -12.640 -1.901 1093 H ARG 87 HN ARG 87 -16.246 -16.336 -3.212 1094 HA ARG 87 HA ARG 87 -18.116 -16.612 -5.398 1095 HE ARG 87 HE ARG 87 -14.730 -13.510 -7.238 1096 HB2 ARG 87 2HB ARG 87 -15.259 -17.627 -5.160 1097 HB3 ARG 87 3HB ARG 87 -16.199 -17.479 -6.641 1098 HG2 ARG 87 2HG ARG 87 -16.369 -14.989 -6.240 1099 HG3 ARG 87 3HG ARG 87 -15.288 -15.191 -4.860 1100 HD2 ARG 87 2HD ARG 87 -13.527 -16.063 -6.257 1101 HD3 ARG 87 3HD ARG 87 -14.570 -16.013 -7.694 1102 HH11 ARG 87 1HH2 ARG 87 -11.734 -15.333 -6.856 1103 HH12 ARG 87 2HH2 ARG 87 -10.770 -13.864 -6.727 1104 HH21 ARG 87 1HH1 ARG 87 -13.455 -11.763 -7.286 1105 HH22 ARG 87 2HH1 ARG 87 -11.713 -11.890 -7.108 1106 H THR 88 HN THR 88 -16.956 -18.856 -2.965 1107 HA THR 88 HA THR 88 -17.513 -21.334 -4.378 1108 HB THR 88 HB THR 88 -17.407 -22.440 -2.280 1109 HG1 THR 88 1HG THR 88 -17.523 -19.941 -0.948 1110 HG21 THR 88 3HG2 THR 88 -15.232 -21.690 -3.046 1111 HG22 THR 88 1HG2 THR 88 -15.311 -21.691 -1.274 1112 HG23 THR 88 2HG2 THR 88 -15.400 -20.162 -2.176 1113 H HIS 89 HN HIS 89 -19.528 -19.007 -2.611 1114 HA HIS 89 HA HIS 89 -21.904 -20.807 -2.833 1115 HD1 HIS 89 1HD HIS 89 -22.616 -21.688 -0.539 1116 HD2 HIS 89 2HD HIS 89 -20.579 -18.273 0.861 1117 HE1 HIS 89 1HE HIS 89 -21.884 -22.177 1.881 1118 HB2 HIS 89 2HB HIS 89 -21.516 -18.070 -1.548 1119 HB3 HIS 89 3HB HIS 89 -23.055 -18.919 -1.629 1120 H THR 90 HN THR 90 -20.342 -18.048 -4.311 1121 HA THR 90 HA THR 90 -22.799 -17.074 -5.582 1122 HB THR 90 HB THR 90 -19.939 -16.137 -6.024 1123 HG1 THR 90 1HG THR 90 -20.416 -16.072 -3.808 1124 HG21 THR 90 3HG2 THR 90 -22.559 -14.637 -6.283 1125 HG22 THR 90 1HG2 THR 90 -21.421 -15.020 -7.597 1126 HG23 THR 90 2HG2 THR 90 -20.945 -13.897 -6.325 1127 H GLY 91 HN GLY 91 -20.478 -19.471 -6.405 1128 HA2 GLY 91 2HA GLY 91 -20.224 -20.710 -8.353 1129 HA3 GLY 91 3HA GLY 91 -21.635 -19.881 -9.035 1130 H GLU 92 HN GLU 92 -19.179 -17.758 -7.865 1131 HA GLU 92 HA GLU 92 -18.781 -16.720 -10.547 1132 HB2 GLU 92 2HB GLU 92 -19.061 -15.294 -8.559 1133 HB3 GLU 92 3HB GLU 92 -17.577 -15.909 -7.863 1134 HG2 GLU 92 2HG GLU 92 -16.260 -14.853 -9.655 1135 HG3 GLU 92 3HG GLU 92 -17.741 -14.388 -10.503 1136 H LYS 93 HN LYS 93 -17.652 -18.332 -11.709 1137 HA LYS 93 HA LYS 93 -14.791 -18.694 -10.881 1138 HB2 LYS 93 2HB LYS 93 -16.663 -20.510 -12.442 1139 HB3 LYS 93 3HB LYS 93 -14.912 -20.733 -12.417 1140 HG2 LYS 93 2HG LYS 93 -14.886 -21.143 -10.056 1141 HG3 LYS 93 3HG LYS 93 -16.604 -20.742 -9.886 1142 HD2 LYS 93 2HD LYS 93 -17.320 -22.666 -11.031 1143 HD3 LYS 93 3HD LYS 93 -15.764 -22.936 -11.810 1144 HE2 LYS 93 2HE LYS 93 -16.226 -23.259 -8.818 1145 HE3 LYS 93 3HE LYS 93 -16.319 -24.574 -10.003 1146 HZ1 LYS 93 3HZ LYS 93 -14.031 -24.026 -10.643 1147 HZ2 LYS 93 1HZ LYS 93 -14.159 -24.556 -9.080 1148 HZ3 LYS 93 2HZ LYS 93 -13.945 -22.955 -9.396 1149 HA PRO 94 HA PRO 94 -14.875 -16.243 -14.794 1150 HB2 PRO 94 2HB PRO 94 -13.212 -14.199 -14.077 1151 HB3 PRO 94 3HB PRO 94 -14.911 -14.283 -13.525 1152 HG2 PRO 94 2HG PRO 94 -12.422 -15.145 -12.016 1153 HG3 PRO 94 3HG PRO 94 -13.766 -14.115 -11.432 1154 HD2 PRO 94 2HD PRO 94 -13.633 -16.799 -10.937 1155 HD3 PRO 94 3HD PRO 94 -15.190 -15.948 -11.179 1156 H PHE 95 HN PHE 95 -12.212 -17.566 -12.839 1157 HA PHE 95 HA PHE 95 -10.145 -17.018 -14.862 1158 HD1 PHE 95 2HD PHE 95 -7.951 -15.995 -13.518 1159 HD2 PHE 95 1HD PHE 95 -10.899 -17.393 -10.719 1160 HE1 PHE 95 2HE PHE 95 -7.584 -13.969 -12.124 1161 HE2 PHE 95 1HE PHE 95 -10.538 -15.367 -9.319 1162 HZ PHE 95 HZ PHE 95 -8.875 -13.658 -10.021 1163 HB2 PHE 95 2HB PHE 95 -10.096 -18.857 -12.425 1164 HB3 PHE 95 3HB PHE 95 -8.718 -18.395 -13.410 1165 H SER 96 HN SER 96 -11.315 -17.970 -16.701 1166 HA SER 96 HA SER 96 -11.576 -20.908 -16.817 1167 HG SER 96 HG SER 96 -13.252 -18.419 -17.374 1168 HB2 SER 96 2HB SER 96 -11.737 -18.864 -19.073 1169 HB3 SER 96 3HB SER 96 -12.356 -20.525 -19.084 1170 H CYS 97 HN CYS 97 -10.272 -22.333 -17.946 1171 HA CYS 97 HA CYS 97 -7.508 -21.614 -18.235 1172 HB2 CYS 97 2HB CYS 97 -8.526 -23.927 -17.727 1173 HB3 CYS 97 3HB CYS 97 -8.876 -24.006 -19.452 1174 H ARG 98 HN ARG 98 -6.202 -21.887 -20.188 1175 HA ARG 98 HA ARG 98 -7.622 -20.920 -22.636 1176 HE ARG 98 HE ARG 98 -7.787 -17.259 -23.340 1177 HB2 ARG 98 2HB ARG 98 -4.912 -19.950 -21.655 1178 HB3 ARG 98 3HB ARG 98 -5.798 -19.364 -23.054 1179 HG2 ARG 98 2HG ARG 98 -6.469 -18.923 -20.124 1180 HG3 ARG 98 3HG ARG 98 -5.917 -17.743 -21.299 1181 HD2 ARG 98 2HD ARG 98 -8.657 -19.001 -21.064 1182 HD3 ARG 98 3HD ARG 98 -8.211 -17.323 -20.931 1183 HH11 ARG 98 1HH2 ARG 98 -9.633 -20.151 -22.342 1184 HH12 ARG 98 2HH2 ARG 98 -10.359 -20.264 -23.931 1185 HH21 ARG 98 1HH1 ARG 98 -8.739 -17.564 -25.294 1186 HH22 ARG 98 2HH1 ARG 98 -9.858 -18.888 -25.527 1187 H TRP 99 HN TRP 99 -6.308 -23.561 -21.527 1188 HA TRP 99 HA TRP 99 -4.075 -24.116 -23.250 1189 HD1 TRP 99 1HD TRP 99 -4.207 -23.844 -20.148 1190 HE1 TRP 99 1HE TRP 99 -1.956 -24.341 -19.041 1191 HE3 TRP 99 3HE TRP 99 -3.047 -28.175 -22.613 1192 HZ2 TRP 99 2HZ TRP 99 0.130 -26.319 -19.256 1193 HZ3 TRP 99 3HZ TRP 99 -0.892 -29.325 -22.168 1194 HH2 TRP 99 2HH TRP 99 0.707 -28.401 -20.510 1195 HB2 TRP 99 2HB TRP 99 -5.966 -25.713 -21.527 1196 HB3 TRP 99 3HB TRP 99 -5.041 -26.589 -22.729 1197 HA PRO 100 HA PRO 100 -5.432 -24.800 -27.282 1198 HB2 PRO 100 2HB PRO 100 -4.741 -27.746 -26.960 1199 HB3 PRO 100 3HB PRO 100 -4.348 -26.651 -28.323 1200 HG2 PRO 100 2HG PRO 100 -2.469 -27.173 -26.461 1201 HG3 PRO 100 3HG PRO 100 -2.718 -25.484 -27.007 1202 HD2 PRO 100 2HD PRO 100 -3.656 -26.800 -24.467 1203 HD3 PRO 100 3HD PRO 100 -3.016 -25.146 -24.727 1204 H SER 101 HN SER 101 -6.662 -27.287 -25.025 1205 HA SER 101 HA SER 101 -9.333 -27.019 -26.252 1206 HG SER 101 HG SER 101 -8.134 -29.879 -24.774 1207 HB2 SER 101 2HB SER 101 -9.674 -29.431 -26.448 1208 HB3 SER 101 3HB SER 101 -8.278 -28.960 -27.433 1209 H CYS 102 HN CYS 102 -9.660 -25.853 -24.232 1210 HA CYS 102 HA CYS 102 -10.461 -27.697 -22.071 1211 HB2 CYS 102 2HB CYS 102 -8.128 -27.026 -21.507 1212 HB3 CYS 102 3HB CYS 102 -8.603 -25.315 -21.575 1213 H GLN 103 HN GLN 103 -11.906 -26.740 -20.542 1214 HA GLN 103 HA GLN 103 -12.896 -24.020 -21.045 1215 HB2 GLN 103 2HB GLN 103 -14.643 -26.500 -21.359 1216 HB3 GLN 103 3HB GLN 103 -15.333 -24.930 -20.975 1217 HG2 GLN 103 2HG GLN 103 -13.769 -25.515 -23.506 1218 HG3 GLN 103 3HG GLN 103 -15.517 -25.431 -23.345 1219 HE21 GLN 103 1HE2 GLN 103 -12.537 -23.501 -23.341 1220 HE22 GLN 103 2HE2 GLN 103 -13.415 -21.949 -23.487 1221 H LYS 104 HN LYS 104 -11.419 -25.629 -18.926 1222 HA LYS 104 HA LYS 104 -13.359 -25.937 -16.719 1223 HB2 LYS 104 2HB LYS 104 -10.339 -26.321 -16.986 1224 HB3 LYS 104 3HB LYS 104 -11.126 -26.241 -15.423 1225 HG2 LYS 104 2HG LYS 104 -11.090 -28.512 -15.760 1226 HG3 LYS 104 3HG LYS 104 -12.725 -28.068 -16.206 1227 HD2 LYS 104 2HD LYS 104 -12.115 -29.607 -17.854 1228 HD3 LYS 104 3HD LYS 104 -11.843 -28.067 -18.671 1229 HE2 LYS 104 2HE LYS 104 -9.410 -28.233 -17.916 1230 HE3 LYS 104 3HE LYS 104 -9.772 -29.883 -17.356 1231 HZ1 LYS 104 3HZ LYS 104 -9.898 -28.796 -20.073 1232 HZ2 LYS 104 1HZ LYS 104 -10.454 -30.322 -19.698 1233 HZ3 LYS 104 2HZ LYS 104 -8.852 -29.925 -19.528 1234 H LYS 105 HN LYS 105 -13.659 -24.541 -15.046 1235 HA LYS 105 HA LYS 105 -12.258 -21.910 -15.265 1236 HB2 LYS 105 2HB LYS 105 -15.210 -22.282 -14.585 1237 HB3 LYS 105 3HB LYS 105 -14.328 -20.783 -14.929 1238 HG2 LYS 105 2HG LYS 105 -13.880 -21.713 -17.259 1239 HG3 LYS 105 3HG LYS 105 -15.018 -23.009 -16.873 1240 HD2 LYS 105 2HD LYS 105 -16.861 -21.470 -16.672 1241 HD3 LYS 105 3HD LYS 105 -15.773 -20.073 -16.744 1242 HE2 LYS 105 2HE LYS 105 -16.832 -20.364 -18.917 1243 HE3 LYS 105 3HE LYS 105 -15.093 -20.668 -19.031 1244 HZ1 LYS 105 3HZ LYS 105 -15.581 -23.044 -18.948 1245 HZ2 LYS 105 1HZ LYS 105 -16.334 -22.329 -20.226 1246 HZ3 LYS 105 2HZ LYS 105 -17.196 -22.736 -18.881 1247 H PHE 106 HN PHE 106 -11.767 -20.835 -13.420 1248 HA PHE 106 HA PHE 106 -12.434 -22.226 -10.848 1249 HD1 PHE 106 1HD PHE 106 -10.577 -24.123 -9.869 1250 HD2 PHE 106 2HD PHE 106 -9.397 -22.333 -13.608 1251 HE1 PHE 106 1HE PHE 106 -10.282 -26.378 -10.863 1252 HE2 PHE 106 2HE PHE 106 -9.153 -24.581 -14.615 1253 HZ PHE 106 HZ PHE 106 -9.622 -26.608 -13.247 1254 HB2 PHE 106 2HB PHE 106 -9.782 -20.944 -11.656 1255 HB3 PHE 106 3HB PHE 106 -10.155 -21.651 -10.085 1256 H ALA 107 HN ALA 107 -12.188 -20.861 -8.920 1257 HA ALA 107 HA ALA 107 -13.249 -18.147 -9.515 1258 HB1 ALA 107 1HB ALA 107 -14.648 -19.599 -8.095 1259 HB2 ALA 107 2HB ALA 107 -13.291 -19.848 -6.969 1260 HB3 ALA 107 3HB ALA 107 -14.020 -18.245 -7.145 1261 H ARG 108 HN ARG 108 -10.299 -19.547 -8.927 1262 HA ARG 108 HA ARG 108 -9.270 -17.038 -7.697 1263 HE ARG 108 HE ARG 108 -7.247 -19.651 -4.700 1264 HB2 ARG 108 2HB ARG 108 -8.556 -19.879 -6.908 1265 HB3 ARG 108 3HB ARG 108 -7.624 -18.470 -6.433 1266 HG2 ARG 108 2HG ARG 108 -9.294 -17.668 -5.003 1267 HG3 ARG 108 3HG ARG 108 -10.578 -18.615 -5.762 1268 HD2 ARG 108 2HD ARG 108 -9.989 -19.533 -3.579 1269 HD3 ARG 108 3HD ARG 108 -9.729 -20.686 -4.883 1270 HH11 ARG 108 2HH1 ARG 108 -9.361 -20.605 -2.095 1271 HH12 ARG 108 1HH1 ARG 108 -8.020 -21.189 -1.121 1272 HH21 ARG 108 2HH2 ARG 108 -5.615 -20.415 -3.520 1273 HH22 ARG 108 1HH2 ARG 108 -5.908 -21.104 -1.928 1274 H SER 109 HN SER 109 -7.433 -16.272 -8.599 1275 HA SER 109 HA SER 109 -6.644 -17.102 -11.177 1276 HG SER 109 HG SER 109 -5.533 -14.465 -8.547 1277 HB2 SER 109 2HB SER 109 -4.604 -15.642 -10.711 1278 HB3 SER 109 3HB SER 109 -6.164 -14.856 -10.460 1279 H ASP 110 HN ASP 110 -5.202 -17.798 -7.960 1280 HA ASP 110 HA ASP 110 -2.976 -19.306 -9.000 1281 HB2 ASP 110 2HB ASP 110 -2.824 -20.134 -6.624 1282 HB3 ASP 110 3HB ASP 110 -2.724 -18.400 -6.856 1283 H GLU 111 HN GLU 111 -6.354 -20.176 -8.133 1284 HA GLU 111 HA GLU 111 -5.990 -23.055 -8.130 1285 HB2 GLU 111 2HB GLU 111 -8.383 -21.228 -8.534 1286 HB3 GLU 111 3HB GLU 111 -8.476 -22.905 -8.987 1287 HG2 GLU 111 2HG GLU 111 -7.870 -23.639 -6.732 1288 HG3 GLU 111 3HG GLU 111 -7.882 -21.968 -6.181 1289 H LEU 112 HN LEU 112 -6.663 -20.606 -10.682 1290 HA LEU 112 HA LEU 112 -6.821 -22.537 -12.826 1291 HG LEU 112 HG LEU 112 -5.338 -20.706 -14.924 1292 HB2 LEU 112 2HB LEU 112 -7.716 -20.296 -13.064 1293 HB3 LEU 112 3HB LEU 112 -6.116 -19.568 -12.861 1294 HD11 LEU 112 1HD1 LEU 112 -6.972 -22.660 -14.879 1295 HD12 LEU 112 2HD1 LEU 112 -6.816 -21.854 -16.392 1296 HD13 LEU 112 3HD1 LEU 112 -8.241 -21.520 -15.399 1297 HD21 LEU 112 3HD2 LEU 112 -7.863 -19.107 -15.427 1298 HD22 LEU 112 1HD2 LEU 112 -6.507 -19.353 -16.535 1299 HD23 LEU 112 2HD2 LEU 112 -6.264 -18.419 -15.047 1300 H VAL 113 HN VAL 113 -4.091 -20.489 -11.569 1301 HA VAL 113 HA VAL 113 -2.061 -21.432 -13.275 1302 HB VAL 113 HB VAL 113 -1.877 -20.759 -10.300 1303 HG11 VAL 113 1HG1 VAL 113 0.522 -20.266 -10.742 1304 HG12 VAL 113 2HG1 VAL 113 0.140 -21.979 -10.890 1305 HG13 VAL 113 3HG1 VAL 113 0.350 -20.994 -12.353 1306 HG21 VAL 113 3HG2 VAL 113 -1.216 -18.552 -10.911 1307 HG22 VAL 113 1HG2 VAL 113 -1.080 -18.987 -12.627 1308 HG23 VAL 113 2HG2 VAL 113 -2.660 -18.878 -11.880 1309 H ARG 114 HN ARG 114 -3.308 -22.892 -10.266 1310 HA ARG 114 HA ARG 114 -1.545 -25.171 -10.232 1311 HE ARG 114 HE ARG 114 -2.075 -25.749 -6.593 1312 HB2 ARG 114 2HB ARG 114 -2.870 -24.542 -8.285 1313 HB3 ARG 114 3HB ARG 114 -4.388 -24.859 -9.134 1314 HG2 ARG 114 2HG ARG 114 -3.906 -27.225 -9.331 1315 HG3 ARG 114 3HG ARG 114 -2.248 -27.005 -8.753 1316 HD2 ARG 114 2HD ARG 114 -4.752 -26.481 -7.107 1317 HD3 ARG 114 3HD ARG 114 -3.805 -27.982 -7.081 1318 HH11 ARG 114 1HH2 ARG 114 -4.551 -27.669 -4.945 1319 HH12 ARG 114 2HH2 ARG 114 -3.917 -27.258 -3.376 1320 HH21 ARG 114 1HH1 ARG 114 -1.345 -25.259 -4.497 1321 HH22 ARG 114 2HH1 ARG 114 -2.309 -25.881 -3.150 1322 H HIS 115 HN HIS 115 -4.898 -24.765 -11.555 1323 HA HIS 115 HA HIS 115 -5.229 -27.304 -12.655 1324 HD1 HIS 115 1HD HIS 115 -7.488 -28.235 -13.865 1325 HD2 HIS 115 2HD HIS 115 -6.578 -24.970 -16.361 1326 HE1 HIS 115 1HE HIS 115 -8.176 -28.894 -16.232 1327 HB2 HIS 115 2HB HIS 115 -6.996 -25.649 -12.675 1328 HB3 HIS 115 3HB HIS 115 -6.117 -24.613 -13.791 1329 H HIS 116 HN HIS 116 -3.701 -24.455 -14.272 1330 HA HIS 116 HA HIS 116 -2.963 -25.760 -16.677 1331 HD1 HIS 116 1HD HIS 116 -4.566 -24.023 -17.652 1332 HD2 HIS 116 2HD HIS 116 -1.962 -21.088 -16.031 1333 HE1 HIS 116 1HE HIS 116 -5.435 -21.812 -18.346 1334 HB2 HIS 116 2HB HIS 116 -1.548 -23.555 -15.132 1335 HB3 HIS 116 3HB HIS 116 -1.151 -24.037 -16.769 1336 H ASN 117 HN ASN 117 -1.380 -25.712 -13.448 1337 HA ASN 117 HA ASN 117 1.112 -26.920 -14.352 1338 HB2 ASN 117 2HB ASN 117 0.550 -25.540 -12.179 1339 HB3 ASN 117 3HB ASN 117 0.050 -27.085 -11.505 1340 HD21 ASN 117 1HD2 ASN 117 2.129 -28.778 -12.649 1341 HD22 ASN 117 2HD2 ASN 117 3.636 -28.179 -11.907 1342 H MET 118 HN MET 118 -2.078 -28.142 -13.739 1343 HA MET 118 HA MET 118 -1.035 -30.944 -13.499 1344 HB2 MET 118 2HB MET 118 -3.777 -29.770 -12.845 1345 HB3 MET 118 3HB MET 118 -3.340 -31.477 -12.695 1346 HG2 MET 118 2HG MET 118 -1.670 -30.947 -10.987 1347 HG3 MET 118 3HG MET 118 -1.968 -29.224 -11.184 1348 HE1 MET 118 3HE MET 118 -3.251 -32.606 -9.739 1349 HE2 MET 118 1HE MET 118 -4.866 -32.198 -9.125 1350 HE3 MET 118 2HE MET 118 -4.583 -32.279 -10.876 1351 H HIS 119 HN HIS 119 -1.956 -28.803 -15.854 1352 HA HIS 119 HA HIS 119 -4.063 -30.186 -17.193 1353 HD1 HIS 119 1HD HIS 119 -4.245 -30.066 -20.194 1354 HD2 HIS 119 2HD HIS 119 -5.186 -26.642 -17.961 1355 HE1 HIS 119 1HE HIS 119 -6.636 -29.307 -20.922 1356 HB2 HIS 119 2HB HIS 119 -2.989 -27.738 -17.412 1357 HB3 HIS 119 3HB HIS 119 -2.148 -28.494 -18.765 Start of MODEL 3 1 H5 DC 124 5H C 124 -4.000 -31.465 -5.115 2 H6 DC 124 6H C 124 -5.940 -31.176 -6.578 3 H5' DC 124 H5' C 124 -8.979 -32.503 -9.873 4 H5'' DC 124 H5" C 124 -7.521 -32.375 -8.855 5 H4' DC 124 H4' C 124 -10.373 -32.468 -7.784 6 H3' DC 124 H3' C 124 -9.092 -30.270 -8.998 7 H2' DC 124 H2' C 124 -7.437 -30.002 -7.396 8 H2'' DC 124 H2" C 124 -8.698 -29.052 -6.582 9 H1' DC 124 H1' C 124 -9.432 -30.880 -5.261 10 H41 DC 124 1H4 C 124 -4.446 -32.131 -1.527 11 H42 DC 124 2H4 C 124 -3.316 -31.890 -2.844 12 H8 DG 125 8H G 125 -9.163 -26.931 -5.672 13 H1 DG 125 1H G 125 -6.450 -29.115 -0.251 14 H5' DG 125 H5' G 125 -12.859 -29.668 -6.382 15 H5'' DG 125 H5" G 125 -13.997 -28.379 -6.841 16 H4' DG 125 H4' G 125 -13.811 -28.529 -4.393 17 H3' DG 125 H3' G 125 -13.398 -26.093 -5.752 18 H2' DG 125 H2' G 125 -11.115 -26.006 -5.357 19 H2'' DG 125 H2" G 125 -11.645 -25.245 -3.830 20 H1' DG 125 H1' G 125 -11.557 -27.313 -2.636 21 H21 DG 125 1H2 G 125 -7.923 -29.341 1.302 22 H22 DG 125 2H2 G 125 -9.623 -29.000 1.023 23 H5 DC 126 5H C 126 -8.018 -23.947 -4.300 24 H6 DC 126 6H C 126 -9.986 -23.503 -2.929 25 H5' DC 126 H5' C 126 -13.618 -26.103 -1.195 26 H5'' DC 126 H5" C 126 -14.611 -24.822 -0.489 27 H4' DC 126 H4' C 126 -12.679 -25.155 0.901 28 H3' DC 126 H3' C 126 -13.212 -22.624 -0.257 29 H2' DC 126 H2' C 126 -11.366 -22.744 -1.675 30 H2'' DC 126 H2" C 126 -10.576 -21.976 -0.263 31 H1' DC 126 H1' C 126 -10.053 -24.211 0.716 32 H41 DC 126 1H4 C 126 -5.013 -25.436 -2.824 33 H42 DC 126 2H4 C 126 -5.821 -24.911 -4.287 34 H8 DG 127 8H G 127 -9.652 -21.797 1.683 35 H1 DG 127 1H G 127 -3.414 -22.854 0.720 36 H5' DG 127 H5' G 127 -12.118 -23.667 3.932 37 H5'' DG 127 H5" G 127 -12.610 -22.567 5.234 38 H4' DG 127 H4' G 127 -10.530 -23.672 5.849 39 H3' DG 127 H3' G 127 -10.733 -20.875 5.735 40 H2' DG 127 H2' G 127 -9.242 -20.544 4.011 41 H2'' DG 127 H2" G 127 -8.006 -20.713 5.295 42 H1' DG 127 H1' G 127 -7.588 -22.971 4.759 43 H21 DG 127 1H2 G 127 -2.465 -23.390 2.588 44 H22 DG 127 2H2 G 127 -3.331 -23.348 4.112 45 H8 DG 128 8H G 128 -7.486 -18.663 4.222 46 H1 DG 128 1H G 128 -2.711 -19.677 0.023 47 H5' DG 128 H5' G 128 -6.745 -21.928 7.572 48 H5'' DG 128 H5" G 128 -6.630 -21.128 9.158 49 H4' DG 128 H4' G 128 -4.548 -20.646 8.094 50 H3' DG 128 H3' G 128 -6.270 -18.439 8.600 51 H2' DG 128 H2' G 128 -6.795 -18.092 6.301 52 H2'' DG 128 H2" G 128 -5.304 -17.085 6.444 53 H1' DG 128 H1' G 128 -3.898 -18.956 5.732 54 H21 DG 128 1H2 G 128 -0.831 -19.951 1.055 55 H22 DG 128 2H2 G 128 -0.750 -20.058 2.803 56 H8 DG 129 8H G 129 -3.357 -16.328 5.656 57 H1 DG 129 1H G 129 -1.030 -16.567 -0.308 58 H5' DG 129 H5' G 129 -1.632 -18.354 8.785 59 H5'' DG 129 H5" G 129 -1.010 -17.234 9.992 60 H4' DG 129 H4' G 129 0.581 -17.369 8.165 61 H3' DG 129 H3' G 129 -0.596 -14.834 8.726 62 H2' DG 129 H2' G 129 -1.768 -14.761 6.752 63 H2'' DG 129 H2" G 129 -0.268 -14.052 6.118 64 H1' DG 129 H1' G 129 0.512 -16.234 5.343 65 H21 DG 129 1H2 G 129 1.129 -16.448 -0.303 66 H22 DG 129 2H2 G 129 2.043 -16.306 1.190 67 H8 DG 130 8H G 130 0.613 -13.583 4.202 68 H1 DG 130 1H G 130 -0.636 -12.815 -2.023 69 H5' DG 130 H5' G 130 3.039 -15.509 5.539 70 H5'' DG 130 H5" G 130 4.125 -14.620 6.612 71 H4' DG 130 H4' G 130 5.128 -14.366 4.555 72 H3' DG 130 H3' G 130 4.201 -12.049 5.759 73 H2' DG 130 H2' G 130 2.313 -11.711 4.407 74 H2'' DG 130 H2" G 130 3.509 -10.935 3.342 75 H1' DG 130 H1' G 130 3.676 -12.784 1.933 76 H21 DG 130 1H2 G 130 1.169 -12.326 -3.128 77 H22 DG 130 2H2 G 130 2.709 -12.087 -2.317 78 H8 DG 131 8H G 131 2.632 -9.469 2.348 79 H1 DG 131 1H G 131 -1.939 -9.398 -2.142 80 H5' DG 131 H5' G 131 5.891 -11.732 1.642 81 H5'' DG 131 H5" G 131 7.385 -10.775 1.755 82 H4' DG 131 H4' G 131 6.601 -10.265 -0.395 83 H3' DG 131 H3' G 131 6.510 -8.148 1.547 84 H2' DG 131 H2' G 131 4.213 -8.073 1.632 85 H2'' DG 131 H2" G 131 4.401 -7.056 0.211 86 H1' DG 131 H1' G 131 3.864 -8.855 -1.290 87 H21 DG 131 1H2 G 131 -1.107 -8.894 -4.086 88 H22 DG 131 2H2 G 131 0.612 -8.593 -4.301 89 H5 DC 132 5H C 132 1.344 -6.508 1.565 90 H6 DC 132 6H C 132 2.803 -5.819 -0.252 91 H5' DC 132 H5' C 132 5.176 -7.631 -2.723 92 H5'' DC 132 H5" C 132 6.304 -6.480 -3.445 93 H4' DC 132 H4' C 132 4.319 -6.084 -4.608 94 H3' DC 132 H3' C 132 5.234 -4.043 -2.869 95 H2' DC 132 H2' C 132 3.500 -4.198 -1.389 96 H2'' DC 132 H2" C 132 2.695 -3.128 -2.534 97 H1' DC 132 H1' C 132 1.580 -4.985 -3.674 98 H41 DC 132 1H4 C 132 -2.273 -6.786 1.093 99 H42 DC 132 2H4 C 132 -0.902 -7.179 2.109 100 H8 DG 133 8H G 133 1.254 -1.890 -3.053 101 H1 DG 133 1H G 133 -4.924 -2.794 -1.538 102 H5' DG 133 H5' G 133 2.591 -3.415 -6.610 103 H5'' DG 133 H5" G 133 3.274 -2.009 -7.458 104 H4' DG 133 H4' G 133 0.875 -2.180 -7.955 105 H3' DG 133 H3' G 133 2.043 0.145 -6.942 106 H2' DG 133 H2' G 133 1.306 -0.142 -4.759 107 H2'' DG 133 H2" G 133 -0.059 0.809 -5.322 108 H1' DG 133 H1' G 133 -1.329 -1.229 -5.906 109 H21 DG 133 1H2 G 133 -6.188 -2.334 -3.229 110 H22 DG 133 2H2 G 133 -5.541 -1.679 -4.715 111 H5' DT 134 H5' T 134 -2.468 -0.156 -7.352 112 H5'' DT 134 H5" T 134 -2.747 1.113 -8.560 113 H4' DT 134 H4' T 134 -4.730 1.121 -7.271 114 H3' DT 134 H3' T 134 -3.060 3.397 -7.288 115 H2' DT 134 H2' T 134 -2.283 3.129 -5.101 116 H2'' DT 134 H2" T 134 -3.716 4.092 -4.756 117 H1' DT 134 H1' T 134 -5.077 2.102 -4.313 118 H3 DT 134 3H T 134 -4.203 0.447 -0.178 119 H71 DT 134 1H7 T 134 0.404 0.249 -1.424 120 H72 DT 134 2H7 T 134 0.535 1.676 -2.483 121 H73 DT 134 3H7 T 134 0.297 1.899 -0.725 122 H6 DT 134 6H T 134 -1.382 1.803 -3.838 123 H5 DC 135 5H C 135 -3.664 4.740 -2.690 124 H6 DC 135 6H C 135 -5.511 5.216 -4.224 125 H5' DC 135 H5' C 135 -7.506 3.608 -7.305 126 H5'' DC 135 H5" C 135 -8.284 4.992 -8.092 127 H4' DC 135 H4' C 135 -9.634 4.318 -6.164 128 H3' DC 135 H3' C 135 -8.586 6.960 -6.451 129 H2' DC 135 H2' C 135 -7.003 6.628 -4.743 130 H2'' DC 135 H2" C 135 -8.321 7.209 -3.741 131 H1' DC 135 H1' C 135 -9.065 4.901 -3.225 132 H41 DC 135 1H4 C 135 -4.232 3.293 0.613 133 H42 DC 135 2H4 C 135 -3.080 3.880 -0.549 134 H5' DT 136 H5' T 136 -10.854 5.316 -2.510 135 H5'' DT 136 H5" T 136 -12.367 6.113 -2.953 136 H4' DT 136 H4' T 136 -12.536 6.045 -0.630 137 H3' DT 136 H3' T 136 -12.239 8.632 -1.741 138 H2' DT 136 H2' T 136 -10.110 9.093 -1.171 139 H2'' DT 136 H2" T 136 -10.722 9.542 0.375 140 H1' DT 136 H1' T 136 -10.186 7.523 1.403 141 H3 DT 136 3H T 136 -5.770 6.556 1.789 142 H71 DT 136 1H7 T 136 -5.222 7.684 -2.886 143 H72 DT 136 2H7 T 136 -6.550 8.852 -3.081 144 H73 DT 136 3H7 T 136 -5.136 9.272 -2.086 145 H6 DT 136 6H T 136 -8.458 8.261 -1.823 146 H8 DG 137 8H G 137 -9.679 10.354 1.823 147 H1 DG 137 1H G 137 -3.733 9.436 4.024 148 H5' DG 137 H5' G 137 -11.953 7.496 2.526 149 H5'' DG 137 H5" G 137 -13.497 8.111 3.116 150 H4' DG 137 H4' G 137 -12.347 7.959 5.057 151 H3' DG 137 H3' G 137 -12.964 10.536 4.228 152 H2' DG 137 H2' G 137 -10.872 11.124 3.451 153 H2'' DG 137 H2" G 137 -10.624 11.615 5.112 154 H1' DG 137 H1' G 137 -9.351 9.680 5.633 155 H21 DG 137 1H2 G 137 -3.762 8.859 6.097 156 H22 DG 137 2H2 G 137 -5.260 8.782 7.008 157 H5 DC 138 5H C 138 -8.553 13.075 4.116 158 H6 DC 138 6H C 138 -9.135 12.298 6.361 159 H5' DC 138 H5' C 138 -10.331 9.307 7.704 160 H5'' DC 138 H5" C 138 -11.284 9.789 9.106 161 H4' DC 138 H4' C 138 -9.123 9.576 9.946 162 H3' DC 138 H3' C 138 -10.349 12.111 10.020 163 H2' DC 138 H2' C 138 -9.112 13.076 8.356 164 H2'' DC 138 H2" C 138 -7.932 13.374 9.606 165 H1' DC 138 H1' C 138 -6.555 11.561 8.976 166 H41 DC 138 1H4 C 138 -5.075 13.280 3.049 167 H42 DC 138 2H4 C 138 -6.766 13.376 2.594 168 H8 DG 139 8H G 139 -6.376 14.743 9.764 169 H1 DG 139 1H G 139 -2.100 15.833 5.130 170 H5' DG 139 H5' G 139 -6.137 11.130 11.215 171 H5'' DG 139 H5" G 139 -6.172 11.344 12.965 172 H4' DG 139 H4' G 139 -3.911 11.442 12.426 173 H3' DG 139 H3' G 139 -5.098 13.643 13.619 174 H2' DG 139 H2' G 139 -5.378 14.912 11.697 175 H2'' DG 139 H2" G 139 -3.770 15.494 12.124 176 H1' DG 139 H1' G 139 -2.670 14.016 10.645 177 H21 DG 139 1H2 G 139 -0.093 15.448 5.827 178 H22 DG 139 2H2 G 139 0.226 14.970 7.488 179 H5 DC 140 5H C 140 -4.158 17.665 10.592 180 H6 DC 140 6H C 140 -2.135 16.868 11.718 181 H5' DC 140 H5' C 140 -0.722 13.431 12.154 182 H5'' DC 140 H5" C 140 0.200 13.705 13.636 183 H4' DC 140 H4' C 140 1.607 14.192 11.774 184 H3' DC 140 H3' C 140 1.294 16.021 13.815 185 H2' DC 140 H2' C 140 -0.298 17.391 12.738 186 H2'' DC 140 H2" C 140 1.185 18.219 12.180 187 H1' DC 140 H1' C 140 1.250 17.036 10.124 188 H41 DC 140 1H4 C 140 -4.008 18.977 7.180 189 H42 DC 140 2H4 C 140 -5.012 18.562 8.549 190 H8 DG 141 8H G 141 -3.426 21.620 0.949 191 H1 DG 141 1H G 141 -1.612 18.701 6.386 192 H5' DG 141 H5' G 141 -0.781 24.521 -0.494 193 H5'' DG 141 H5" G 141 -0.958 23.890 -2.136 194 H4' DG 141 H4' G 141 0.905 22.855 -0.910 195 H3' DG 141 H3' G 141 -0.917 21.429 -2.432 196 H2' DG 141 H2' G 141 -2.197 20.631 -0.701 197 H2'' DG 141 H2" G 141 -1.008 19.319 -0.682 198 H1' DG 141 H1' G 141 0.234 20.305 1.074 199 H21 DG 141 1H2 G 141 0.522 18.272 6.359 200 H22 DG 141 2H2 G 141 1.507 18.569 4.933 201 H5 DC 142 5H C 142 -2.630 17.760 0.487 202 H6 DC 142 6H C 142 -0.278 17.317 0.051 203 H5' DC 142 H5' C 142 2.002 19.591 0.596 204 H5'' DC 142 H5" C 142 3.213 19.332 -0.649 205 H4' DC 142 H4' C 142 4.020 18.037 0.965 206 H3' DC 142 H3' C 142 3.219 16.617 -1.198 207 H2' DC 142 H2' C 142 1.130 15.974 -0.466 208 H2'' DC 142 H2" C 142 1.934 14.623 0.229 209 H1' DC 142 H1' C 142 1.955 15.507 2.427 210 H41 DC 142 1H4 C 142 -4.153 16.806 3.659 211 H42 DC 142 2H4 C 142 -4.364 17.564 2.094 212 H8 DG 143 8H G 143 1.562 13.022 1.412 213 H1 DG 143 1H G 143 -3.684 12.456 5.042 214 H5' DG 143 H5' G 143 4.099 15.351 3.392 215 H5'' DG 143 H5" G 143 5.641 14.581 2.940 216 H4' DG 143 H4' G 143 4.979 13.533 4.927 217 H3' DG 143 H3' G 143 5.324 11.905 2.716 218 H2' DG 143 H2' G 143 3.102 11.741 2.105 219 H2'' DG 143 H2" G 143 3.065 10.375 3.167 220 H1' DG 143 H1' G 143 2.121 11.581 4.969 221 H21 DG 143 1H2 G 143 -3.183 11.656 6.992 222 H22 DG 143 2H2 G 143 -1.532 11.227 7.419 223 H5 DC 144 5H C 144 0.799 9.471 2.024 224 H6 DC 144 6H C 144 1.805 8.691 4.113 225 H5' DC 144 H5' C 144 3.196 10.947 6.501 226 H5'' DC 144 H5" C 144 4.420 9.888 7.167 227 H4' DC 144 H4' C 144 2.534 9.469 8.455 228 H3' DC 144 H3' C 144 3.724 7.398 7.014 229 H2' DC 144 H2' C 144 2.162 7.074 5.373 230 H2'' DC 144 H2" C 144 1.337 6.116 6.585 231 H1' DC 144 H1' C 144 -0.206 7.787 7.113 232 H41 DC 144 1H4 C 144 -2.846 9.882 1.729 233 H42 DC 144 2H4 C 144 -1.284 10.064 0.955 234 H8 DA 145 8H A 145 -0.168 4.955 5.990 235 H2 DA 145 2H A 145 -6.236 6.290 4.381 236 H5' DA 145 H5' A 145 0.010 7.283 9.708 237 H5'' DA 145 H5" A 145 0.153 5.953 10.884 238 H4' DA 145 H4' A 145 -2.181 6.298 10.326 239 H3' DA 145 H3' A 145 -0.917 3.784 10.136 240 H2' DA 145 H2' A 145 -0.879 3.797 7.804 241 H2'' DA 145 H2" A 145 -2.493 3.090 7.984 242 H1' DA 145 H1' A 145 -3.592 5.208 7.816 243 H61 DA 145 2H6 A 145 -1.855 5.884 1.577 244 H62 DA 145 1H6 A 145 -3.418 6.372 0.949 245 H8 DG 146 8H G 146 -3.892 1.625 7.288 246 H1 DG 146 1H G 146 -5.736 3.359 1.394 247 H5' DG 146 H5' G 146 -5.198 4.529 9.882 248 H5'' DG 146 H5" G 146 -6.363 4.434 11.179 249 H4' DG 146 H4' G 146 -7.853 3.909 9.615 250 H3' DG 146 H3' G 146 -6.846 1.397 10.441 251 H2' DG 146 H2' G 146 -5.574 1.008 8.538 252 H2'' DG 146 H2" G 146 -7.114 0.375 7.920 253 H1' DG 146 H1' G 146 -7.680 2.413 6.858 254 H21 DG 146 1H2 G 146 -7.838 3.787 1.337 255 H22 DG 146 2H2 G 146 -8.811 3.819 2.787 256 H8 DA 147 8H A 147 -6.825 -1.245 6.465 257 H2 DA 147 2H A 147 -6.494 0.379 0.262 258 H5' DA 147 H5' A 147 -10.070 1.841 7.476 259 H5'' DA 147 H5" A 147 -11.472 0.804 7.769 260 H4' DA 147 H4' A 147 -11.229 1.110 5.370 261 H3' DA 147 H3' A 147 -11.200 -1.433 6.700 262 H2' DA 147 H2' A 147 -9.040 -2.028 6.127 263 H2'' DA 147 H2" A 147 -9.769 -2.473 4.545 264 H1' DA 147 H1' A 147 -9.368 -0.330 3.632 265 H61 DA 147 2H6 A 147 -2.771 -0.894 3.716 266 H62 DA 147 1H6 A 147 -2.497 -0.393 2.055 267 H5 DC 148 5H C 148 -7.079 -3.456 3.294 268 H6 DC 148 6H C 148 -9.364 -3.364 2.435 269 H5' DC 148 H5' C 148 -12.475 -0.803 2.036 270 H5'' DC 148 H5" C 148 -13.821 -1.942 1.826 271 H4' DC 148 H4' C 148 -12.710 -1.673 -0.311 272 H3' DC 148 H3' C 148 -13.076 -4.183 0.952 273 H2' DC 148 H2' C 148 -10.862 -4.486 1.461 274 H2'' DC 148 H2" C 148 -10.808 -5.234 -0.131 275 H1' DC 148 H1' C 148 -10.135 -3.171 -1.197 276 H41 DC 148 1H4 C 148 -4.195 -3.141 1.035 277 H42 DC 148 2H4 C 148 -4.755 -3.441 2.676 278 H8 DG 149 8H G 149 -9.205 -6.767 -0.899 279 H1 DG 149 1H G 149 -2.826 -5.872 -1.182 280 H5' DG 149 H5' G 149 -10.770 -3.459 -3.089 281 H5'' DG 149 H5" G 149 -12.047 -4.119 -4.111 282 H4' DG 149 H4' G 149 -10.073 -4.409 -5.394 283 H3' DG 149 H3' G 149 -11.524 -6.664 -4.532 284 H2' DG 149 H2' G 149 -10.086 -7.361 -2.858 285 H2'' DG 149 H2" G 149 -9.282 -8.235 -4.163 286 H1' DG 149 H1' G 149 -7.676 -6.442 -4.487 287 H21 DG 149 1H2 G 149 -2.206 -5.643 -3.265 288 H22 DG 149 2H2 G 149 -3.368 -5.645 -4.578 289 H5 DC 150 5H C 150 -6.994 -9.584 -1.674 290 H6 DC 150 6H C 150 -7.157 -9.815 -4.094 291 H5' DC 150 H5' C 150 -8.223 -9.133 -5.707 292 H5'' DC 150 H5" C 150 -8.007 -7.435 -6.207 293 H4' DC 150 H4' C 150 -6.730 -8.206 -8.170 294 H3' DC 150 H3' C 150 -7.771 -10.706 -7.664 295 H2' DC 150 H2' C 150 -6.740 -11.168 -5.644 296 H2'' DC 150 H2" C 150 -5.444 -11.700 -6.675 297 H1' DC 150 H1' C 150 -4.134 -9.788 -6.322 298 H41 DC 150 1H4 C 150 -3.725 -9.393 -0.032 299 H42 DC 150 2H4 C 150 -5.467 -9.442 0.190 300 H5 DC 151 5H C 151 -5.118 -12.852 -4.345 301 H6 DC 151 6H C 151 -3.939 -12.862 -6.491 302 H5' DC 151 H5' C 151 -3.492 -10.216 -9.124 303 H5'' DC 151 H5" C 151 -3.264 -11.264 -10.533 304 H4' DC 151 H4' C 151 -1.124 -10.897 -9.491 305 H3' DC 151 H3' C 151 -2.144 -13.477 -9.979 306 H2' DC 151 H2' C 151 -2.647 -13.953 -7.801 307 H2'' DC 151 H2" C 151 -0.972 -14.448 -7.686 308 H1' DC 151 H1' C 151 -0.259 -12.366 -6.775 309 H41 DC 151 1H4 C 151 -3.226 -12.909 -1.221 310 H42 DC 151 2H4 C 151 -4.800 -12.799 -1.972 311 H5 DC 152 5H C 152 -3.128 -15.786 -4.941 312 H6 DC 152 6H C 152 -0.954 -15.808 -6.066 313 H5' DC 152 H5' C 152 1.685 -13.244 -7.563 314 H5'' DC 152 H5" C 152 2.957 -14.019 -8.526 315 H4' DC 152 H4' C 152 3.572 -14.620 -6.351 316 H3' DC 152 H3' C 152 2.547 -16.715 -7.996 317 H2' DC 152 H2' C 152 0.671 -17.125 -6.706 318 H2'' DC 152 H2" C 152 1.797 -18.126 -5.755 319 H1' DC 152 H1' C 152 2.270 -16.351 -4.216 320 H41 DC 152 1H4 C 152 -3.367 -16.223 -1.288 321 H42 DC 152 2H4 C 152 -4.228 -16.030 -2.803 322 H5 DC 153 5H C 153 -1.288 -19.566 -4.694 323 H6 DC 153 6H C 153 1.118 -19.961 -4.433 324 H5' DC 153 H5' C 153 4.326 -17.605 -4.099 325 H5'' DC 153 H5" C 153 5.778 -18.555 -4.420 326 H4' DC 153 H4' C 153 5.212 -19.174 -2.254 327 H3' DC 153 H3' C 153 4.911 -21.180 -4.262 328 H2' DC 153 H2' C 153 2.644 -21.324 -4.113 329 H2'' DC 153 H2" C 153 2.970 -22.386 -2.745 330 H1' DC 153 H1' C 153 2.710 -20.608 -1.115 331 H41 DC 153 1H4 C 153 -3.510 -19.319 -1.789 332 H42 DC 153 2H4 C 153 -3.410 -19.642 -3.509 333 H5 DC 154 5H C 154 -0.191 -22.916 -3.071 334 H6 DC 154 6H C 154 1.658 -23.515 -1.584 335 H5' DC 154 H5' C 154 4.632 -21.811 0.036 336 H5'' DC 154 H5" C 154 5.792 -23.056 0.520 337 H4' DC 154 H4' C 154 4.115 -23.019 2.195 338 H3' DC 154 H3' C 154 4.500 -25.365 0.569 339 H2' DC 154 H2' C 154 2.371 -25.425 -0.327 340 H2'' DC 154 H2" C 154 1.914 -26.085 1.272 341 H1' DC 154 H1' C 154 1.203 -24.000 2.092 342 H41 DC 154 1H4 C 154 -3.627 -22.705 -1.803 343 H42 DC 154 2H4 C 154 -2.550 -22.502 -3.172 344 H8 DG 155 8H G 155 0.557 -27.647 0.874 345 H1 DG 155 1H G 155 -5.503 -25.853 -0.272 346 H5' DG 155 H5' G 155 2.275 -25.553 4.539 347 H5'' DG 155 H5" G 155 2.744 -26.939 5.536 348 H4' DG 155 H4' G 155 0.377 -26.509 5.841 349 H3' DG 155 H3' G 155 1.436 -28.971 5.024 350 H2' DG 155 H2' G 155 0.646 -28.830 2.833 351 H2'' DG 155 H2" G 155 -0.798 -29.573 3.590 352 H1' DG 155 H1' G 155 -1.822 -27.434 3.962 353 H21 DG 155 1H2 G 155 -6.675 -25.921 1.570 354 H22 DG 155 2H2 G 155 -5.937 -26.309 3.117 355 H5 DC 156 5H C 156 -1.611 -30.496 1.065 356 H6 DC 156 6H C 156 -2.452 -30.922 3.332 357 H5' DC 156 H5' C 156 -2.677 -28.755 6.990 358 H5'' DC 156 H5" C 156 -3.048 -30.049 8.149 359 H4' DC 156 H4' C 156 -5.065 -29.434 6.920 360 H3' DC 156 H3' C 156 -3.962 -32.091 6.964 361 H2' DC 156 H2' C 156 -3.670 -32.200 4.659 362 H2'' DC 156 H2" C 156 -5.426 -32.522 4.694 363 H1' DC 156 H1' C 156 -6.020 -30.258 4.296 364 H41 DC 156 1H4 C 156 -3.881 -29.308 -1.579 365 H42 DC 156 2H4 C 156 -2.232 -29.692 -1.129 366 H8 DG 157 8H G 157 -6.431 -34.912 4.630 367 H1 DG 157 1H G 157 -6.818 -32.158 -1.150 368 H5' DG 157 H5' G 157 -8.722 -31.542 7.283 369 H5'' DG 157 H5" G 157 -9.510 -32.765 8.303 370 H4' DG 157 H4' G 157 -10.790 -32.368 6.221 371 H3' DG 157 H3' G 157 -10.163 -34.923 7.084 372 H2' DG 157 H2' G 157 -8.298 -35.237 5.670 373 H2'' DG 157 H2" G 157 -9.588 -35.925 4.624 374 H1' DG 157 H1' G 157 -9.952 -33.837 3.514 375 H21 DG 157 1H2 G 157 -8.927 -31.743 -1.593 376 H22 DG 157 2H2 G 157 -10.182 -31.962 -0.390 377 HA ALA 1 HA ALA 1 -5.490 20.686 -16.514 378 H1 ALA 1 HN ALA 1 -6.754 18.869 -17.898 379 HB1 ALA 1 1HB ALA 1 -7.250 21.259 -18.161 380 HB2 ALA 1 2HB ALA 1 -8.505 20.920 -16.947 381 HB3 ALA 1 3HB ALA 1 -7.377 22.274 -16.713 382 H SER 2 HN SER 2 -7.225 18.349 -14.862 383 HA SER 2 HA SER 2 -8.223 19.789 -12.577 384 HG SER 2 HG SER 2 -7.535 15.788 -12.892 385 HB2 SER 2 2HB SER 2 -8.124 17.517 -11.476 386 HB3 SER 2 3HB SER 2 -9.002 17.550 -13.018 387 H GLU 3 HN GLU 3 -5.060 18.328 -13.375 388 HA GLU 3 HA GLU 3 -3.941 18.962 -10.724 389 HB2 GLU 3 2HB GLU 3 -2.646 17.869 -13.265 390 HB3 GLU 3 3HB GLU 3 -1.855 17.994 -11.683 391 HG2 GLU 3 2HG GLU 3 -3.468 16.429 -10.704 392 HG3 GLU 3 3HG GLU 3 -4.314 16.290 -12.253 393 H LYS 4 HN LYS 4 -4.906 21.311 -11.922 394 HA LYS 4 HA LYS 4 -2.801 22.726 -13.362 395 HB2 LYS 4 2HB LYS 4 -4.300 24.719 -12.989 396 HB3 LYS 4 3HB LYS 4 -5.068 23.362 -13.782 397 HG2 LYS 4 2HG LYS 4 -6.319 22.751 -11.810 398 HG3 LYS 4 3HG LYS 4 -5.360 23.810 -10.783 399 HD2 LYS 4 2HD LYS 4 -7.528 24.816 -11.189 400 HD3 LYS 4 3HD LYS 4 -6.246 25.798 -11.894 401 HE2 LYS 4 2HE LYS 4 -8.123 25.732 -13.416 402 HE3 LYS 4 3HE LYS 4 -6.767 24.858 -14.143 403 HZ1 LYS 4 3HZ LYS 4 -7.783 22.810 -13.531 404 HZ2 LYS 4 1HZ LYS 4 -8.888 23.703 -14.358 405 HZ3 LYS 4 2HZ LYS 4 -9.006 23.571 -12.718 406 H ARG 5 HN ARG 5 -1.469 21.742 -11.201 407 HA ARG 5 HA ARG 5 -0.517 24.177 -9.891 408 HE ARG 5 HE ARG 5 -3.628 19.535 -6.434 409 HB2 ARG 5 2HB ARG 5 -0.956 23.508 -7.569 410 HB3 ARG 5 3HB ARG 5 -2.474 23.590 -8.451 411 HG2 ARG 5 2HG ARG 5 -2.179 21.034 -8.820 412 HG3 ARG 5 3HG ARG 5 -0.924 21.105 -7.590 413 HD2 ARG 5 2HD ARG 5 -2.405 21.442 -5.871 414 HD3 ARG 5 3HD ARG 5 -3.520 22.402 -6.847 415 HH11 ARG 5 1HH2 ARG 5 -4.515 22.057 -8.764 416 HH12 ARG 5 2HH2 ARG 5 -5.610 20.941 -9.595 417 HH21 ARG 5 1HH1 ARG 5 -5.130 18.271 -7.581 418 HH22 ARG 5 2HH1 ARG 5 -5.939 19.012 -8.963 419 HA PRO 6 HA PRO 6 3.086 21.506 -9.693 420 HB2 PRO 6 2HB PRO 6 4.726 22.930 -8.047 421 HB3 PRO 6 3HB PRO 6 4.238 23.557 -9.650 422 HG2 PRO 6 2HG PRO 6 3.006 24.202 -6.947 423 HG3 PRO 6 3HG PRO 6 3.541 25.349 -8.217 424 HD2 PRO 6 2HD PRO 6 0.937 24.517 -7.936 425 HD3 PRO 6 3HD PRO 6 1.647 24.921 -9.531 426 H PHE 7 HN PHE 7 4.558 20.455 -7.953 427 HA PHE 7 HA PHE 7 3.161 20.087 -5.337 428 HD1 PHE 7 1HD PHE 7 0.944 17.970 -5.101 429 HD2 PHE 7 2HD PHE 7 2.593 18.259 -9.042 430 HE1 PHE 7 1HE PHE 7 -1.353 18.102 -6.037 431 HE2 PHE 7 2HE PHE 7 0.306 18.280 -10.005 432 HZ PHE 7 HZ PHE 7 -1.672 18.250 -8.509 433 HB2 PHE 7 2HB PHE 7 4.010 17.754 -7.101 434 HB3 PHE 7 3HB PHE 7 3.342 17.629 -5.475 435 H MET 8 HN MET 8 4.605 19.759 -3.615 436 HA MET 8 HA MET 8 7.360 18.795 -4.344 437 HB2 MET 8 2HB MET 8 8.393 20.295 -2.821 438 HB3 MET 8 3HB MET 8 7.335 21.263 -3.846 439 HG2 MET 8 2HG MET 8 6.735 20.391 -0.995 440 HG3 MET 8 3HG MET 8 7.307 21.973 -1.491 441 HE1 MET 8 3HE MET 8 4.718 21.089 0.331 442 HE2 MET 8 1HE MET 8 5.248 22.779 0.158 443 HE3 MET 8 2HE MET 8 3.553 22.340 -0.158 444 H CYS 9 HN CYS 9 8.451 17.584 -2.828 445 HA CYS 9 HA CYS 9 6.860 15.953 -1.048 446 HB2 CYS 9 2HB CYS 9 8.956 15.130 -2.029 447 HB3 CYS 9 3HB CYS 9 9.874 16.415 -1.229 448 H ALA 10 HN ALA 10 6.718 16.011 1.207 449 HA ALA 10 HA ALA 10 7.832 18.419 2.569 450 HB1 ALA 10 1HB ALA 10 5.502 18.932 2.149 451 HB2 ALA 10 2HB ALA 10 4.984 17.361 2.842 452 HB3 ALA 10 3HB ALA 10 5.709 18.614 3.867 453 H TYR 11 HN TYR 11 8.364 15.344 2.325 454 HA TYR 11 HA TYR 11 8.100 14.453 5.115 455 HD1 TYR 11 1HD TYR 11 7.828 11.791 5.570 456 HD2 TYR 11 2HD TYR 11 11.750 12.790 4.095 457 HE1 TYR 11 1HE TYR 11 8.841 10.812 7.592 458 HE2 TYR 11 2HE TYR 11 12.779 11.690 6.086 459 HH TYR 11 HH TYR 11 10.808 10.206 8.663 460 HB2 TYR 11 2HB TYR 11 8.191 12.798 3.264 461 HB3 TYR 11 3HB TYR 11 9.798 13.391 2.820 462 HA PRO 12 HA PRO 12 11.447 17.246 6.230 463 HB2 PRO 12 2HB PRO 12 11.810 16.348 8.849 464 HB3 PRO 12 3HB PRO 12 10.507 17.439 8.318 465 HG2 PRO 12 2HG PRO 12 10.366 14.439 8.691 466 HG3 PRO 12 3HG PRO 12 9.220 15.689 9.276 467 HD2 PRO 12 2HD PRO 12 8.751 14.275 7.036 468 HD3 PRO 12 3HD PRO 12 8.341 16.023 7.096 469 H GLY 13 HN GLY 13 13.075 16.432 4.801 470 HA2 GLY 13 2HA GLY 13 15.376 15.212 5.536 471 HA3 GLY 13 3HA GLY 13 14.254 13.842 5.355 472 H CYS 14 HN CYS 14 12.633 15.396 3.359 473 HA CYS 14 HA CYS 14 14.482 15.809 1.054 474 HB2 CYS 14 2HB CYS 14 13.451 13.574 0.793 475 HB3 CYS 14 3HB CYS 14 11.869 14.302 1.087 476 H ASN 15 HN ASN 15 12.907 16.845 -0.810 477 HA ASN 15 HA ASN 15 10.618 18.310 -0.029 478 HB2 ASN 15 2HB ASN 15 12.283 19.685 1.348 479 HB3 ASN 15 3HB ASN 15 13.089 20.103 -0.153 480 HD21 ASN 15 1HD2 ASN 15 9.428 19.940 0.469 481 HD22 ASN 15 2HD2 ASN 15 9.339 21.684 0.200 482 H LYS 16 HN LYS 16 11.787 16.746 -2.283 483 HA LYS 16 HA LYS 16 12.547 18.499 -4.395 484 HB2 LYS 16 2HB LYS 16 11.580 15.618 -4.345 485 HB3 LYS 16 3HB LYS 16 12.187 16.394 -5.814 486 HG2 LYS 16 2HG LYS 16 14.393 16.608 -4.928 487 HG3 LYS 16 3HG LYS 16 13.849 16.309 -3.275 488 HD2 LYS 16 2HD LYS 16 13.177 13.969 -3.965 489 HD3 LYS 16 3HD LYS 16 13.895 14.280 -5.550 490 HE2 LYS 16 2HE LYS 16 15.428 13.023 -4.129 491 HE3 LYS 16 3HE LYS 16 16.108 14.624 -4.472 492 HZ1 LYS 16 3HZ LYS 16 16.239 13.878 -2.104 493 HZ2 LYS 16 1HZ LYS 16 14.588 14.016 -2.018 494 HZ3 LYS 16 2HZ LYS 16 15.488 15.334 -2.316 495 H ARG 17 HN ARG 17 11.484 19.051 -6.315 496 HA ARG 17 HA ARG 17 8.591 19.414 -5.834 497 HE ARG 17 HE ARG 17 11.359 21.678 -3.233 498 HB2 ARG 17 2HB ARG 17 10.557 20.820 -7.730 499 HB3 ARG 17 3HB ARG 17 8.818 21.122 -7.665 500 HG2 ARG 17 2HG ARG 17 9.576 22.807 -6.284 501 HG3 ARG 17 3HG ARG 17 9.165 21.553 -5.126 502 HD2 ARG 17 2HD ARG 17 11.757 20.933 -5.351 503 HD3 ARG 17 3HD ARG 17 11.885 22.565 -5.978 504 HH11 ARG 17 2HH1 ARG 17 11.079 24.477 -5.350 505 HH12 ARG 17 1HH1 ARG 17 11.121 25.602 -4.006 506 HH21 ARG 17 1HH2 ARG 17 11.428 23.183 -1.565 507 HH22 ARG 17 2HH2 ARG 17 11.291 24.886 -1.949 508 H TYR 18 HN TYR 18 7.153 18.301 -6.879 509 HA TYR 18 HA TYR 18 7.860 16.849 -9.360 510 HD1 TYR 18 2HD TYR 18 7.611 16.393 -5.511 511 HD2 TYR 18 1HD TYR 18 7.371 13.667 -8.852 512 HE1 TYR 18 2HE TYR 18 9.435 15.047 -4.549 513 HE2 TYR 18 1HE TYR 18 9.270 12.388 -7.933 514 HH TYR 18 HH TYR 18 10.671 13.041 -4.808 515 HB2 TYR 18 2HB TYR 18 5.757 16.496 -7.203 516 HB3 TYR 18 3HB TYR 18 5.787 15.524 -8.648 517 H PHE 19 HN PHE 19 5.905 16.483 -10.832 518 HA PHE 19 HA PHE 19 4.438 19.089 -11.133 519 HD1 PHE 19 1HD PHE 19 5.572 20.810 -13.241 520 HD2 PHE 19 2HD PHE 19 7.747 17.125 -12.700 521 HE1 PHE 19 1HE PHE 19 7.716 22.060 -13.307 522 HE2 PHE 19 2HE PHE 19 9.886 18.382 -12.749 523 HZ PHE 19 HZ PHE 19 9.873 20.849 -13.059 524 HB2 PHE 19 2HB PHE 19 5.352 17.103 -13.268 525 HB3 PHE 19 3HB PHE 19 4.476 18.602 -13.562 526 H LYS 20 HN LYS 20 4.182 15.525 -11.152 527 HA LYS 20 HA LYS 20 1.243 15.754 -11.654 528 HB2 LYS 20 2HB LYS 20 3.281 13.566 -11.978 529 HB3 LYS 20 3HB LYS 20 1.576 13.126 -11.791 530 HG2 LYS 20 2HG LYS 20 2.761 14.936 -13.951 531 HG3 LYS 20 3HG LYS 20 2.347 13.227 -14.138 532 HD2 LYS 20 2HD LYS 20 -0.046 13.818 -13.523 533 HD3 LYS 20 3HD LYS 20 0.421 15.530 -13.635 534 HE2 LYS 20 2HE LYS 20 1.176 15.116 -15.993 535 HE3 LYS 20 3HE LYS 20 0.567 13.455 -15.850 536 HZ1 LYS 20 3HZ LYS 20 -1.110 14.782 -16.836 537 HZ2 LYS 20 1HZ LYS 20 -1.002 15.939 -15.665 538 HZ3 LYS 20 2HZ LYS 20 -1.609 14.468 -15.289 539 H LEU 21 HN LEU 21 -0.220 15.245 -10.107 540 HA LEU 21 HA LEU 21 0.515 15.135 -7.358 541 HG LEU 21 HG LEU 21 -2.041 13.134 -6.646 542 HB2 LEU 21 2HB LEU 21 -1.722 15.806 -8.073 543 HB3 LEU 21 3HB LEU 21 -2.003 14.247 -8.823 544 HD11 LEU 21 1HD1 LEU 21 -0.479 14.555 -5.346 545 HD12 LEU 21 2HD1 LEU 21 -2.039 14.395 -4.535 546 HD13 LEU 21 3HD1 LEU 21 -1.651 15.890 -5.405 547 HD21 LEU 21 3HD2 LEU 21 -4.114 14.104 -5.795 548 HD22 LEU 21 1HD2 LEU 21 -4.115 14.082 -7.565 549 HD23 LEU 21 2HD2 LEU 21 -3.809 15.606 -6.698 550 H SER 22 HN SER 22 -0.524 12.502 -9.586 551 HA SER 22 HA SER 22 -0.261 10.409 -7.657 552 HG SER 22 HG SER 22 -0.746 10.008 -11.665 553 HB2 SER 22 2HB SER 22 -0.364 8.919 -9.683 554 HB3 SER 22 3HB SER 22 -1.680 10.100 -9.553 555 H HIS 23 HN HIS 23 2.070 11.917 -9.806 556 HA HIS 23 HA HIS 23 3.957 9.637 -9.670 557 HD1 HIS 23 1HD HIS 23 6.627 11.852 -12.634 558 HD2 HIS 23 2HD HIS 23 4.710 13.996 -9.605 559 HE1 HIS 23 1HE HIS 23 7.631 14.200 -12.653 560 HB2 HIS 23 2HB HIS 23 4.946 10.520 -11.366 561 HB3 HIS 23 3HB HIS 23 3.597 11.526 -11.592 562 H LEU 24 HN LEU 24 3.192 12.650 -8.069 563 HA LEU 24 HA LEU 24 5.620 12.688 -6.410 564 HG LEU 24 HG LEU 24 4.780 15.833 -5.066 565 HB2 LEU 24 2HB LEU 24 4.381 14.742 -6.948 566 HB3 LEU 24 3HB LEU 24 2.968 14.147 -6.160 567 HD11 LEU 24 1HD1 LEU 24 2.535 15.436 -4.227 568 HD12 LEU 24 2HD1 LEU 24 3.718 15.404 -2.909 569 HD13 LEU 24 3HD1 LEU 24 3.044 13.881 -3.521 570 HD21 LEU 24 3HD2 LEU 24 6.462 13.821 -4.785 571 HD22 LEU 24 1HD2 LEU 24 5.446 13.446 -3.378 572 HD23 LEU 24 2HD2 LEU 24 6.222 15.012 -3.501 573 H GLN 25 HN GLN 25 2.188 11.603 -6.163 574 HA GLN 25 HA GLN 25 2.280 10.674 -3.471 575 HB2 GLN 25 2HB GLN 25 0.662 9.868 -5.902 576 HB3 GLN 25 3HB GLN 25 0.486 9.004 -4.378 577 HG2 GLN 25 2HG GLN 25 -0.118 10.988 -3.170 578 HG3 GLN 25 3HG GLN 25 0.223 12.034 -4.540 579 HE21 GLN 25 1HE2 GLN 25 -2.346 11.794 -3.024 580 HE22 GLN 25 2HE2 GLN 25 -3.467 11.288 -4.294 581 H MET 26 HN MET 26 3.215 9.080 -6.564 582 HA MET 26 HA MET 26 4.005 6.566 -5.445 583 HB2 MET 26 2HB MET 26 5.029 8.113 -7.875 584 HB3 MET 26 3HB MET 26 5.584 6.511 -7.424 585 HG2 MET 26 2HG MET 26 2.845 7.280 -8.414 586 HG3 MET 26 3HG MET 26 4.014 6.199 -9.117 587 HE1 MET 26 3HE MET 26 0.499 5.128 -6.554 588 HE2 MET 26 1HE MET 26 1.289 6.708 -6.328 589 HE3 MET 26 2HE MET 26 0.688 6.226 -7.931 590 H HIS 27 HN HIS 27 5.866 9.645 -5.989 591 HA HIS 27 HA HIS 27 8.340 8.737 -4.931 592 HD1 HIS 27 1HD HIS 27 10.599 10.060 -4.211 593 HD2 HIS 27 2HD HIS 27 7.842 13.010 -3.015 594 HE1 HIS 27 1HE HIS 27 11.656 11.343 -2.241 595 HB2 HIS 27 2HB HIS 27 8.335 10.854 -6.008 596 HB3 HIS 27 3HB HIS 27 7.056 11.508 -5.001 597 H SER 28 HN SER 28 5.511 10.211 -3.193 598 HA SER 28 HA SER 28 6.591 10.303 -0.664 599 HG SER 28 HG SER 28 3.439 8.906 -2.041 600 HB2 SER 28 2HB SER 28 4.410 10.508 0.136 601 HB3 SER 28 3HB SER 28 4.270 11.057 -1.533 602 H ARG 29 HN ARG 29 5.419 7.410 -2.400 603 HA ARG 29 HA ARG 29 5.067 5.675 -0.155 604 HE ARG 29 HE ARG 29 2.732 3.295 -2.425 605 HB2 ARG 29 2HB ARG 29 4.427 5.227 -2.558 606 HB3 ARG 29 3HB ARG 29 6.134 4.894 -2.906 607 HG2 ARG 29 2HG ARG 29 6.160 3.049 -1.288 608 HG3 ARG 29 3HG ARG 29 4.502 3.412 -0.790 609 HD2 ARG 29 2HD ARG 29 5.354 2.552 -3.584 610 HD3 ARG 29 3HD ARG 29 4.673 1.472 -2.354 611 HH11 ARG 29 2HH1 ARG 29 4.312 1.845 -5.244 612 HH12 ARG 29 1HH1 ARG 29 2.965 2.311 -6.277 613 HH21 ARG 29 1HH2 ARG 29 1.108 3.794 -3.831 614 HH22 ARG 29 2HH2 ARG 29 1.243 3.271 -5.511 615 H LYS 30 HN LYS 30 7.987 6.704 -1.959 616 HA LYS 30 HA LYS 30 9.843 4.793 -0.848 617 HB2 LYS 30 2HB LYS 30 10.387 7.672 -1.695 618 HB3 LYS 30 3HB LYS 30 11.570 6.397 -1.532 619 HG2 LYS 30 2HG LYS 30 9.319 6.502 -3.595 620 HG3 LYS 30 3HG LYS 30 11.017 6.839 -3.888 621 HD2 LYS 30 2HD LYS 30 9.884 4.130 -3.056 622 HD3 LYS 30 3HD LYS 30 10.342 4.609 -4.692 623 HE2 LYS 30 2HE LYS 30 12.682 4.959 -3.961 624 HE3 LYS 30 3HE LYS 30 12.246 4.469 -2.314 625 HZ1 LYS 30 3HZ LYS 30 12.003 2.768 -4.709 626 HZ2 LYS 30 1HZ LYS 30 11.636 2.318 -3.169 627 HZ3 LYS 30 2HZ LYS 30 13.195 2.658 -3.578 628 H HIS 31 HN HIS 31 8.372 7.736 0.450 629 HA HIS 31 HA HIS 31 10.304 7.886 2.679 630 HD1 HIS 31 1HD HIS 31 11.594 9.925 3.127 631 HD2 HIS 31 2HD HIS 31 8.962 11.514 0.245 632 HE1 HIS 31 1HE HIS 31 12.856 11.778 1.905 633 HB2 HIS 31 2HB HIS 31 7.954 9.604 1.801 634 HB3 HIS 31 3HB HIS 31 8.685 9.783 3.386 635 H THR 32 HN THR 32 7.328 6.184 2.056 636 HA THR 32 HA THR 32 6.076 6.520 4.686 637 HB THR 32 HB THR 32 4.777 4.535 4.067 638 HG1 THR 32 1HG THR 32 6.377 4.427 1.693 639 HG21 THR 32 3HG2 THR 32 4.870 6.614 1.867 640 HG22 THR 32 1HG2 THR 32 3.895 6.643 3.346 641 HG23 THR 32 2HG2 THR 32 3.580 5.416 2.108 642 H GLY 33 HN GLY 33 8.695 4.622 3.310 643 HA2 GLY 33 2HA GLY 33 8.753 2.701 5.540 644 HA3 GLY 33 3HA GLY 33 9.915 2.826 4.205 645 H GLU 34 HN GLU 34 9.312 5.900 5.616 646 HA GLU 34 HA GLU 34 11.970 6.252 6.563 647 HB2 GLU 34 2HB GLU 34 11.154 8.283 7.586 648 HB3 GLU 34 3HB GLU 34 10.552 8.142 5.969 649 HG2 GLU 34 2HG GLU 34 8.526 8.678 6.853 650 HG3 GLU 34 3HG GLU 34 8.429 7.016 7.368 651 H LYS 35 HN LYS 35 9.066 5.009 8.199 652 HA LYS 35 HA LYS 35 10.790 4.096 10.428 653 HB2 LYS 35 2HB LYS 35 8.225 5.691 10.843 654 HB3 LYS 35 3HB LYS 35 9.008 4.746 12.103 655 HG2 LYS 35 2HG LYS 35 10.262 7.097 10.678 656 HG3 LYS 35 3HG LYS 35 9.476 7.176 12.245 657 HD2 LYS 35 2HD LYS 35 11.177 5.774 13.255 658 HD3 LYS 35 3HD LYS 35 11.931 5.447 11.691 659 HE2 LYS 35 2HE LYS 35 11.750 8.182 13.014 660 HE3 LYS 35 3HE LYS 35 13.185 7.142 12.948 661 HZ1 LYS 35 3HZ LYS 35 11.816 8.402 10.668 662 HZ2 LYS 35 1HZ LYS 35 12.988 7.276 10.496 663 HZ3 LYS 35 2HZ LYS 35 13.338 8.730 11.214 664 HA PRO 36 HA PRO 36 7.937 0.811 8.937 665 HB2 PRO 36 2HB PRO 36 9.691 -1.286 9.157 666 HB3 PRO 36 3HB PRO 36 9.722 -0.138 7.788 667 HG2 PRO 36 2HG PRO 36 11.459 -0.116 10.272 668 HG3 PRO 36 3HG PRO 36 11.966 0.061 8.562 669 HD2 PRO 36 2HD PRO 36 11.568 2.185 10.243 670 HD3 PRO 36 3HD PRO 36 11.230 2.293 8.488 671 H TYR 37 HN TYR 37 6.760 -0.730 10.124 672 HA TYR 37 HA TYR 37 7.012 -0.476 13.062 673 HD1 TYR 37 1HD TYR 37 4.274 0.527 13.865 674 HD2 TYR 37 2HD TYR 37 4.341 -0.564 9.689 675 HE1 TYR 37 1HE TYR 37 2.691 2.379 13.358 676 HE2 TYR 37 2HE TYR 37 2.786 1.334 9.186 677 HH TYR 37 HH TYR 37 2.035 3.788 11.254 678 HB2 TYR 37 2HB TYR 37 5.038 -2.153 11.460 679 HB3 TYR 37 3HB TYR 37 4.971 -1.644 13.157 680 H GLN 38 HN GLN 38 6.859 -2.473 14.417 681 HA GLN 38 HA GLN 38 7.934 -4.924 13.123 682 HB2 GLN 38 2HB GLN 38 9.453 -5.352 15.001 683 HB3 GLN 38 3HB GLN 38 9.856 -3.867 14.161 684 HG2 GLN 38 2HG GLN 38 8.483 -2.667 16.057 685 HG3 GLN 38 3HG GLN 38 8.680 -4.189 16.929 686 HE21 GLN 38 1HE2 GLN 38 11.213 -5.018 16.831 687 HE22 GLN 38 2HE2 GLN 38 12.306 -3.668 17.148 688 H CYS 39 HN CYS 39 7.331 -6.874 14.168 689 HA CYS 39 HA CYS 39 4.801 -6.870 15.556 690 HB2 CYS 39 2HB CYS 39 5.849 -8.798 14.214 691 HB3 CYS 39 3HB CYS 39 6.876 -9.109 15.623 692 H ASP 40 HN ASP 40 4.445 -7.801 17.761 693 HA ASP 40 HA ASP 40 6.590 -6.975 19.688 694 HB2 ASP 40 2HB ASP 40 5.024 -5.958 21.114 695 HB3 ASP 40 3HB ASP 40 4.635 -5.337 19.519 696 H PHE 41 HN PHE 41 5.076 -9.583 18.419 697 HA PHE 41 HA PHE 41 4.056 -10.998 20.672 698 HD1 PHE 41 1HD PHE 41 2.358 -12.978 20.205 699 HD2 PHE 41 2HD PHE 41 5.974 -14.209 18.206 700 HE1 PHE 41 1HE PHE 41 1.804 -15.358 20.654 701 HE2 PHE 41 2HE PHE 41 5.406 -16.580 18.637 702 HZ PHE 41 HZ PHE 41 3.338 -17.158 19.877 703 HB2 PHE 41 2HB PHE 41 3.614 -11.592 18.345 704 HB3 PHE 41 3HB PHE 41 5.291 -11.979 18.082 705 H LYS 42 HN LYS 42 4.962 -12.709 21.923 706 HA LYS 42 HA LYS 42 7.432 -11.974 23.088 707 HB2 LYS 42 2HB LYS 42 5.396 -13.324 24.046 708 HB3 LYS 42 3HB LYS 42 6.215 -14.733 23.390 709 HG2 LYS 42 2HG LYS 42 8.279 -13.490 24.805 710 HG3 LYS 42 3HG LYS 42 6.885 -12.956 25.710 711 HD2 LYS 42 2HD LYS 42 7.783 -14.963 26.725 712 HD3 LYS 42 3HD LYS 42 6.189 -15.320 26.056 713 HE2 LYS 42 2HE LYS 42 7.770 -17.155 25.609 714 HE3 LYS 42 3HE LYS 42 7.219 -16.415 24.107 715 HZ1 LYS 42 3HZ LYS 42 9.541 -16.763 24.009 716 HZ2 LYS 42 1HZ LYS 42 9.816 -15.926 25.413 717 HZ3 LYS 42 2HZ LYS 42 9.276 -15.152 24.053 718 H ASP 43 HN ASP 43 6.924 -13.914 20.277 719 HA ASP 43 HA ASP 43 9.775 -14.813 20.361 720 HB2 ASP 43 2HB ASP 43 7.441 -16.552 19.448 721 HB3 ASP 43 3HB ASP 43 9.140 -17.006 19.467 722 H CYS 44 HN CYS 44 8.519 -12.514 19.004 723 HA CYS 44 HA CYS 44 9.195 -13.289 16.200 724 HB2 CYS 44 2HB CYS 44 6.685 -13.133 16.469 725 HB3 CYS 44 3HB CYS 44 6.915 -11.430 16.961 726 H GLU 45 HN GLU 45 9.853 -11.484 14.860 727 HA GLU 45 HA GLU 45 10.343 -8.886 16.092 728 HB2 GLU 45 2HB GLU 45 12.385 -10.737 16.463 729 HB3 GLU 45 3HB GLU 45 12.907 -9.985 14.980 730 HG2 GLU 45 2HG GLU 45 12.325 -8.679 17.670 731 HG3 GLU 45 3HG GLU 45 13.890 -8.862 16.894 732 H ARG 46 HN ARG 46 8.798 -9.996 13.834 733 HA ARG 46 HA ARG 46 10.287 -9.375 11.365 734 HE ARG 46 HE ARG 46 8.296 -12.360 12.929 735 HB2 ARG 46 2HB ARG 46 7.575 -10.486 12.067 736 HB3 ARG 46 3HB ARG 46 7.678 -9.551 10.595 737 HG2 ARG 46 2HG ARG 46 7.978 -11.862 10.048 738 HG3 ARG 46 3HG ARG 46 9.431 -10.941 9.679 739 HD2 ARG 46 2HD ARG 46 10.031 -13.093 10.596 740 HD3 ARG 46 3HD ARG 46 10.519 -11.827 11.728 741 HH11 ARG 46 1HH1 ARG 46 10.083 -14.964 11.351 742 HH12 ARG 46 2HH1 ARG 46 9.459 -16.122 12.515 743 HH21 ARG 46 1HH2 ARG 46 7.693 -13.751 14.289 744 HH22 ARG 46 2HH2 ARG 46 8.146 -15.460 14.216 745 H ARG 47 HN ARG 47 9.801 -7.658 9.949 746 HA ARG 47 HA ARG 47 8.435 -5.356 11.279 747 HE ARG 47 HE ARG 47 10.842 -2.084 11.375 748 HB2 ARG 47 2HB ARG 47 10.780 -5.285 9.317 749 HB3 ARG 47 3HB ARG 47 9.971 -3.892 10.025 750 HG2 ARG 47 2HG ARG 47 10.663 -4.997 12.336 751 HG3 ARG 47 3HG ARG 47 11.812 -5.892 11.339 752 HD2 ARG 47 2HD ARG 47 13.053 -4.016 11.989 753 HD3 ARG 47 3HD ARG 47 12.503 -3.568 10.379 754 HH11 ARG 47 1HH2 ARG 47 12.943 -3.485 13.863 755 HH12 ARG 47 2HH2 ARG 47 12.298 -2.356 15.050 756 HH21 ARG 47 1HH1 ARG 47 10.248 -0.619 13.003 757 HH22 ARG 47 2HH1 ARG 47 10.883 -0.930 14.625 758 H PHE 48 HN PHE 48 7.277 -3.904 9.966 759 HA PHE 48 HA PHE 48 6.672 -4.826 7.186 760 HD1 PHE 48 1HD PHE 48 4.463 -6.931 6.887 761 HD2 PHE 48 2HD PHE 48 5.316 -5.757 10.949 762 HE1 PHE 48 1HE PHE 48 4.658 -9.315 7.559 763 HE2 PHE 48 2HE PHE 48 5.528 -8.145 11.602 764 HZ PHE 48 HZ PHE 48 5.304 -9.907 9.863 765 HB2 PHE 48 2HB PHE 48 4.562 -4.092 9.250 766 HB3 PHE 48 3HB PHE 48 4.267 -4.579 7.587 767 H SER 49 HN SER 49 6.299 -3.180 5.749 768 HA SER 49 HA SER 49 6.893 -0.460 6.741 769 HG SER 49 HG SER 49 6.273 0.853 4.526 770 HB2 SER 49 2HB SER 49 8.023 -1.370 4.704 771 HB3 SER 49 3HB SER 49 6.440 -1.476 3.895 772 H ARG 50 HN ARG 50 4.097 -2.204 6.632 773 HA ARG 50 HA ARG 50 2.496 0.274 6.357 774 HE ARG 50 HE ARG 50 -0.662 -2.207 3.287 775 HB2 ARG 50 2HB ARG 50 2.519 -1.259 4.204 776 HB3 ARG 50 3HB ARG 50 1.406 -2.274 5.124 777 HG2 ARG 50 2HG ARG 50 -0.247 -0.537 5.206 778 HG3 ARG 50 3HG ARG 50 0.939 0.718 4.870 779 HD2 ARG 50 2HD ARG 50 -0.445 0.414 2.918 780 HD3 ARG 50 3HD ARG 50 1.231 -0.022 2.588 781 HH11 ARG 50 1HH2 ARG 50 1.041 -0.572 0.706 782 HH12 ARG 50 2HH2 ARG 50 0.687 -1.868 -0.428 783 HH21 ARG 50 2HH1 ARG 50 -1.130 -3.723 1.714 784 HH22 ARG 50 1HH1 ARG 50 -0.464 -3.522 0.126 785 H SER 51 HN SER 51 0.848 0.428 7.786 786 HA SER 51 HA SER 51 0.988 -1.086 10.164 787 HG SER 51 HG SER 51 -2.101 1.236 9.035 788 HB2 SER 51 2HB SER 51 -1.276 0.048 10.624 789 HB3 SER 51 3HB SER 51 0.090 1.123 10.261 790 H ASP 52 HN ASP 52 -1.430 -1.230 7.491 791 HA ASP 52 HA ASP 52 -3.044 -3.212 8.667 792 HB2 ASP 52 2HB ASP 52 -4.199 -3.252 6.707 793 HB3 ASP 52 3HB ASP 52 -3.388 -1.703 6.576 794 H GLN 53 HN GLN 53 -0.061 -3.546 6.745 795 HA GLN 53 HA GLN 53 -0.195 -6.409 6.383 796 HB2 GLN 53 2HB GLN 53 2.147 -4.460 6.458 797 HB3 GLN 53 3HB GLN 53 2.314 -6.175 6.096 798 HG2 GLN 53 2HG GLN 53 0.986 -6.001 4.105 799 HG3 GLN 53 3HG GLN 53 0.477 -4.357 4.493 800 HE21 GLN 53 1HE2 GLN 53 1.365 -4.120 2.091 801 HE22 GLN 53 2HE2 GLN 53 3.085 -3.714 2.087 802 H LEU 54 HN LEU 54 1.357 -4.275 8.872 803 HA LEU 54 HA LEU 54 2.353 -6.409 10.524 804 HG LEU 54 HG LEU 54 1.329 -4.756 13.263 805 HB2 LEU 54 2HB LEU 54 3.149 -4.159 10.892 806 HB3 LEU 54 3HB LEU 54 1.523 -3.544 11.146 807 HD11 LEU 54 1HD1 LEU 54 3.195 -5.927 14.299 808 HD12 LEU 54 2HD1 LEU 54 4.224 -5.677 12.886 809 HD13 LEU 54 3HD1 LEU 54 2.815 -6.744 12.785 810 HD21 LEU 54 3HD2 LEU 54 2.770 -3.448 14.566 811 HD22 LEU 54 1HD2 LEU 54 2.544 -2.487 13.090 812 HD23 LEU 54 2HD2 LEU 54 4.029 -3.462 13.337 813 H LYS 55 HN LYS 55 -0.768 -4.559 10.663 814 HA LYS 55 HA LYS 55 -1.894 -5.884 12.887 815 HB2 LYS 55 2HB LYS 55 -3.148 -4.652 10.405 816 HB3 LYS 55 3HB LYS 55 -4.122 -5.327 11.707 817 HG2 LYS 55 2HG LYS 55 -3.245 -3.761 13.324 818 HG3 LYS 55 3HG LYS 55 -2.085 -3.107 12.159 819 HD2 LYS 55 2HD LYS 55 -3.943 -2.327 10.717 820 HD3 LYS 55 3HD LYS 55 -5.121 -3.015 11.852 821 HE2 LYS 55 2HE LYS 55 -4.273 -1.491 13.630 822 HE3 LYS 55 3HE LYS 55 -3.138 -0.782 12.468 823 HZ1 LYS 55 3HZ LYS 55 -5.031 -0.113 11.137 824 HZ2 LYS 55 1HZ LYS 55 -5.146 0.522 12.649 825 HZ3 LYS 55 2HZ LYS 55 -6.081 -0.767 12.223 826 H ARG 56 HN ARG 56 -2.002 -6.789 9.401 827 HA ARG 56 HA ARG 56 -3.590 -9.159 9.720 828 HE ARG 56 HE ARG 56 -3.591 -8.321 5.573 829 HB2 ARG 56 2HB ARG 56 -3.036 -8.012 7.557 830 HB3 ARG 56 3HB ARG 56 -1.381 -8.615 7.682 831 HG2 ARG 56 2HG ARG 56 -2.354 -10.980 7.743 832 HG3 ARG 56 3HG ARG 56 -3.934 -10.261 7.390 833 HD2 ARG 56 2HD ARG 56 -1.409 -10.049 5.685 834 HD3 ARG 56 3HD ARG 56 -2.800 -11.092 5.366 835 HH11 ARG 56 1HH2 ARG 56 -2.196 -10.642 3.363 836 HH12 ARG 56 2HH2 ARG 56 -2.545 -9.697 1.945 837 HH21 ARG 56 1HH1 ARG 56 -4.122 -7.153 3.790 838 HH22 ARG 56 2HH1 ARG 56 -3.862 -7.765 2.191 839 H HIS 57 HN HIS 57 -0.024 -8.645 9.711 840 HA HIS 57 HA HIS 57 0.717 -11.354 10.069 841 HD1 HIS 57 1HD HIS 57 3.493 -12.289 10.097 842 HD2 HIS 57 2HD HIS 57 3.350 -9.261 13.052 843 HE1 HIS 57 1HE HIS 57 4.897 -13.092 12.095 844 HB2 HIS 57 2HB HIS 57 2.359 -9.724 9.433 845 HB3 HIS 57 3HB HIS 57 2.060 -8.734 10.861 846 H GLN 58 HN GLN 58 0.179 -8.781 12.519 847 HA GLN 58 HA GLN 58 0.542 -10.282 14.888 848 HB2 GLN 58 2HB GLN 58 -1.291 -7.963 14.184 849 HB3 GLN 58 3HB GLN 58 -1.208 -8.625 15.811 850 HG2 GLN 58 2HG GLN 58 1.454 -7.980 14.565 851 HG3 GLN 58 3HG GLN 58 0.390 -6.607 14.862 852 HE21 GLN 58 1HE2 GLN 58 2.758 -8.732 16.479 853 HE22 GLN 58 2HE2 GLN 58 2.204 -8.122 18.057 854 H ARG 59 HN ARG 59 -2.219 -10.133 12.611 855 HA ARG 59 HA ARG 59 -4.227 -11.272 14.269 856 HE ARG 59 HE ARG 59 -6.240 -8.832 12.078 857 HB2 ARG 59 2HB ARG 59 -4.200 -10.271 11.806 858 HB3 ARG 59 3HB ARG 59 -4.114 -11.973 11.340 859 HG2 ARG 59 2HG ARG 59 -6.170 -12.466 12.345 860 HG3 ARG 59 3HG ARG 59 -6.220 -10.952 13.278 861 HD2 ARG 59 2HD ARG 59 -6.358 -11.134 10.250 862 HD3 ARG 59 3HD ARG 59 -7.762 -10.922 11.315 863 HH11 ARG 59 1HH2 ARG 59 -7.183 -9.767 8.816 864 HH12 ARG 59 2HH2 ARG 59 -6.707 -8.205 8.152 865 HH21 ARG 59 1HH1 ARG 59 -5.817 -6.870 11.201 866 HH22 ARG 59 2HH1 ARG 59 -6.051 -6.595 9.484 867 H ARG 60 HN ARG 60 -1.527 -12.770 12.482 868 HA ARG 60 HA ARG 60 -2.432 -15.526 12.713 869 HE ARG 60 HE ARG 60 0.976 -18.795 11.576 870 HB2 ARG 60 2HB ARG 60 -0.680 -14.817 11.129 871 HB3 ARG 60 3HB ARG 60 0.394 -14.376 12.472 872 HG2 ARG 60 2HG ARG 60 0.547 -16.679 13.230 873 HG3 ARG 60 3HG ARG 60 -0.694 -17.182 12.079 874 HD2 ARG 60 2HD ARG 60 0.958 -16.221 10.275 875 HD3 ARG 60 3HD ARG 60 2.157 -16.268 11.565 876 HH11 ARG 60 1HH2 ARG 60 2.770 -16.939 9.185 877 HH12 ARG 60 2HH2 ARG 60 3.412 -18.384 8.429 878 HH21 ARG 60 1HH1 ARG 60 1.757 -20.580 10.511 879 HH22 ARG 60 2HH1 ARG 60 2.809 -20.386 9.128 880 H HIS 61 HN HIS 61 -0.574 -13.314 14.834 881 HA HIS 61 HA HIS 61 0.161 -15.471 16.700 882 HD1 HIS 61 1HD HIS 61 2.618 -15.703 16.635 883 HD2 HIS 61 2HD HIS 61 2.711 -11.591 15.752 884 HE1 HIS 61 1HE HIS 61 4.905 -15.220 15.594 885 HB2 HIS 61 2HB HIS 61 0.470 -12.439 16.785 886 HB3 HIS 61 3HB HIS 61 1.009 -13.506 18.064 887 H THR 62 HN THR 62 -2.594 -13.481 16.184 888 HA THR 62 HA THR 62 -3.417 -13.672 19.059 889 HB THR 62 HB THR 62 -4.905 -11.710 18.490 890 HG1 THR 62 1HG THR 62 -3.256 -11.478 16.225 891 HG21 THR 62 3HG2 THR 62 -3.121 -10.016 18.315 892 HG22 THR 62 1HG2 THR 62 -1.932 -11.271 17.906 893 HG23 THR 62 2HG2 THR 62 -2.703 -11.266 19.498 894 H GLY 63 HN GLY 63 -4.069 -15.069 16.043 895 HA2 GLY 63 2HA GLY 63 -5.747 -16.491 15.330 896 HA3 GLY 63 3HA GLY 63 -6.182 -16.615 17.043 897 H VAL 64 HN VAL 64 -6.465 -13.386 15.872 898 HA VAL 64 HA VAL 64 -9.335 -13.447 16.298 899 HB VAL 64 HB VAL 64 -7.533 -11.201 15.261 900 HG11 VAL 64 1HG1 VAL 64 -9.342 -9.700 16.087 901 HG12 VAL 64 2HG1 VAL 64 -9.921 -10.720 14.777 902 HG13 VAL 64 3HG1 VAL 64 -10.350 -11.113 16.454 903 HG21 VAL 64 3HG2 VAL 64 -6.875 -11.943 17.524 904 HG22 VAL 64 1HG2 VAL 64 -7.642 -10.361 17.595 905 HG23 VAL 64 2HG2 VAL 64 -8.551 -11.812 18.079 906 H LYS 65 HN LYS 65 -10.914 -13.832 14.869 907 HA LYS 65 HA LYS 65 -10.374 -13.323 11.965 908 HB2 LYS 65 2HB LYS 65 -12.101 -15.472 13.267 909 HB3 LYS 65 3HB LYS 65 -12.176 -15.050 11.549 910 HG2 LYS 65 2HG LYS 65 -9.780 -15.578 11.298 911 HG3 LYS 65 3HG LYS 65 -9.694 -16.061 13.000 912 HD2 LYS 65 2HD LYS 65 -11.327 -17.857 12.589 913 HD3 LYS 65 3HD LYS 65 -11.484 -17.369 10.897 914 HE2 LYS 65 2HE LYS 65 -8.889 -18.295 12.200 915 HE3 LYS 65 3HE LYS 65 -9.970 -19.340 11.264 916 HZ1 LYS 65 3HZ LYS 65 -8.181 -18.506 9.917 917 HZ2 LYS 65 1HZ LYS 65 -8.613 -16.943 10.213 918 HZ3 LYS 65 2HZ LYS 65 -9.619 -17.937 9.362 919 HA PRO 66 HA PRO 66 -13.600 -10.498 13.486 920 HB2 PRO 66 2HB PRO 66 -12.778 -8.184 12.303 921 HB3 PRO 66 3HB PRO 66 -11.894 -8.920 13.670 922 HG2 PRO 66 2HG PRO 66 -11.262 -9.120 10.720 923 HG3 PRO 66 3HG PRO 66 -10.140 -8.765 12.069 924 HD2 PRO 66 2HD PRO 66 -10.515 -11.256 10.957 925 HD3 PRO 66 3HD PRO 66 -9.994 -11.017 12.649 926 H PHE 67 HN PHE 67 -12.875 -11.508 10.220 927 HA PHE 67 HA PHE 67 -15.243 -10.052 9.093 928 HD1 PHE 67 2HD PHE 67 -14.341 -8.546 6.763 929 HD2 PHE 67 1HD PHE 67 -11.207 -10.910 8.517 930 HE1 PHE 67 2HE PHE 67 -12.785 -6.623 6.571 931 HE2 PHE 67 1HE PHE 67 -9.637 -8.984 8.307 932 HZ PHE 67 HZ PHE 67 -10.429 -6.846 7.322 933 HB2 PHE 67 2HB PHE 67 -13.300 -11.981 7.726 934 HB3 PHE 67 3HB PHE 67 -14.516 -10.962 6.972 935 H GLN 68 HN GLN 68 -17.181 -11.070 8.592 936 HA GLN 68 HA GLN 68 -17.335 -14.007 9.140 937 HB2 GLN 68 2HB GLN 68 -18.233 -12.675 11.074 938 HB3 GLN 68 3HB GLN 68 -19.499 -12.027 10.015 939 HG2 GLN 68 2HG GLN 68 -20.508 -14.178 9.754 940 HG3 GLN 68 3HG GLN 68 -19.037 -15.027 10.242 941 HE21 GLN 68 1HE2 GLN 68 -20.313 -16.315 11.767 942 HE22 GLN 68 2HE2 GLN 68 -20.802 -15.506 13.275 943 H CYS 69 HN CYS 69 -18.485 -15.183 7.687 944 HA CYS 69 HA CYS 69 -19.366 -14.018 5.207 945 HB2 CYS 69 2HB CYS 69 -18.661 -16.392 5.414 946 HB3 CYS 69 3HB CYS 69 -20.062 -16.722 6.441 947 H LYS 70 HN LYS 70 -21.534 -13.904 4.367 948 HA LYS 70 HA LYS 70 -23.519 -13.127 6.476 949 HB2 LYS 70 2HB LYS 70 -23.484 -12.483 3.498 950 HB3 LYS 70 3HB LYS 70 -24.707 -11.953 4.650 951 HG2 LYS 70 2HG LYS 70 -21.772 -11.102 4.613 952 HG3 LYS 70 3HG LYS 70 -23.171 -10.161 4.125 953 HD2 LYS 70 2HD LYS 70 -22.801 -9.274 6.198 954 HD3 LYS 70 3HD LYS 70 -23.997 -10.510 6.603 955 HE2 LYS 70 2HE LYS 70 -22.108 -12.027 7.298 956 HE3 LYS 70 3HE LYS 70 -20.958 -10.762 6.874 957 HZ1 LYS 70 3HZ LYS 70 -21.977 -9.375 8.556 958 HZ2 LYS 70 1HZ LYS 70 -21.443 -10.789 9.210 959 HZ3 LYS 70 2HZ LYS 70 -23.051 -10.567 8.940 960 H THR 71 HN THR 71 -22.589 -15.695 4.535 961 HA THR 71 HA THR 71 -25.387 -16.608 4.006 962 HB THR 71 HB THR 71 -23.340 -18.331 2.830 963 HG1 THR 71 1HG THR 71 -22.012 -16.516 2.793 964 HG21 THR 71 3HG2 THR 71 -25.663 -18.140 2.058 965 HG22 THR 71 1HG2 THR 71 -24.492 -17.790 0.771 966 HG23 THR 71 2HG2 THR 71 -25.352 -16.453 1.567 967 H CYS 72 HN CYS 72 -22.248 -18.308 4.679 968 HA CYS 72 HA CYS 72 -23.726 -20.310 6.293 969 HB2 CYS 72 2HB CYS 72 -21.578 -21.505 6.313 970 HB3 CYS 72 3HB CYS 72 -22.022 -21.053 4.653 971 H GLN 73 HN GLN 73 -22.355 -17.300 6.870 972 HA GLN 73 HA GLN 73 -21.746 -16.166 8.772 973 HB2 GLN 73 2HB GLN 73 -22.758 -18.464 10.474 974 HB3 GLN 73 3HB GLN 73 -22.752 -16.747 10.818 975 HG2 GLN 73 2HG GLN 73 -24.606 -18.246 8.936 976 HG3 GLN 73 3HG GLN 73 -25.009 -17.449 10.445 977 HE21 GLN 73 1HE2 GLN 73 -25.395 -17.111 7.157 978 HE22 GLN 73 2HE2 GLN 73 -25.488 -15.353 7.117 979 H ARG 74 HN ARG 74 -19.832 -18.132 7.530 980 HA ARG 74 HA ARG 74 -18.250 -19.165 9.803 981 HE ARG 74 HE ARG 74 -13.804 -20.793 7.699 982 HB2 ARG 74 2HB ARG 74 -18.355 -20.448 7.701 983 HB3 ARG 74 3HB ARG 74 -17.679 -19.080 6.795 984 HG2 ARG 74 2HG ARG 74 -15.565 -19.254 7.949 985 HG3 ARG 74 3HG ARG 74 -16.227 -20.401 9.127 986 HD2 ARG 74 2HD ARG 74 -16.466 -22.099 7.404 987 HD3 ARG 74 3HD ARG 74 -15.909 -20.972 6.157 988 HH11 ARG 74 1HH2 ARG 74 -15.486 -23.824 7.106 989 HH12 ARG 74 2HH2 ARG 74 -14.080 -24.781 7.524 990 HH21 ARG 74 2HH1 ARG 74 -12.068 -22.055 8.186 991 HH22 ARG 74 1HH1 ARG 74 -12.197 -23.795 8.119 992 H LYS 75 HN LYS 75 -16.381 -18.276 10.590 993 HA LYS 75 HA LYS 75 -15.937 -15.450 9.887 994 HB2 LYS 75 2HB LYS 75 -15.350 -17.226 12.242 995 HB3 LYS 75 3HB LYS 75 -14.205 -15.922 11.925 996 HG2 LYS 75 2HG LYS 75 -16.003 -14.261 11.883 997 HG3 LYS 75 3HG LYS 75 -17.205 -15.518 12.227 998 HD2 LYS 75 2HD LYS 75 -16.372 -15.851 14.440 999 HD3 LYS 75 3HD LYS 75 -14.821 -15.091 14.061 1000 HE2 LYS 75 2HE LYS 75 -16.056 -13.557 15.421 1001 HE3 LYS 75 3HE LYS 75 -15.926 -12.899 13.784 1002 HZ1 LYS 75 3HZ LYS 75 -18.190 -13.638 13.380 1003 HZ2 LYS 75 1HZ LYS 75 -18.149 -12.665 14.696 1004 HZ3 LYS 75 2HZ LYS 75 -18.290 -14.293 14.884 1005 H PHE 76 HN PHE 76 -14.022 -14.550 9.229 1006 HA PHE 76 HA PHE 76 -11.710 -16.340 8.667 1007 HD1 PHE 76 1HD PHE 76 -11.580 -17.786 6.120 1008 HD2 PHE 76 2HD PHE 76 -15.070 -15.241 6.290 1009 HE1 PHE 76 1HE PHE 76 -12.964 -19.605 5.138 1010 HE2 PHE 76 2HE PHE 76 -16.441 -17.076 5.351 1011 HZ PHE 76 HZ PHE 76 -15.401 -19.245 4.785 1012 HB2 PHE 76 2HB PHE 76 -12.848 -14.328 6.676 1013 HB3 PHE 76 3HB PHE 76 -11.406 -15.301 6.447 1014 H SER 77 HN SER 77 -9.703 -15.071 8.253 1015 HA SER 77 HA SER 77 -9.633 -12.810 10.146 1016 HG SER 77 HG SER 77 -6.540 -15.178 8.909 1017 HB2 SER 77 2HB SER 77 -7.097 -13.197 9.890 1018 HB3 SER 77 3HB SER 77 -8.019 -14.516 10.614 1019 H ARG 78 HN ARG 78 -9.761 -13.227 6.751 1020 HA ARG 78 HA ARG 78 -8.756 -10.443 6.340 1021 HE ARG 78 HE ARG 78 -5.981 -12.668 3.332 1022 HB2 ARG 78 2HB ARG 78 -7.930 -12.947 4.835 1023 HB3 ARG 78 3HB ARG 78 -7.729 -11.334 4.155 1024 HG2 ARG 78 2HG ARG 78 -6.038 -10.727 5.607 1025 HG3 ARG 78 3HG ARG 78 -6.557 -11.822 6.886 1026 HD2 ARG 78 2HD ARG 78 -4.476 -12.570 5.922 1027 HD3 ARG 78 3HD ARG 78 -5.761 -13.759 5.708 1028 HH11 ARG 78 1HH2 ARG 78 -2.950 -13.321 4.963 1029 HH12 ARG 78 2HH2 ARG 78 -2.099 -13.464 3.422 1030 HH21 ARG 78 2HH1 ARG 78 -4.921 -12.952 1.529 1031 HH22 ARG 78 1HH1 ARG 78 -3.200 -13.330 1.479 1032 H SER 79 HN SER 79 -10.034 -9.229 5.056 1033 HA SER 79 HA SER 79 -12.539 -10.095 4.099 1034 HG SER 79 HG SER 79 -10.593 -6.641 3.235 1035 HB2 SER 79 2HB SER 79 -12.425 -7.978 2.680 1036 HB3 SER 79 3HB SER 79 -12.158 -7.758 4.414 1037 H ASP 80 HN ASP 80 -9.360 -10.045 2.474 1038 HA ASP 80 HA ASP 80 -10.315 -10.612 -0.170 1039 HB2 ASP 80 2HB ASP 80 -7.997 -11.399 -0.603 1040 HB3 ASP 80 3HB ASP 80 -8.136 -9.796 0.108 1041 H HIS 81 HN HIS 81 -9.257 -12.846 2.509 1042 HA HIS 81 HA HIS 81 -9.855 -15.307 1.159 1043 HD1 HIS 81 1HD HIS 81 -7.423 -15.277 1.489 1044 HD2 HIS 81 2HD HIS 81 -8.081 -15.919 5.592 1045 HE1 HIS 81 1HE HIS 81 -5.231 -15.860 2.437 1046 HB2 HIS 81 2HB HIS 81 -9.990 -14.568 4.126 1047 HB3 HIS 81 3HB HIS 81 -10.193 -16.186 3.503 1048 H LEU 82 HN LEU 82 -11.886 -13.151 3.235 1049 HA LEU 82 HA LEU 82 -14.177 -14.841 3.262 1050 HG LEU 82 HG LEU 82 -16.201 -13.826 4.083 1051 HB2 LEU 82 2HB LEU 82 -13.783 -12.932 4.768 1052 HB3 LEU 82 3HB LEU 82 -14.042 -11.789 3.457 1053 HD11 LEU 82 1HD1 LEU 82 -15.931 -11.184 5.530 1054 HD12 LEU 82 2HD1 LEU 82 -15.531 -12.800 6.263 1055 HD13 LEU 82 3HD1 LEU 82 -17.164 -12.410 5.722 1056 HD21 LEU 82 3HD2 LEU 82 -16.618 -12.282 2.151 1057 HD22 LEU 82 1HD2 LEU 82 -16.320 -10.891 3.199 1058 HD23 LEU 82 2HD2 LEU 82 -17.720 -11.950 3.470 1059 H LYS 83 HN LYS 83 -13.348 -12.078 1.087 1060 HA LYS 83 HA LYS 83 -15.685 -12.276 -0.592 1061 HB2 LYS 83 2HB LYS 83 -14.111 -10.336 -0.482 1062 HB3 LYS 83 3HB LYS 83 -12.865 -11.294 -1.288 1063 HG2 LYS 83 2HG LYS 83 -14.258 -11.451 -3.312 1064 HG3 LYS 83 3HG LYS 83 -15.596 -10.628 -2.484 1065 HD2 LYS 83 2HD LYS 83 -14.172 -8.611 -2.197 1066 HD3 LYS 83 3HD LYS 83 -12.848 -9.409 -3.059 1067 HE2 LYS 83 2HE LYS 83 -15.613 -8.858 -4.227 1068 HE3 LYS 83 3HE LYS 83 -14.205 -7.811 -4.457 1069 HZ1 LYS 83 3HZ LYS 83 -14.361 -10.632 -5.293 1070 HZ2 LYS 83 1HZ LYS 83 -13.077 -9.627 -5.526 1071 HZ3 LYS 83 2HZ LYS 83 -14.505 -9.331 -6.295 1072 H THR 84 HN THR 84 -12.514 -13.930 -0.609 1073 HA THR 84 HA THR 84 -12.852 -15.264 -3.146 1074 HB THR 84 HB THR 84 -11.233 -15.887 -0.656 1075 HG1 THR 84 1HG THR 84 -10.499 -14.151 -1.575 1076 HG21 THR 84 3HG2 THR 84 -11.400 -18.041 -1.678 1077 HG22 THR 84 1HG2 THR 84 -9.803 -17.335 -1.920 1078 HG23 THR 84 2HG2 THR 84 -10.996 -17.338 -3.268 1079 H HIS 85 HN HIS 85 -13.423 -16.321 0.257 1080 HA HIS 85 HA HIS 85 -14.550 -18.873 -0.352 1081 HD1 HIS 85 1HD HIS 85 -15.955 -20.614 2.023 1082 HD2 HIS 85 2HD HIS 85 -17.011 -16.578 2.710 1083 HE1 HIS 85 1HE HIS 85 -18.407 -20.579 2.847 1084 HB2 HIS 85 2HB HIS 85 -13.920 -18.621 1.896 1085 HB3 HIS 85 3HB HIS 85 -14.562 -16.990 2.005 1086 H THR 86 HN THR 86 -15.924 -15.613 -0.169 1087 HA THR 86 HA THR 86 -18.664 -16.176 -0.125 1088 HB THR 86 HB THR 86 -17.198 -13.990 -1.652 1089 HG1 THR 86 1HG THR 86 -16.906 -14.073 0.642 1090 HG21 THR 86 3HG2 THR 86 -19.147 -12.627 -1.451 1091 HG22 THR 86 1HG2 THR 86 -20.099 -14.009 -0.837 1092 HG23 THR 86 2HG2 THR 86 -19.465 -14.015 -2.508 1093 H ARG 87 HN ARG 87 -16.355 -16.287 -2.881 1094 HA ARG 87 HA ARG 87 -18.341 -16.427 -4.926 1095 HE ARG 87 HE ARG 87 -15.402 -13.548 -7.312 1096 HB2 ARG 87 2HB ARG 87 -15.492 -17.456 -4.877 1097 HB3 ARG 87 3HB ARG 87 -16.520 -17.401 -6.303 1098 HG2 ARG 87 2HG ARG 87 -16.749 -14.937 -6.055 1099 HG3 ARG 87 3HG ARG 87 -15.611 -14.976 -4.702 1100 HD2 ARG 87 2HD ARG 87 -13.816 -15.740 -6.082 1101 HD3 ARG 87 3HD ARG 87 -14.912 -16.143 -7.417 1102 HH11 ARG 87 1HH2 ARG 87 -12.246 -15.143 -7.412 1103 HH12 ARG 87 2HH2 ARG 87 -11.516 -13.705 -8.117 1104 HH21 ARG 87 1HH1 ARG 87 -14.517 -12.032 -8.429 1105 HH22 ARG 87 2HH1 ARG 87 -12.785 -11.978 -8.740 1106 H THR 88 HN THR 88 -17.116 -18.879 -2.695 1107 HA THR 88 HA THR 88 -17.903 -21.227 -4.108 1108 HB THR 88 HB THR 88 -18.054 -22.328 -1.965 1109 HG1 THR 88 1HG THR 88 -17.784 -19.814 -0.684 1110 HG21 THR 88 3HG2 THR 88 -15.755 -20.334 -1.856 1111 HG22 THR 88 1HG2 THR 88 -15.771 -21.899 -2.679 1112 HG23 THR 88 2HG2 THR 88 -15.903 -21.833 -0.914 1113 H HIS 89 HN HIS 89 -19.815 -18.803 -2.351 1114 HA HIS 89 HA HIS 89 -22.270 -20.440 -2.508 1115 HD1 HIS 89 1HD HIS 89 -22.780 -21.079 -0.055 1116 HD2 HIS 89 2HD HIS 89 -20.679 -17.544 0.847 1117 HE1 HIS 89 1HE HIS 89 -21.923 -21.307 2.355 1118 HB2 HIS 89 2HB HIS 89 -21.783 -17.593 -1.519 1119 HB3 HIS 89 3HB HIS 89 -23.310 -18.455 -1.421 1120 H THR 90 HN THR 90 -20.626 -17.897 -4.325 1121 HA THR 90 HA THR 90 -23.107 -17.163 -5.787 1122 HB THR 90 HB THR 90 -21.847 -15.387 -6.741 1123 HG1 THR 90 1HG THR 90 -19.727 -15.118 -6.558 1124 HG21 THR 90 3HG2 THR 90 -21.079 -14.075 -4.860 1125 HG22 THR 90 1HG2 THR 90 -20.985 -15.520 -3.840 1126 HG23 THR 90 2HG2 THR 90 -22.557 -14.959 -4.435 1127 H GLY 91 HN GLY 91 -20.877 -19.613 -6.080 1128 HA2 GLY 91 2HA GLY 91 -20.012 -20.879 -7.825 1129 HA3 GLY 91 3HA GLY 91 -21.465 -20.376 -8.707 1130 H GLU 92 HN GLU 92 -19.305 -17.826 -7.699 1131 HA GLU 92 HA GLU 92 -19.023 -16.957 -10.431 1132 HB2 GLU 92 2HB GLU 92 -19.304 -15.466 -8.575 1133 HB3 GLU 92 3HB GLU 92 -17.771 -15.964 -7.846 1134 HG2 GLU 92 2HG GLU 92 -16.617 -14.859 -9.811 1135 HG3 GLU 92 3HG GLU 92 -18.208 -14.326 -10.374 1136 H LYS 93 HN LYS 93 -17.918 -18.927 -11.262 1137 HA LYS 93 HA LYS 93 -14.982 -18.886 -10.778 1138 HB2 LYS 93 2HB LYS 93 -16.833 -20.878 -12.139 1139 HB3 LYS 93 3HB LYS 93 -15.073 -21.062 -12.079 1140 HG2 LYS 93 2HG LYS 93 -15.114 -21.185 -9.650 1141 HG3 LYS 93 3HG LYS 93 -16.853 -20.842 -9.617 1142 HD2 LYS 93 2HD LYS 93 -17.286 -22.966 -10.839 1143 HD3 LYS 93 3HD LYS 93 -15.545 -23.283 -10.893 1144 HE2 LYS 93 2HE LYS 93 -16.477 -24.579 -9.091 1145 HE3 LYS 93 3HE LYS 93 -15.482 -23.290 -8.396 1146 HZ1 LYS 93 3HZ LYS 93 -17.578 -23.507 -7.253 1147 HZ2 LYS 93 1HZ LYS 93 -18.423 -23.250 -8.643 1148 HZ3 LYS 93 2HZ LYS 93 -17.505 -22.043 -8.001 1149 HA PRO 94 HA PRO 94 -15.189 -16.815 -14.888 1150 HB2 PRO 94 2HB PRO 94 -13.588 -14.671 -14.417 1151 HB3 PRO 94 3HB PRO 94 -15.253 -14.755 -13.762 1152 HG2 PRO 94 2HG PRO 94 -12.656 -15.435 -12.329 1153 HG3 PRO 94 3HG PRO 94 -13.988 -14.382 -11.761 1154 HD2 PRO 94 2HD PRO 94 -13.784 -17.018 -11.047 1155 HD3 PRO 94 3HD PRO 94 -15.356 -16.180 -11.281 1156 H PHE 95 HN PHE 95 -12.424 -17.834 -12.862 1157 HA PHE 95 HA PHE 95 -10.394 -17.336 -14.919 1158 HD1 PHE 95 2HD PHE 95 -8.207 -16.172 -13.594 1159 HD2 PHE 95 1HD PHE 95 -11.101 -17.563 -10.732 1160 HE1 PHE 95 2HE PHE 95 -7.852 -14.115 -12.242 1161 HE2 PHE 95 1HE PHE 95 -10.767 -15.505 -9.392 1162 HZ PHE 95 HZ PHE 95 -9.133 -13.776 -10.141 1163 HB2 PHE 95 2HB PHE 95 -10.272 -19.045 -12.394 1164 HB3 PHE 95 3HB PHE 95 -8.912 -18.578 -13.397 1165 H SER 96 HN SER 96 -11.333 -18.435 -16.759 1166 HA SER 96 HA SER 96 -11.615 -21.364 -16.631 1167 HG SER 96 HG SER 96 -13.311 -18.957 -17.312 1168 HB2 SER 96 2HB SER 96 -11.863 -19.493 -19.020 1169 HB3 SER 96 3HB SER 96 -12.448 -21.168 -18.906 1170 H CYS 97 HN CYS 97 -10.361 -22.890 -17.695 1171 HA CYS 97 HA CYS 97 -7.588 -22.231 -18.091 1172 HB2 CYS 97 2HB CYS 97 -8.551 -24.467 -17.325 1173 HB3 CYS 97 3HB CYS 97 -9.021 -24.758 -18.995 1174 H ARG 98 HN ARG 98 -6.350 -22.743 -20.047 1175 HA ARG 98 HA ARG 98 -7.807 -21.881 -22.520 1176 HE ARG 98 HE ARG 98 -3.053 -21.317 -19.280 1177 HB2 ARG 98 2HB ARG 98 -5.645 -20.584 -23.052 1178 HB3 ARG 98 3HB ARG 98 -6.693 -19.947 -21.806 1179 HG2 ARG 98 2HG ARG 98 -4.416 -19.668 -21.116 1180 HG3 ARG 98 3HG ARG 98 -5.217 -20.784 -20.026 1181 HD2 ARG 98 2HD ARG 98 -4.110 -22.687 -21.329 1182 HD3 ARG 98 3HD ARG 98 -3.218 -21.445 -22.224 1183 HH11 ARG 98 1HH1 ARG 98 -1.558 -22.783 -22.107 1184 HH12 ARG 98 2HH1 ARG 98 -0.080 -23.144 -21.244 1185 HH21 ARG 98 1HH2 ARG 98 -1.158 -21.731 -18.288 1186 HH22 ARG 98 2HH2 ARG 98 0.164 -22.519 -19.136 1187 H TRP 99 HN TRP 99 -6.400 -24.463 -21.184 1188 HA TRP 99 HA TRP 99 -4.288 -25.131 -23.019 1189 HD1 TRP 99 1HD TRP 99 -4.358 -24.567 -19.701 1190 HE1 TRP 99 1HE TRP 99 -1.997 -24.700 -18.734 1191 HE3 TRP 99 3HE TRP 99 -2.680 -28.638 -22.299 1192 HZ2 TRP 99 2HZ TRP 99 0.355 -26.343 -19.081 1193 HZ3 TRP 99 3HZ TRP 99 -0.342 -29.425 -22.010 1194 HH2 TRP 99 2HH TRP 99 1.174 -28.299 -20.404 1195 HB2 TRP 99 2HB TRP 99 -5.911 -26.605 -20.937 1196 HB3 TRP 99 3HB TRP 99 -4.962 -27.535 -22.085 1197 HA PRO 100 HA PRO 100 -6.586 -26.370 -26.551 1198 HB2 PRO 100 2HB PRO 100 -4.792 -28.025 -27.842 1199 HB3 PRO 100 3HB PRO 100 -4.504 -26.289 -27.585 1200 HG2 PRO 100 2HG PRO 100 -3.523 -28.587 -25.856 1201 HG3 PRO 100 3HG PRO 100 -2.553 -27.265 -26.588 1202 HD2 PRO 100 2HD PRO 100 -3.431 -27.115 -24.026 1203 HD3 PRO 100 3HD PRO 100 -3.430 -25.663 -25.078 1204 H SER 101 HN SER 101 -6.978 -28.039 -24.015 1205 HA SER 101 HA SER 101 -8.553 -30.137 -25.248 1206 HG SER 101 HG SER 101 -6.478 -30.667 -26.206 1207 HB2 SER 101 2HB SER 101 -6.065 -30.923 -23.660 1208 HB3 SER 101 3HB SER 101 -7.411 -32.034 -23.987 1209 H CYS 102 HN CYS 102 -8.741 -27.776 -23.390 1210 HA CYS 102 HA CYS 102 -10.082 -29.170 -21.124 1211 HB2 CYS 102 2HB CYS 102 -7.751 -28.356 -20.483 1212 HB3 CYS 102 3HB CYS 102 -8.316 -26.703 -20.757 1213 H GLN 103 HN GLN 103 -11.212 -27.338 -19.747 1214 HA GLN 103 HA GLN 103 -12.184 -24.970 -20.976 1215 HB2 GLN 103 2HB GLN 103 -14.593 -25.735 -21.407 1216 HB3 GLN 103 3HB GLN 103 -13.431 -26.160 -22.590 1217 HG2 GLN 103 2HG GLN 103 -13.595 -28.381 -20.693 1218 HG3 GLN 103 3HG GLN 103 -15.215 -27.854 -21.090 1219 HE21 GLN 103 1HE2 GLN 103 -12.334 -27.827 -23.373 1220 HE22 GLN 103 2HE2 GLN 103 -13.130 -29.039 -24.404 1221 H LYS 104 HN LYS 104 -11.262 -26.164 -18.407 1222 HA LYS 104 HA LYS 104 -13.669 -26.199 -16.669 1223 HB2 LYS 104 2HB LYS 104 -10.709 -26.627 -16.099 1224 HB3 LYS 104 3HB LYS 104 -11.989 -26.799 -14.889 1225 HG2 LYS 104 2HG LYS 104 -12.929 -28.721 -15.970 1226 HG3 LYS 104 3HG LYS 104 -12.041 -28.420 -17.466 1227 HD2 LYS 104 2HD LYS 104 -9.893 -28.756 -16.145 1228 HD3 LYS 104 3HD LYS 104 -10.892 -29.362 -14.817 1229 HE2 LYS 104 2HE LYS 104 -10.029 -31.224 -16.097 1230 HE3 LYS 104 3HE LYS 104 -11.775 -31.126 -16.396 1231 HZ1 LYS 104 3HZ LYS 104 -10.333 -31.437 -18.404 1232 HZ2 LYS 104 1HZ LYS 104 -9.765 -29.895 -18.173 1233 HZ3 LYS 104 2HZ LYS 104 -11.341 -30.131 -18.487 1234 H LYS 105 HN LYS 105 -13.867 -24.808 -14.825 1235 HA LYS 105 HA LYS 105 -12.352 -22.254 -15.097 1236 HB2 LYS 105 2HB LYS 105 -14.496 -21.099 -14.504 1237 HB3 LYS 105 3HB LYS 105 -14.412 -21.826 -16.103 1238 HG2 LYS 105 2HG LYS 105 -15.826 -23.688 -15.435 1239 HG3 LYS 105 3HG LYS 105 -15.840 -23.131 -13.760 1240 HD2 LYS 105 2HD LYS 105 -17.926 -22.650 -14.936 1241 HD3 LYS 105 3HD LYS 105 -17.171 -21.184 -14.352 1242 HE2 LYS 105 2HE LYS 105 -16.900 -22.128 -17.237 1243 HE3 LYS 105 3HE LYS 105 -18.242 -21.130 -16.659 1244 HZ1 LYS 105 3HZ LYS 105 -15.408 -20.386 -16.754 1245 HZ2 LYS 105 1HZ LYS 105 -16.493 -19.564 -15.835 1246 HZ3 LYS 105 2HZ LYS 105 -16.679 -19.650 -17.480 1247 H PHE 106 HN PHE 106 -11.948 -21.072 -13.270 1248 HA PHE 106 HA PHE 106 -12.613 -22.400 -10.660 1249 HD1 PHE 106 1HD PHE 106 -10.656 -24.300 -9.727 1250 HD2 PHE 106 2HD PHE 106 -9.500 -22.408 -13.424 1251 HE1 PHE 106 1HE PHE 106 -10.294 -26.525 -10.772 1252 HE2 PHE 106 2HE PHE 106 -9.204 -24.627 -14.478 1253 HZ PHE 106 HZ PHE 106 -9.641 -26.689 -13.156 1254 HB2 PHE 106 2HB PHE 106 -9.970 -21.071 -11.436 1255 HB3 PHE 106 3HB PHE 106 -10.355 -21.827 -9.891 1256 H ALA 107 HN ALA 107 -12.370 -20.933 -8.769 1257 HA ALA 107 HA ALA 107 -13.436 -18.245 -9.498 1258 HB1 ALA 107 1HB ALA 107 -13.562 -19.871 -6.905 1259 HB2 ALA 107 2HB ALA 107 -14.236 -18.247 -7.108 1260 HB3 ALA 107 3HB ALA 107 -14.895 -19.582 -8.050 1261 H ARG 108 HN ARG 108 -10.492 -19.609 -8.785 1262 HA ARG 108 HA ARG 108 -9.512 -17.026 -7.668 1263 HE ARG 108 HE ARG 108 -7.313 -19.676 -4.715 1264 HB2 ARG 108 2HB ARG 108 -8.629 -19.801 -6.801 1265 HB3 ARG 108 3HB ARG 108 -7.855 -18.270 -6.372 1266 HG2 ARG 108 2HG ARG 108 -9.483 -17.618 -4.922 1267 HG3 ARG 108 3HG ARG 108 -10.736 -18.643 -5.633 1268 HD2 ARG 108 2HD ARG 108 -9.987 -19.454 -3.420 1269 HD3 ARG 108 3HD ARG 108 -9.817 -20.635 -4.707 1270 HH11 ARG 108 2HH2 ARG 108 -9.234 -20.333 -1.871 1271 HH12 ARG 108 1HH2 ARG 108 -7.905 -21.116 -1.038 1272 HH21 ARG 108 1HH1 ARG 108 -5.664 -20.717 -3.661 1273 HH22 ARG 108 2HH1 ARG 108 -5.934 -21.331 -2.035 1274 H SER 109 HN SER 109 -7.681 -16.257 -8.583 1275 HA SER 109 HA SER 109 -6.868 -17.178 -11.122 1276 HG SER 109 HG SER 109 -4.999 -15.785 -11.894 1277 HB2 SER 109 2HB SER 109 -6.522 -14.864 -10.356 1278 HB3 SER 109 3HB SER 109 -5.408 -15.417 -9.103 1279 H ASP 110 HN ASP 110 -5.579 -17.887 -7.855 1280 HA ASP 110 HA ASP 110 -3.159 -19.188 -8.843 1281 HB2 ASP 110 2HB ASP 110 -2.693 -19.697 -6.624 1282 HB3 ASP 110 3HB ASP 110 -3.413 -18.097 -6.559 1283 H GLU 111 HN GLU 111 -6.515 -20.154 -7.998 1284 HA GLU 111 HA GLU 111 -6.079 -23.003 -7.968 1285 HB2 GLU 111 2HB GLU 111 -8.503 -21.244 -8.443 1286 HB3 GLU 111 3HB GLU 111 -8.561 -22.945 -8.850 1287 HG2 GLU 111 2HG GLU 111 -7.951 -23.594 -6.586 1288 HG3 GLU 111 3HG GLU 111 -7.932 -21.903 -6.082 1289 H LEU 112 HN LEU 112 -6.870 -20.655 -10.581 1290 HA LEU 112 HA LEU 112 -6.909 -22.616 -12.689 1291 HG LEU 112 HG LEU 112 -5.399 -20.740 -14.786 1292 HB2 LEU 112 2HB LEU 112 -7.835 -20.406 -12.983 1293 HB3 LEU 112 3HB LEU 112 -6.260 -19.637 -12.741 1294 HD11 LEU 112 1HD1 LEU 112 -8.255 -21.722 -15.247 1295 HD12 LEU 112 2HD1 LEU 112 -6.872 -22.772 -14.822 1296 HD13 LEU 112 3HD1 LEU 112 -6.848 -21.872 -16.310 1297 HD21 LEU 112 3HD2 LEU 112 -6.576 -19.433 -16.419 1298 HD22 LEU 112 1HD2 LEU 112 -6.454 -18.493 -14.921 1299 HD23 LEU 112 2HD2 LEU 112 -7.990 -19.279 -15.372 1300 H VAL 113 HN VAL 113 -4.250 -20.602 -11.288 1301 HA VAL 113 HA VAL 113 -2.143 -21.451 -13.055 1302 HB VAL 113 HB VAL 113 -2.051 -20.665 -10.105 1303 HG11 VAL 113 1HG1 VAL 113 0.347 -20.139 -10.495 1304 HG12 VAL 113 2HG1 VAL 113 0.000 -21.864 -10.583 1305 HG13 VAL 113 3HG1 VAL 113 0.238 -20.935 -12.080 1306 HG21 VAL 113 3HG2 VAL 113 -1.182 -18.942 -12.428 1307 HG22 VAL 113 1HG2 VAL 113 -2.822 -18.876 -11.824 1308 HG23 VAL 113 2HG2 VAL 113 -1.476 -18.468 -10.744 1309 H ARG 114 HN ARG 114 -3.441 -22.858 -10.016 1310 HA ARG 114 HA ARG 114 -1.546 -25.042 -9.881 1311 HE ARG 114 HE ARG 114 -4.624 -27.803 -5.421 1312 HB2 ARG 114 2HB ARG 114 -2.812 -24.136 -7.954 1313 HB3 ARG 114 3HB ARG 114 -4.316 -24.655 -8.693 1314 HG2 ARG 114 2HG ARG 114 -3.525 -27.067 -8.418 1315 HG3 ARG 114 3HG ARG 114 -2.155 -26.408 -7.490 1316 HD2 ARG 114 2HD ARG 114 -3.960 -25.109 -6.127 1317 HD3 ARG 114 3HD ARG 114 -5.149 -26.141 -6.919 1318 HH11 ARG 114 1HH2 ARG 114 -1.895 -25.551 -5.341 1319 HH12 ARG 114 2HH2 ARG 114 -1.288 -26.277 -3.865 1320 HH21 ARG 114 1HH1 ARG 114 -3.872 -28.441 -3.499 1321 HH22 ARG 114 2HH1 ARG 114 -2.355 -27.832 -2.892 1322 H HIS 115 HN HIS 115 -4.543 -24.479 -11.645 1323 HA HIS 115 HA HIS 115 -5.227 -27.321 -11.967 1324 HD1 HIS 115 1HD HIS 115 -7.229 -28.513 -13.137 1325 HD2 HIS 115 2HD HIS 115 -6.688 -25.245 -15.750 1326 HE1 HIS 115 1HE HIS 115 -7.691 -29.350 -15.523 1327 HB2 HIS 115 2HB HIS 115 -7.062 -25.781 -12.048 1328 HB3 HIS 115 3HB HIS 115 -6.251 -24.752 -13.236 1329 H HIS 116 HN HIS 116 -3.711 -24.655 -13.823 1330 HA HIS 116 HA HIS 116 -3.080 -26.120 -16.166 1331 HD1 HIS 116 1HD HIS 116 -4.600 -24.614 -17.172 1332 HD2 HIS 116 2HD HIS 116 -1.989 -21.478 -16.024 1333 HE1 HIS 116 1HE HIS 116 -5.504 -22.526 -18.167 1334 HB2 HIS 116 2HB HIS 116 -1.625 -23.852 -14.750 1335 HB3 HIS 116 3HB HIS 116 -1.149 -24.490 -16.320 1336 H ASN 117 HN ASN 117 -1.619 -26.159 -12.902 1337 HA ASN 117 HA ASN 117 0.858 -27.481 -13.694 1338 HB2 ASN 117 2HB ASN 117 0.215 -26.156 -11.490 1339 HB3 ASN 117 3HB ASN 117 -0.366 -27.727 -10.930 1340 HD21 ASN 117 1HD2 ASN 117 1.639 -29.472 -12.006 1341 HD22 ASN 117 2HD2 ASN 117 3.148 -28.976 -11.197 1342 H MET 118 HN MET 118 -2.448 -28.529 -13.365 1343 HA MET 118 HA MET 118 -1.802 -31.365 -12.850 1344 HB2 MET 118 2HB MET 118 -4.431 -30.175 -13.840 1345 HB3 MET 118 3HB MET 118 -4.178 -31.748 -13.116 1346 HG2 MET 118 2HG MET 118 -3.676 -30.760 -10.949 1347 HG3 MET 118 3HG MET 118 -3.744 -29.136 -11.633 1348 HE1 MET 118 3HE MET 118 -6.861 -28.892 -9.428 1349 HE2 MET 118 1HE MET 118 -5.350 -29.745 -9.017 1350 HE3 MET 118 2HE MET 118 -5.294 -28.201 -9.894 1351 H HIS 119 HN HIS 119 -1.949 -29.196 -15.580 1352 HA HIS 119 HA HIS 119 -2.331 -31.387 -17.545 1353 HD1 HIS 119 1HD HIS 119 -4.365 -31.115 -19.156 1354 HD2 HIS 119 2HD HIS 119 -4.265 -27.181 -17.643 1355 HE1 HIS 119 1HE HIS 119 -6.767 -30.193 -19.256 1356 HB2 HIS 119 2HB HIS 119 -1.925 -28.375 -17.816 1357 HB3 HIS 119 3HB HIS 119 -1.936 -29.484 -19.174 Start of MODEL 4 1 H5 DC 124 5H C 124 -3.996 -31.539 -5.080 2 H6 DC 124 6H C 124 -5.908 -31.082 -6.552 3 H5' DC 124 H5' C 124 -8.999 -32.483 -9.769 4 H5'' DC 124 H5" C 124 -7.552 -32.353 -8.753 5 H4' DC 124 H4' C 124 -10.407 -32.405 -7.688 6 H3' DC 124 H3' C 124 -9.143 -30.253 -8.960 7 H2' DC 124 H2' C 124 -7.385 -30.000 -7.451 8 H2'' DC 124 H2" C 124 -8.582 -28.963 -6.630 9 H1' DC 124 H1' C 124 -9.396 -30.737 -5.255 10 H41 DC 124 1H4 C 124 -4.529 -32.299 -1.510 11 H42 DC 124 2H4 C 124 -3.366 -32.030 -2.793 12 H8 DG 125 8H G 125 -9.160 -26.973 -5.663 13 H1 DG 125 1H G 125 -6.473 -29.020 -0.202 14 H5' DG 125 H5' G 125 -12.832 -29.677 -6.344 15 H5'' DG 125 H5" G 125 -14.001 -28.426 -6.813 16 H4' DG 125 H4' G 125 -13.845 -28.574 -4.370 17 H3' DG 125 H3' G 125 -13.435 -26.136 -5.722 18 H2' DG 125 H2' G 125 -11.139 -26.045 -5.339 19 H2'' DG 125 H2" G 125 -11.646 -25.264 -3.820 20 H1' DG 125 H1' G 125 -11.557 -27.337 -2.599 21 H21 DG 125 1H2 G 125 -7.936 -29.247 1.346 22 H22 DG 125 2H2 G 125 -9.642 -28.944 1.058 23 H5 DC 126 5H C 126 -8.028 -23.896 -4.304 24 H6 DC 126 6H C 126 -9.977 -23.477 -2.893 25 H5' DC 126 H5' C 126 -13.489 -26.220 -1.187 26 H5'' DC 126 H5" C 126 -14.544 -24.951 -0.531 27 H4' DC 126 H4' C 126 -12.636 -25.185 0.906 28 H3' DC 126 H3' C 126 -13.253 -22.671 -0.266 29 H2' DC 126 H2' C 126 -11.359 -22.731 -1.633 30 H2'' DC 126 H2" C 126 -10.620 -21.944 -0.217 31 H1' DC 126 H1' C 126 -10.010 -24.172 0.755 32 H41 DC 126 1H4 C 126 -5.013 -25.479 -2.923 33 H42 DC 126 2H4 C 126 -5.821 -24.886 -4.357 34 H8 DG 127 8H G 127 -9.653 -21.761 1.615 35 H1 DG 127 1H G 127 -3.410 -23.037 0.720 36 H5' DG 127 H5' G 127 -12.040 -23.687 3.873 37 H5'' DG 127 H5" G 127 -12.570 -22.654 5.204 38 H4' DG 127 H4' G 127 -10.494 -23.750 5.823 39 H3' DG 127 H3' G 127 -10.768 -20.946 5.780 40 H2' DG 127 H2' G 127 -9.305 -20.497 4.085 41 H2'' DG 127 H2" G 127 -8.043 -20.682 5.340 42 H1' DG 127 H1' G 127 -7.617 -22.905 4.756 43 H21 DG 127 1H2 G 127 -2.459 -23.476 2.608 44 H22 DG 127 2H2 G 127 -3.314 -23.332 4.134 45 H8 DG 128 8H G 128 -7.432 -18.604 4.139 46 H1 DG 128 1H G 128 -2.661 -19.717 -0.035 47 H5' DG 128 H5' G 128 -6.724 -21.960 7.564 48 H5'' DG 128 H5" G 128 -6.579 -21.123 9.118 49 H4' DG 128 H4' G 128 -4.538 -20.691 8.044 50 H3' DG 128 H3' G 128 -6.255 -18.533 8.573 51 H2' DG 128 H2' G 128 -6.771 -18.156 6.265 52 H2'' DG 128 H2" G 128 -5.328 -17.102 6.435 53 H1' DG 128 H1' G 128 -3.851 -18.910 5.682 54 H21 DG 128 1H2 G 128 -0.768 -19.865 1.026 55 H22 DG 128 2H2 G 128 -0.697 -19.844 2.778 56 H8 DG 129 8H G 129 -3.444 -16.311 5.620 57 H1 DG 129 1H G 129 -0.994 -16.474 -0.297 58 H5' DG 129 H5' G 129 -1.767 -18.286 8.633 59 H5'' DG 129 H5" G 129 -1.139 -17.323 9.949 60 H4' DG 129 H4' G 129 0.467 -17.241 8.307 61 H3' DG 129 H3' G 129 -0.688 -14.726 8.748 62 H2' DG 129 H2' G 129 -1.915 -14.792 6.733 63 H2'' DG 129 H2" G 129 -0.441 -14.015 6.109 64 H1' DG 129 H1' G 129 0.464 -16.146 5.348 65 H21 DG 129 1H2 G 129 1.164 -16.396 -0.224 66 H22 DG 129 2H2 G 129 2.039 -16.317 1.295 67 H8 DG 130 8H G 130 0.575 -13.500 4.204 68 H1 DG 130 1H G 130 -0.579 -12.924 -2.050 69 H5' DG 130 H5' G 130 2.941 -15.595 5.501 70 H5'' DG 130 H5" G 130 4.063 -14.752 6.590 71 H4' DG 130 H4' G 130 5.087 -14.499 4.507 72 H3' DG 130 H3' G 130 4.158 -12.159 5.734 73 H2' DG 130 H2' G 130 2.406 -11.709 4.339 74 H2'' DG 130 H2" G 130 3.621 -11.027 3.257 75 H1' DG 130 H1' G 130 3.668 -12.877 1.891 76 H21 DG 130 1H2 G 130 1.272 -12.547 -3.121 77 H22 DG 130 2H2 G 130 2.784 -12.240 -2.281 78 H8 DG 131 8H G 131 2.560 -9.480 2.432 79 H1 DG 131 1H G 131 -1.822 -9.400 -2.268 80 H5' DG 131 H5' G 131 5.825 -11.763 1.661 81 H5'' DG 131 H5" G 131 7.326 -10.848 1.809 82 H4' DG 131 H4' G 131 6.618 -10.328 -0.372 83 H3' DG 131 H3' G 131 6.625 -8.228 1.528 84 H2' DG 131 H2' G 131 4.305 -8.121 1.787 85 H2'' DG 131 H2" G 131 4.453 -7.005 0.415 86 H1' DG 131 H1' G 131 3.919 -8.762 -1.186 87 H21 DG 131 1H2 G 131 -0.904 -9.078 -4.180 88 H22 DG 131 2H2 G 131 0.825 -8.819 -4.349 89 H5 DC 132 5H C 132 1.327 -6.568 1.565 90 H6 DC 132 6H C 132 2.827 -5.892 -0.231 91 H5' DC 132 H5' C 132 5.271 -7.645 -2.888 92 H5'' DC 132 H5" C 132 6.319 -6.367 -3.528 93 H4' DC 132 H4' C 132 4.278 -6.106 -4.663 94 H3' DC 132 H3' C 132 5.259 -4.072 -2.970 95 H2' DC 132 H2' C 132 3.586 -4.293 -1.411 96 H2'' DC 132 H2" C 132 2.722 -3.193 -2.487 97 H1' DC 132 H1' C 132 1.610 -4.998 -3.650 98 H41 DC 132 1H4 C 132 -2.296 -6.645 1.082 99 H42 DC 132 2H4 C 132 -0.952 -7.010 2.145 100 H8 DG 133 8H G 133 1.258 -1.899 -3.009 101 H1 DG 133 1H G 133 -4.970 -2.610 -1.565 102 H5' DG 133 H5' G 133 2.606 -3.347 -6.593 103 H5'' DG 133 H5" G 133 3.271 -1.971 -7.507 104 H4' DG 133 H4' G 133 0.915 -2.080 -8.011 105 H3' DG 133 H3' G 133 2.027 0.198 -6.882 106 H2' DG 133 H2' G 133 1.268 -0.126 -4.642 107 H2'' DG 133 H2" G 133 -0.098 0.841 -5.256 108 H1' DG 133 H1' G 133 -1.332 -1.040 -5.833 109 H21 DG 133 1H2 G 133 -6.208 -2.141 -3.339 110 H22 DG 133 2H2 G 133 -5.498 -1.592 -4.840 111 H5' DT 134 H5' T 134 -2.554 -0.038 -7.559 112 H5'' DT 134 H5" T 134 -2.881 1.353 -8.597 113 H4' DT 134 H4' T 134 -4.786 1.138 -7.185 114 H3' DT 134 H3' T 134 -3.109 3.373 -7.345 115 H2' DT 134 H2' T 134 -2.245 3.036 -5.220 116 H2'' DT 134 H2" T 134 -3.605 4.085 -4.821 117 H1' DT 134 H1' T 134 -5.086 2.126 -4.331 118 H3 DT 134 3H T 134 -4.190 0.373 -0.179 119 H71 DT 134 1H7 T 134 0.328 1.863 -0.751 120 H72 DT 134 2H7 T 134 0.422 0.227 -1.440 121 H73 DT 134 3H7 T 134 0.550 1.644 -2.511 122 H6 DT 134 6H T 134 -1.358 2.016 -3.735 123 H5 DC 135 5H C 135 -3.595 4.854 -2.725 124 H6 DC 135 6H C 135 -5.465 5.280 -4.243 125 H5' DC 135 H5' C 135 -7.531 3.605 -7.386 126 H5'' DC 135 H5" C 135 -8.384 4.988 -8.117 127 H4' DC 135 H4' C 135 -9.571 4.301 -6.158 128 H3' DC 135 H3' C 135 -8.632 6.963 -6.356 129 H2' DC 135 H2' C 135 -7.018 6.606 -4.722 130 H2'' DC 135 H2" C 135 -8.332 7.143 -3.683 131 H1' DC 135 H1' C 135 -9.025 4.855 -3.206 132 H41 DC 135 1H4 C 135 -4.157 3.364 0.584 133 H42 DC 135 2H4 C 135 -2.998 3.898 -0.600 134 H5' DT 136 H5' T 136 -10.908 5.252 -2.489 135 H5'' DT 136 H5" T 136 -12.433 6.071 -2.900 136 H4' DT 136 H4' T 136 -12.470 6.060 -0.579 137 H3' DT 136 H3' T 136 -12.283 8.585 -1.786 138 H2' DT 136 H2' T 136 -10.104 9.018 -1.316 139 H2'' DT 136 H2" T 136 -10.676 9.542 0.235 140 H1' DT 136 H1' T 136 -10.209 7.519 1.344 141 H3 DT 136 3H T 136 -5.853 6.517 1.850 142 H71 DT 136 1H7 T 136 -6.539 8.682 -3.065 143 H72 DT 136 2H7 T 136 -5.184 9.223 -2.045 144 H73 DT 136 3H7 T 136 -5.166 7.594 -2.758 145 H6 DT 136 6H T 136 -8.419 8.186 -1.830 146 H8 DG 137 8H G 137 -9.657 10.348 1.749 147 H1 DG 137 1H G 137 -3.756 9.334 4.030 148 H5' DG 137 H5' G 137 -12.081 7.479 2.532 149 H5'' DG 137 H5" G 137 -13.566 8.190 3.167 150 H4' DG 137 H4' G 137 -12.283 7.949 5.041 151 H3' DG 137 H3' G 137 -12.974 10.524 4.254 152 H2' DG 137 H2' G 137 -10.922 11.108 3.396 153 H2'' DG 137 H2" G 137 -10.609 11.616 5.041 154 H1' DG 137 H1' G 137 -9.391 9.617 5.555 155 H21 DG 137 1H2 G 137 -3.844 8.830 6.143 156 H22 DG 137 2H2 G 137 -5.363 8.826 7.028 157 H5 DC 138 5H C 138 -8.598 13.068 4.055 158 H6 DC 138 6H C 138 -9.186 12.356 6.321 159 H5' DC 138 H5' C 138 -10.255 9.277 7.561 160 H5'' DC 138 H5" C 138 -11.240 9.712 8.961 161 H4' DC 138 H4' C 138 -9.090 9.530 9.830 162 H3' DC 138 H3' C 138 -10.370 12.010 9.981 163 H2' DC 138 H2' C 138 -9.232 13.056 8.284 164 H2'' DC 138 H2" C 138 -8.059 13.420 9.522 165 H1' DC 138 H1' C 138 -6.610 11.669 8.935 166 H41 DC 138 1H4 C 138 -5.088 13.186 2.983 167 H42 DC 138 2H4 C 138 -6.771 13.325 2.520 168 H8 DG 139 8H G 139 -6.369 14.557 9.707 169 H1 DG 139 1H G 139 -2.121 15.802 5.072 170 H5' DG 139 H5' G 139 -6.082 11.023 11.310 171 H5'' DG 139 H5" G 139 -6.174 11.382 13.045 172 H4' DG 139 H4' G 139 -3.874 11.501 12.437 173 H3' DG 139 H3' G 139 -5.107 13.710 13.629 174 H2' DG 139 H2' G 139 -5.313 14.971 11.693 175 H2'' DG 139 H2" G 139 -3.693 15.521 12.122 176 H1' DG 139 H1' G 139 -2.639 13.981 10.623 177 H21 DG 139 1H2 G 139 -0.105 15.313 5.705 178 H22 DG 139 2H2 G 139 0.241 14.786 7.345 179 H5 DC 140 5H C 140 -4.100 17.626 10.611 180 H6 DC 140 6H C 140 -2.056 16.863 11.707 181 H5' DC 140 H5' C 140 -0.686 13.390 12.218 182 H5'' DC 140 H5" C 140 0.215 13.764 13.691 183 H4' DC 140 H4' C 140 1.605 14.184 11.750 184 H3' DC 140 H3' C 140 1.287 16.039 13.803 185 H2' DC 140 H2' C 140 -0.229 17.424 12.660 186 H2'' DC 140 H2" C 140 1.277 18.177 12.088 187 H1' DC 140 H1' C 140 1.283 16.971 10.043 188 H41 DC 140 1H4 C 140 -4.021 18.954 7.187 189 H42 DC 140 2H4 C 140 -5.001 18.537 8.577 190 H8 DG 141 8H G 141 -3.411 21.573 0.899 191 H1 DG 141 1H G 141 -1.617 18.746 6.381 192 H5' DG 141 H5' G 141 -0.773 24.537 -0.670 193 H5'' DG 141 H5" G 141 -1.006 23.818 -2.273 194 H4' DG 141 H4' G 141 0.889 22.870 -0.975 195 H3' DG 141 H3' G 141 -0.891 21.392 -2.512 196 H2' DG 141 H2' G 141 -2.148 20.578 -0.740 197 H2'' DG 141 H2" G 141 -0.939 19.292 -0.729 198 H1' DG 141 H1' G 141 0.297 20.305 1.040 199 H21 DG 141 1H2 G 141 0.507 18.340 6.384 200 H22 DG 141 2H2 G 141 1.506 18.628 4.966 201 H5 DC 142 5H C 142 -2.643 17.585 0.418 202 H6 DC 142 6H C 142 -0.246 17.299 0.035 203 H5' DC 142 H5' C 142 2.213 19.653 0.377 204 H5'' DC 142 H5" C 142 3.376 19.163 -0.855 205 H4' DC 142 H4' C 142 4.024 17.948 0.998 206 H3' DC 142 H3' C 142 3.133 16.530 -1.247 207 H2' DC 142 H2' C 142 1.127 15.878 -0.452 208 H2'' DC 142 H2" C 142 1.983 14.578 0.282 209 H1' DC 142 H1' C 142 1.991 15.560 2.444 210 H41 DC 142 1H4 C 142 -4.138 16.735 3.650 211 H42 DC 142 2H4 C 142 -4.353 17.491 2.084 212 H8 DG 143 8H G 143 1.557 12.967 1.400 213 H1 DG 143 1H G 143 -3.737 12.456 4.965 214 H5' DG 143 H5' G 143 4.233 15.338 3.264 215 H5'' DG 143 H5" G 143 5.679 14.405 2.865 216 H4' DG 143 H4' G 143 4.888 13.563 4.962 217 H3' DG 143 H3' G 143 5.251 11.916 2.721 218 H2' DG 143 H2' G 143 3.076 11.687 2.121 219 H2'' DG 143 H2" G 143 3.047 10.352 3.229 220 H1' DG 143 H1' G 143 2.052 11.631 4.970 221 H21 DG 143 1H2 G 143 -3.277 11.655 6.913 222 H22 DG 143 2H2 G 143 -1.639 11.187 7.348 223 H5 DC 144 5H C 144 0.840 9.526 1.983 224 H6 DC 144 6H C 144 1.840 8.666 4.047 225 H5' DC 144 H5' C 144 3.105 11.009 6.422 226 H5'' DC 144 H5" C 144 4.379 10.056 7.144 227 H4' DC 144 H4' C 144 2.540 9.503 8.376 228 H3' DC 144 H3' C 144 3.783 7.428 7.010 229 H2' DC 144 H2' C 144 2.216 7.108 5.359 230 H2'' DC 144 H2" C 144 1.369 6.147 6.555 231 H1' DC 144 H1' C 144 -0.178 7.826 7.095 232 H41 DC 144 1H4 C 144 -2.812 9.829 1.659 233 H42 DC 144 2H4 C 144 -1.243 10.052 0.896 234 H8 DA 145 8H A 145 -0.190 4.838 5.914 235 H2 DA 145 2H A 145 -6.275 6.201 4.444 236 H5' DA 145 H5' A 145 0.068 7.292 9.712 237 H5'' DA 145 H5" A 145 0.206 5.978 10.897 238 H4' DA 145 H4' A 145 -2.133 6.299 10.403 239 H3' DA 145 H3' A 145 -0.914 3.822 10.151 240 H2' DA 145 H2' A 145 -0.767 3.881 7.806 241 H2'' DA 145 H2" A 145 -2.335 3.061 7.964 242 H1' DA 145 H1' A 145 -3.562 5.098 7.825 243 H61 DA 145 2H6 A 145 -1.909 6.042 1.574 244 H62 DA 145 1H6 A 145 -3.496 6.459 0.973 245 H8 DG 146 8H G 146 -3.838 1.689 7.256 246 H1 DG 146 1H G 146 -5.769 3.332 1.382 247 H5' DG 146 H5' G 146 -5.165 4.618 9.826 248 H5'' DG 146 H5" G 146 -6.315 4.539 11.133 249 H4' DG 146 H4' G 146 -7.812 3.922 9.636 250 H3' DG 146 H3' G 146 -6.763 1.441 10.441 251 H2' DG 146 H2' G 146 -5.517 1.022 8.498 252 H2'' DG 146 H2" G 146 -7.074 0.416 7.898 253 H1' DG 146 H1' G 146 -7.639 2.469 6.857 254 H21 DG 146 1H2 G 146 -7.889 3.707 1.359 255 H22 DG 146 2H2 G 146 -8.839 3.741 2.823 256 H8 DA 147 8H A 147 -6.897 -1.213 6.463 257 H2 DA 147 2H A 147 -6.489 0.281 0.239 258 H5' DA 147 H5' A 147 -10.287 1.853 7.545 259 H5'' DA 147 H5" A 147 -11.578 0.666 7.860 260 H4' DA 147 H4' A 147 -11.308 1.086 5.436 261 H3' DA 147 H3' A 147 -11.286 -1.487 6.689 262 H2' DA 147 H2' A 147 -9.100 -1.996 6.095 263 H2'' DA 147 H2" A 147 -9.832 -2.454 4.530 264 H1' DA 147 H1' A 147 -9.397 -0.277 3.580 265 H61 DA 147 2H6 A 147 -2.840 -0.474 3.874 266 H62 DA 147 1H6 A 147 -2.533 -0.289 2.158 267 H5 DC 148 5H C 148 -7.091 -3.486 3.308 268 H6 DC 148 6H C 148 -9.381 -3.423 2.449 269 H5' DC 148 H5' C 148 -12.209 -0.711 2.007 270 H5'' DC 148 H5" C 148 -13.687 -1.659 1.773 271 H4' DC 148 H4' C 148 -12.597 -1.533 -0.363 272 H3' DC 148 H3' C 148 -13.165 -4.000 0.867 273 H2' DC 148 H2' C 148 -10.967 -4.442 1.463 274 H2'' DC 148 H2" C 148 -10.910 -5.217 -0.125 275 H1' DC 148 H1' C 148 -10.118 -3.224 -1.203 276 H41 DC 148 1H4 C 148 -4.229 -3.236 1.003 277 H42 DC 148 2H4 C 148 -4.761 -3.529 2.660 278 H8 DG 149 8H G 149 -9.171 -6.911 -0.956 279 H1 DG 149 1H G 149 -2.825 -5.951 -1.168 280 H5' DG 149 H5' G 149 -10.959 -3.452 -3.277 281 H5'' DG 149 H5" G 149 -12.144 -4.296 -4.286 282 H4' DG 149 H4' G 149 -10.104 -4.521 -5.388 283 H3' DG 149 H3' G 149 -11.526 -6.762 -4.552 284 H2' DG 149 H2' G 149 -10.087 -7.354 -2.870 285 H2'' DG 149 H2" G 149 -9.264 -8.258 -4.136 286 H1' DG 149 H1' G 149 -7.656 -6.439 -4.502 287 H21 DG 149 1H2 G 149 -2.185 -5.605 -3.192 288 H22 DG 149 2H2 G 149 -3.320 -5.555 -4.528 289 H5 DC 150 5H C 150 -7.006 -9.531 -1.632 290 H6 DC 150 6H C 150 -7.180 -9.700 -4.050 291 H5' DC 150 H5' C 150 -8.142 -9.007 -5.666 292 H5'' DC 150 H5" C 150 -8.013 -7.374 -6.357 293 H4' DC 150 H4' C 150 -6.703 -8.222 -8.188 294 H3' DC 150 H3' C 150 -7.724 -10.709 -7.672 295 H2' DC 150 H2' C 150 -6.782 -11.084 -5.627 296 H2'' DC 150 H2" C 150 -5.458 -11.679 -6.593 297 H1' DC 150 H1' C 150 -4.126 -9.737 -6.275 298 H41 DC 150 1H4 C 150 -3.729 -9.400 0.007 299 H42 DC 150 2H4 C 150 -5.473 -9.512 0.224 300 H5 DC 151 5H C 151 -5.161 -12.795 -4.399 301 H6 DC 151 6H C 151 -3.932 -12.880 -6.520 302 H5' DC 151 H5' C 151 -3.486 -10.233 -9.075 303 H5'' DC 151 H5" C 151 -3.240 -11.220 -10.527 304 H4' DC 151 H4' C 151 -1.108 -10.928 -9.451 305 H3' DC 151 H3' C 151 -2.144 -13.469 -9.995 306 H2' DC 151 H2' C 151 -2.707 -13.967 -7.830 307 H2'' DC 151 H2" C 151 -1.085 -14.582 -7.738 308 H1' DC 151 H1' C 151 -0.222 -12.565 -6.706 309 H41 DC 151 1H4 C 151 -3.350 -12.915 -1.218 310 H42 DC 151 2H4 C 151 -4.906 -12.836 -2.017 311 H5 DC 152 5H C 152 -3.155 -15.969 -4.964 312 H6 DC 152 6H C 152 -0.988 -16.021 -6.105 313 H5' DC 152 H5' C 152 1.641 -13.267 -7.566 314 H5'' DC 152 H5" C 152 2.890 -14.073 -8.526 315 H4' DC 152 H4' C 152 3.487 -14.590 -6.319 316 H3' DC 152 H3' C 152 2.594 -16.709 -8.010 317 H2' DC 152 H2' C 152 0.707 -17.137 -6.769 318 H2'' DC 152 H2" C 152 1.815 -18.130 -5.793 319 H1' DC 152 H1' C 152 2.244 -16.335 -4.236 320 H41 DC 152 1H4 C 152 -3.374 -16.222 -1.298 321 H42 DC 152 2H4 C 152 -4.238 -16.078 -2.818 322 H5 DC 153 5H C 153 -1.343 -19.573 -4.696 323 H6 DC 153 6H C 153 1.074 -19.827 -4.456 324 H5' DC 153 H5' C 153 4.513 -17.503 -4.013 325 H5'' DC 153 H5" C 153 5.914 -18.552 -4.346 326 H4' DC 153 H4' C 153 5.190 -19.192 -2.209 327 H3' DC 153 H3' C 153 4.906 -21.144 -4.291 328 H2' DC 153 H2' C 153 2.612 -21.169 -4.159 329 H2'' DC 153 H2" C 153 2.866 -22.275 -2.813 330 H1' DC 153 H1' C 153 2.698 -20.510 -1.147 331 H41 DC 153 1H4 C 153 -3.533 -19.324 -1.760 332 H42 DC 153 2H4 C 153 -3.441 -19.600 -3.491 333 H5 DC 154 5H C 154 -0.214 -22.941 -3.150 334 H6 DC 154 6H C 154 1.637 -23.552 -1.670 335 H5' DC 154 H5' C 154 4.658 -21.761 0.246 336 H5'' DC 154 H5" C 154 5.745 -23.120 0.621 337 H4' DC 154 H4' C 154 3.987 -23.049 2.277 338 H3' DC 154 H3' C 154 4.532 -25.298 0.560 339 H2' DC 154 H2' C 154 2.457 -25.357 -0.439 340 H2'' DC 154 H2" C 154 1.953 -26.122 1.094 341 H1' DC 154 H1' C 154 1.165 -24.080 2.016 342 H41 DC 154 1H4 C 154 -3.647 -22.669 -1.841 343 H42 DC 154 2H4 C 154 -2.576 -22.429 -3.209 344 H8 DG 155 8H G 155 0.539 -27.605 0.957 345 H1 DG 155 1H G 155 -5.506 -25.836 -0.313 346 H5' DG 155 H5' G 155 2.225 -25.503 4.510 347 H5'' DG 155 H5" G 155 2.813 -26.838 5.532 348 H4' DG 155 H4' G 155 0.434 -26.578 5.911 349 H3' DG 155 H3' G 155 1.475 -29.043 4.983 350 H2' DG 155 H2' G 155 0.499 -28.978 2.865 351 H2'' DG 155 H2" G 155 -0.909 -29.635 3.760 352 H1' DG 155 H1' G 155 -1.873 -27.457 4.049 353 H21 DG 155 1H2 G 155 -6.695 -25.846 1.503 354 H22 DG 155 2H2 G 155 -5.993 -26.226 3.068 355 H5 DC 156 5H C 156 -1.665 -30.624 1.084 356 H6 DC 156 6H C 156 -2.492 -30.947 3.369 357 H5' DC 156 H5' C 156 -2.672 -28.721 6.906 358 H5'' DC 156 H5" C 156 -2.970 -30.004 8.091 359 H4' DC 156 H4' C 156 -5.056 -29.419 7.009 360 H3' DC 156 H3' C 156 -3.983 -32.047 6.989 361 H2' DC 156 H2' C 156 -3.668 -32.191 4.700 362 H2'' DC 156 H2" C 156 -5.427 -32.516 4.736 363 H1' DC 156 H1' C 156 -6.042 -30.286 4.326 364 H41 DC 156 1H4 C 156 -3.882 -29.281 -1.525 365 H42 DC 156 2H4 C 156 -2.244 -29.720 -1.082 366 H8 DG 157 8H G 157 -6.438 -34.783 4.711 367 H1 DG 157 1H G 157 -6.890 -32.331 -1.191 368 H5' DG 157 H5' G 157 -8.701 -31.552 7.230 369 H5'' DG 157 H5" G 157 -9.464 -32.732 8.301 370 H4' DG 157 H4' G 157 -10.843 -32.355 6.282 371 H3' DG 157 H3' G 157 -10.177 -34.937 7.129 372 H2' DG 157 H2' G 157 -8.347 -35.252 5.665 373 H2'' DG 157 H2" G 157 -9.652 -35.898 4.615 374 H1' DG 157 H1' G 157 -9.999 -33.786 3.559 375 H21 DG 157 1H2 G 157 -8.933 -31.753 -1.598 376 H22 DG 157 2H2 G 157 -10.166 -31.802 -0.354 377 HA ALA 1 HA ALA 1 13.890 23.178 1.023 378 H1 ALA 1 HN ALA 1 16.185 24.292 1.128 379 HB1 ALA 1 1HB ALA 1 14.285 23.260 4.047 380 HB2 ALA 1 2HB ALA 1 12.795 22.775 3.206 381 HB3 ALA 1 3HB ALA 1 14.268 21.797 3.037 382 H SER 2 HN SER 2 15.557 25.805 2.545 383 HA SER 2 HA SER 2 13.227 27.520 2.982 384 HG SER 2 HG SER 2 16.826 27.927 2.125 385 HB2 SER 2 2HB SER 2 15.159 29.302 3.119 386 HB3 SER 2 3HB SER 2 15.016 28.060 4.360 387 H GLU 3 HN GLU 3 14.355 26.329 0.161 388 HA GLU 3 HA GLU 3 13.457 28.651 -1.408 389 HB2 GLU 3 2HB GLU 3 15.515 28.657 -2.815 390 HB3 GLU 3 3HB GLU 3 15.804 29.200 -1.180 391 HG2 GLU 3 2HG GLU 3 16.498 26.429 -2.242 392 HG3 GLU 3 3HG GLU 3 17.620 27.773 -2.083 393 H LYS 4 HN LYS 4 13.679 28.038 -3.875 394 HA LYS 4 HA LYS 4 12.186 25.553 -4.196 395 HB2 LYS 4 2HB LYS 4 12.073 26.246 -6.577 396 HB3 LYS 4 3HB LYS 4 11.537 27.498 -5.482 397 HG2 LYS 4 2HG LYS 4 13.326 28.906 -5.886 398 HG3 LYS 4 3HG LYS 4 14.431 27.616 -6.349 399 HD2 LYS 4 2HD LYS 4 12.052 28.448 -8.058 400 HD3 LYS 4 3HD LYS 4 13.685 29.116 -8.233 401 HE2 LYS 4 2HE LYS 4 14.601 26.858 -8.638 402 HE3 LYS 4 3HE LYS 4 12.994 26.152 -8.455 403 HZ1 LYS 4 3HZ LYS 4 12.272 27.441 -10.353 404 HZ2 LYS 4 1HZ LYS 4 13.553 26.490 -10.759 405 HZ3 LYS 4 2HZ LYS 4 13.769 28.106 -10.525 406 H ARG 5 HN ARG 5 14.613 24.743 -3.209 407 HA ARG 5 HA ARG 5 16.416 23.875 -5.364 408 HE ARG 5 HE ARG 5 13.668 23.718 -1.490 409 HB2 ARG 5 2HB ARG 5 17.334 22.394 -3.427 410 HB3 ARG 5 3HB ARG 5 17.507 24.123 -3.331 411 HG2 ARG 5 2HG ARG 5 17.050 23.169 -1.193 412 HG3 ARG 5 3HG ARG 5 15.774 24.280 -1.639 413 HD2 ARG 5 2HD ARG 5 15.333 21.374 -2.225 414 HD3 ARG 5 3HD ARG 5 15.353 21.864 -0.532 415 HH11 ARG 5 1HH1 ARG 5 13.605 20.331 -2.404 416 HH12 ARG 5 2HH1 ARG 5 11.852 20.319 -2.492 417 HH21 ARG 5 1HH2 ARG 5 11.539 23.640 -1.608 418 HH22 ARG 5 2HH2 ARG 5 10.702 22.156 -2.041 419 HA PRO 6 HA PRO 6 14.528 20.085 -6.646 420 HB2 PRO 6 2HB PRO 6 17.003 18.613 -5.721 421 HB3 PRO 6 3HB PRO 6 16.190 18.550 -7.312 422 HG2 PRO 6 2HG PRO 6 18.474 19.963 -7.028 423 HG3 PRO 6 3HG PRO 6 17.102 20.680 -7.939 424 HD2 PRO 6 2HD PRO 6 17.908 21.160 -5.065 425 HD3 PRO 6 3HD PRO 6 17.480 22.358 -6.333 426 H PHE 7 HN PHE 7 13.494 18.138 -5.935 427 HA PHE 7 HA PHE 7 13.206 17.949 -2.982 428 HD1 PHE 7 2HD PHE 7 11.409 18.466 -6.668 429 HD2 PHE 7 1HD PHE 7 10.062 18.366 -2.569 430 HE1 PHE 7 2HE PHE 7 10.070 20.510 -7.055 431 HE2 PHE 7 1HE PHE 7 8.707 20.405 -2.986 432 HZ PHE 7 HZ PHE 7 8.748 21.503 -5.208 433 HB2 PHE 7 2HB PHE 7 11.758 16.477 -5.220 434 HB3 PHE 7 3HB PHE 7 11.299 16.476 -3.523 435 H MET 8 HN MET 8 13.285 15.818 -1.910 436 HA MET 8 HA MET 8 14.568 13.698 -3.477 437 HB2 MET 8 2HB MET 8 16.111 13.088 -1.649 438 HB3 MET 8 3HB MET 8 16.506 14.644 -2.377 439 HG2 MET 8 2HG MET 8 15.604 15.862 -0.523 440 HG3 MET 8 3HG MET 8 14.879 14.417 0.183 441 HE1 MET 8 3HE MET 8 17.691 12.531 1.890 442 HE2 MET 8 1HE MET 8 15.948 12.869 1.819 443 HE3 MET 8 2HE MET 8 16.771 12.169 0.411 444 H CYS 9 HN CYS 9 14.188 11.593 -2.679 445 HA CYS 9 HA CYS 9 11.641 11.306 -1.307 446 HB2 CYS 9 2HB CYS 9 12.389 9.693 -2.999 447 HB3 CYS 9 3HB CYS 9 13.778 9.235 -2.010 448 H ALA 10 HN ALA 10 11.317 9.998 0.671 449 HA ALA 10 HA ALA 10 13.491 10.410 2.691 450 HB1 ALA 10 1HB ALA 10 10.479 10.660 3.137 451 HB2 ALA 10 2HB ALA 10 11.746 10.873 4.367 452 HB3 ALA 10 3HB ALA 10 11.621 12.019 3.020 453 H TYR 11 HN TYR 11 12.789 8.041 0.947 454 HA TYR 11 HA TYR 11 11.951 6.086 3.060 455 HD1 TYR 11 1HD TYR 11 9.922 4.456 2.853 456 HD2 TYR 11 2HD TYR 11 12.667 3.479 -0.315 457 HE1 TYR 11 1HE TYR 11 9.720 2.059 3.417 458 HE2 TYR 11 2HE TYR 11 12.411 1.044 0.211 459 HH TYR 11 HH TYR 11 10.171 -0.095 2.651 460 HB2 TYR 11 2HB TYR 11 10.623 6.100 0.968 461 HB3 TYR 11 3HB TYR 11 12.090 5.728 0.058 462 HA PRO 12 HA PRO 12 16.249 5.110 3.334 463 HB2 PRO 12 2HB PRO 12 16.118 2.761 4.800 464 HB3 PRO 12 3HB PRO 12 15.756 4.377 5.465 465 HG2 PRO 12 2HG PRO 12 13.784 2.333 4.391 466 HG3 PRO 12 3HG PRO 12 13.732 3.203 5.962 467 HD2 PRO 12 2HD PRO 12 12.319 4.074 3.858 468 HD3 PRO 12 3HD PRO 12 13.162 5.254 4.901 469 H GLY 13 HN GLY 13 14.199 3.472 1.233 470 HA2 GLY 13 2HA GLY 13 16.461 1.773 0.237 471 HA3 GLY 13 3HA GLY 13 14.759 1.329 0.003 472 H CYS 14 HN CYS 14 15.801 4.664 -0.111 473 HA CYS 14 HA CYS 14 15.939 4.775 -3.046 474 HB2 CYS 14 2HB CYS 14 13.521 4.753 -2.759 475 HB3 CYS 14 3HB CYS 14 13.595 5.996 -1.514 476 H ASN 15 HN ASN 15 14.752 7.383 -0.946 477 HA ASN 15 HA ASN 15 15.556 9.517 -0.674 478 HB2 ASN 15 2HB ASN 15 18.145 7.989 -0.118 479 HB3 ASN 15 3HB ASN 15 17.919 9.709 0.201 480 HD21 ASN 15 1HD2 ASN 15 15.387 9.948 1.390 481 HD22 ASN 15 2HD2 ASN 15 15.502 8.930 2.847 482 H LYS 16 HN LYS 16 15.287 8.789 -3.347 483 HA LYS 16 HA LYS 16 17.711 9.778 -4.777 484 HB2 LYS 16 2HB LYS 16 14.984 8.783 -5.743 485 HB3 LYS 16 3HB LYS 16 16.239 9.405 -6.822 486 HG2 LYS 16 2HG LYS 16 17.823 7.684 -6.011 487 HG3 LYS 16 3HG LYS 16 16.558 6.969 -5.015 488 HD2 LYS 16 2HD LYS 16 16.394 7.309 -8.043 489 HD3 LYS 16 3HD LYS 16 16.972 5.847 -7.252 490 HE2 LYS 16 2HE LYS 16 14.183 6.996 -6.809 491 HE3 LYS 16 3HE LYS 16 14.575 5.771 -8.028 492 HZ1 LYS 16 3HZ LYS 16 14.794 5.541 -5.116 493 HZ2 LYS 16 1HZ LYS 16 15.442 4.412 -6.147 494 HZ3 LYS 16 2HZ LYS 16 13.811 4.689 -6.098 495 H ARG 17 HN ARG 17 16.941 11.391 -6.680 496 HA ARG 17 HA ARG 17 15.666 13.648 -5.183 497 HE ARG 17 HE ARG 17 18.628 11.610 -3.544 498 HB2 ARG 17 2HB ARG 17 17.882 13.605 -7.298 499 HB3 ARG 17 3HB ARG 17 17.016 15.060 -6.824 500 HG2 ARG 17 2HG ARG 17 18.929 15.167 -5.556 501 HG3 ARG 17 3HG ARG 17 17.704 14.629 -4.423 502 HD2 ARG 17 2HD ARG 17 19.112 12.360 -5.694 503 HD3 ARG 17 3HD ARG 17 20.247 13.488 -4.971 504 HH11 ARG 17 1HH1 ARG 17 19.774 14.919 -3.108 505 HH12 ARG 17 2HH1 ARG 17 19.731 14.740 -1.364 506 HH21 ARG 17 1HH2 ARG 17 18.655 11.474 -1.469 507 HH22 ARG 17 2HH2 ARG 17 19.083 12.850 -0.435 508 H TYR 18 HN TYR 18 13.905 14.545 -5.935 509 HA TYR 18 HA TYR 18 12.997 13.903 -8.707 510 HD1 TYR 18 2HD TYR 18 12.412 12.428 -5.114 511 HD2 TYR 18 1HD TYR 18 10.317 12.413 -8.885 512 HE1 TYR 18 2HE TYR 18 12.319 9.948 -5.103 513 HE2 TYR 18 1HE TYR 18 10.316 9.961 -8.892 514 HH TYR 18 HH TYR 18 11.518 8.088 -6.181 515 HB2 TYR 18 2HB TYR 18 11.525 14.546 -6.132 516 HB3 TYR 18 3HB TYR 18 10.740 14.525 -7.705 517 H PHE 19 HN PHE 19 11.627 15.560 -9.772 518 HA PHE 19 HA PHE 19 12.696 18.308 -9.205 519 HD1 PHE 19 1HD PHE 19 14.757 19.186 -10.991 520 HD2 PHE 19 2HD PHE 19 13.426 15.173 -11.854 521 HE1 PHE 19 1HE PHE 19 17.117 18.442 -11.198 522 HE2 PHE 19 2HE PHE 19 15.784 14.436 -12.050 523 HZ PHE 19 HZ PHE 19 17.631 16.067 -11.728 524 HB2 PHE 19 2HB PHE 19 11.836 17.038 -11.847 525 HB3 PHE 19 3HB PHE 19 12.385 18.699 -11.639 526 H LYS 20 HN LYS 20 9.842 16.456 -10.391 527 HA LYS 20 HA LYS 20 8.099 18.835 -10.074 528 HB2 LYS 20 2HB LYS 20 7.228 16.006 -10.674 529 HB3 LYS 20 3HB LYS 20 6.347 17.461 -10.976 530 HG2 LYS 20 2HG LYS 20 8.853 16.558 -12.463 531 HG3 LYS 20 3HG LYS 20 7.195 16.499 -13.057 532 HD2 LYS 20 2HD LYS 20 7.041 18.973 -12.926 533 HD3 LYS 20 3HD LYS 20 8.719 19.060 -12.368 534 HE2 LYS 20 2HE LYS 20 7.837 17.861 -15.028 535 HE3 LYS 20 3HE LYS 20 8.413 19.519 -14.815 536 HZ1 LYS 20 3HZ LYS 20 10.173 18.064 -15.532 537 HZ2 LYS 20 1HZ LYS 20 9.981 17.098 -14.213 538 HZ3 LYS 20 2HZ LYS 20 10.500 18.651 -14.030 539 H LEU 21 HN LEU 21 7.195 19.335 -8.180 540 HA LEU 21 HA LEU 21 7.464 17.859 -5.778 541 HG LEU 21 HG LEU 21 4.336 18.893 -4.830 542 HB2 LEU 21 2HB LEU 21 6.870 20.207 -5.804 543 HB3 LEU 21 3HB LEU 21 5.393 19.893 -6.685 544 HD11 LEU 21 1HD1 LEU 21 5.261 18.606 -2.611 545 HD12 LEU 21 2HD1 LEU 21 6.840 19.205 -3.131 546 HD13 LEU 21 3HD1 LEU 21 6.227 17.658 -3.737 547 HD21 LEU 21 3HD2 LEU 21 4.372 21.350 -4.900 548 HD22 LEU 21 1HD2 LEU 21 5.900 21.387 -3.989 549 HD23 LEU 21 2HD2 LEU 21 4.416 20.825 -3.210 550 H SER 22 HN SER 22 4.800 17.895 -8.205 551 HA SER 22 HA SER 22 3.061 16.101 -6.789 552 HG SER 22 HG SER 22 2.780 17.299 -10.658 553 HB2 SER 22 2HB SER 22 1.954 15.884 -9.058 554 HB3 SER 22 3HB SER 22 2.139 17.539 -8.447 555 H HIS 23 HN HIS 23 5.624 15.529 -9.252 556 HA HIS 23 HA HIS 23 4.872 12.725 -9.649 557 HD1 HIS 23 1HD HIS 23 8.437 13.091 -12.752 558 HD2 HIS 23 2HD HIS 23 8.863 14.489 -8.829 559 HE1 HIS 23 1HE HIS 23 10.873 13.815 -12.491 560 HB2 HIS 23 2HB HIS 23 6.460 12.595 -11.163 561 HB3 HIS 23 3HB HIS 23 6.149 14.266 -11.299 562 H LEU 24 HN LEU 24 6.878 14.573 -7.499 563 HA LEU 24 HA LEU 24 8.175 12.247 -6.245 564 HG LEU 24 HG LEU 24 10.163 14.356 -4.185 565 HB2 LEU 24 2HB LEU 24 9.187 14.483 -6.193 566 HB3 LEU 24 3HB LEU 24 7.860 15.112 -5.288 567 HD11 LEU 24 1HD1 LEU 24 9.054 14.233 -2.013 568 HD12 LEU 24 2HD1 LEU 24 7.485 13.994 -2.805 569 HD13 LEU 24 3HD1 LEU 24 8.373 15.519 -3.022 570 HD21 LEU 24 3HD2 LEU 24 10.362 12.277 -3.246 571 HD22 LEU 24 1HD2 LEU 24 9.647 11.832 -4.796 572 HD23 LEU 24 2HD2 LEU 24 8.653 11.901 -3.331 573 H GLN 25 HN GLN 25 5.365 14.397 -5.568 574 HA GLN 25 HA GLN 25 4.544 13.227 -3.124 575 HB2 GLN 25 2HB GLN 25 3.634 15.312 -4.063 576 HB3 GLN 25 3HB GLN 25 2.874 14.418 -5.376 577 HG2 GLN 25 2HG GLN 25 1.332 13.338 -3.801 578 HG3 GLN 25 3HG GLN 25 2.115 14.184 -2.454 579 HE21 GLN 25 1HE2 GLN 25 -0.296 15.053 -2.172 580 HE22 GLN 25 2HE2 GLN 25 -0.571 16.490 -3.185 581 H MET 26 HN MET 26 3.688 12.325 -6.523 582 HA MET 26 HA MET 26 2.065 10.053 -5.776 583 HB2 MET 26 2HB MET 26 2.367 11.355 -8.088 584 HB3 MET 26 3HB MET 26 3.586 10.113 -8.394 585 HG2 MET 26 2HG MET 26 0.678 9.646 -7.577 586 HG3 MET 26 3HG MET 26 1.269 9.572 -9.227 587 HE1 MET 26 3HE MET 26 0.207 5.817 -7.845 588 HE2 MET 26 1HE MET 26 -0.405 7.331 -7.158 589 HE3 MET 26 2HE MET 26 -0.346 7.112 -8.922 590 H HIS 27 HN HIS 27 5.572 10.478 -6.524 591 HA HIS 27 HA HIS 27 6.322 7.749 -6.509 592 HD1 HIS 27 1HD HIS 27 8.644 6.558 -6.562 593 HD2 HIS 27 2HD HIS 27 9.722 9.693 -3.953 594 HE1 HIS 27 1HE HIS 27 10.479 5.657 -4.985 595 HB2 HIS 27 2HB HIS 27 7.954 9.422 -7.172 596 HB3 HIS 27 3HB HIS 27 7.864 10.244 -5.617 597 H SER 28 HN SER 28 5.950 10.059 -3.770 598 HA SER 28 HA SER 28 6.823 8.446 -1.711 599 HG SER 28 HG SER 28 3.800 10.601 -2.295 600 HB2 SER 28 2HB SER 28 5.698 9.925 -0.255 601 HB3 SER 28 3HB SER 28 5.923 10.922 -1.716 602 H ARG 29 HN ARG 29 3.677 8.276 -3.417 603 HA ARG 29 HA ARG 29 2.228 6.676 -1.539 604 HE ARG 29 HE ARG 29 2.010 9.297 -1.563 605 HB2 ARG 29 2HB ARG 29 2.049 6.566 -4.581 606 HB3 ARG 29 3HB ARG 29 0.859 6.002 -3.438 607 HG2 ARG 29 2HG ARG 29 1.601 8.907 -3.921 608 HG3 ARG 29 3HG ARG 29 0.147 8.066 -4.433 609 HD2 ARG 29 2HD ARG 29 -0.758 8.977 -2.599 610 HD3 ARG 29 3HD ARG 29 -0.030 7.606 -1.752 611 HH11 ARG 29 2HH2 ARG 29 -1.367 10.341 -1.247 612 HH12 ARG 29 1HH2 ARG 29 -0.872 11.787 -0.377 613 HH21 ARG 29 1HH1 ARG 29 2.495 11.176 -0.662 614 HH22 ARG 29 2HH1 ARG 29 1.205 12.314 -0.254 615 H LYS 30 HN LYS 30 4.656 5.827 -4.031 616 HA LYS 30 HA LYS 30 4.157 2.991 -4.050 617 HB2 LYS 30 2HB LYS 30 5.501 4.248 -5.759 618 HB3 LYS 30 3HB LYS 30 6.791 4.458 -4.560 619 HG2 LYS 30 2HG LYS 30 7.065 2.014 -4.381 620 HG3 LYS 30 3HG LYS 30 5.713 1.761 -5.499 621 HD2 LYS 30 2HD LYS 30 6.992 2.910 -7.284 622 HD3 LYS 30 3HD LYS 30 8.350 3.151 -6.170 623 HE2 LYS 30 2HE LYS 30 7.200 0.423 -6.930 624 HE3 LYS 30 3HE LYS 30 8.579 1.182 -7.743 625 HZ1 LYS 30 3HZ LYS 30 9.356 -0.317 -6.093 626 HZ2 LYS 30 1HZ LYS 30 8.461 0.370 -4.908 627 HZ3 LYS 30 2HZ LYS 30 9.707 1.209 -5.580 628 H HIS 31 HN HIS 31 6.053 5.111 -1.897 629 HA HIS 31 HA HIS 31 7.418 2.817 -0.671 630 HD1 HIS 31 1HD HIS 31 9.417 2.595 -1.360 631 HD2 HIS 31 2HD HIS 31 9.629 6.818 -1.476 632 HE1 HIS 31 1HE HIS 31 11.502 3.185 -2.630 633 HB2 HIS 31 2HB HIS 31 7.468 5.818 -0.191 634 HB3 HIS 31 3HB HIS 31 8.284 4.670 0.879 635 H THR 32 HN THR 32 4.709 5.060 0.238 636 HA THR 32 HA THR 32 4.072 4.159 2.702 637 HB THR 32 HB THR 32 1.742 4.446 2.286 638 HG1 THR 32 1HG THR 32 2.246 4.201 -0.520 639 HG21 THR 32 3HG2 THR 32 3.137 6.406 0.455 640 HG22 THR 32 1HG2 THR 32 3.029 6.528 2.218 641 HG23 THR 32 2HG2 THR 32 1.557 6.597 1.230 642 H GLY 33 HN GLY 33 3.946 2.128 -0.199 643 HA2 GLY 33 2HA GLY 33 2.649 -0.101 1.286 644 HA3 GLY 33 3HA GLY 33 3.042 -0.076 -0.440 645 H GLU 34 HN GLU 34 5.642 1.113 1.387 646 HA GLU 34 HA GLU 34 6.957 -1.568 1.545 647 HB2 GLU 34 2HB GLU 34 8.145 0.999 0.411 648 HB3 GLU 34 3HB GLU 34 9.020 -0.528 0.622 649 HG2 GLU 34 2HG GLU 34 7.585 -1.686 -0.948 650 HG3 GLU 34 3HG GLU 34 6.567 -0.264 -1.164 651 H LYS 35 HN LYS 35 5.716 0.273 3.623 652 HA LYS 35 HA LYS 35 7.949 1.614 5.001 653 HB2 LYS 35 2HB LYS 35 5.499 2.377 4.978 654 HB3 LYS 35 3HB LYS 35 5.151 1.040 6.055 655 HG2 LYS 35 2HG LYS 35 6.966 3.441 6.588 656 HG3 LYS 35 3HG LYS 35 5.370 3.127 7.269 657 HD2 LYS 35 2HD LYS 35 6.476 0.975 8.280 658 HD3 LYS 35 3HD LYS 35 8.001 1.796 7.945 659 HE2 LYS 35 2HE LYS 35 7.397 3.664 9.344 660 HE3 LYS 35 3HE LYS 35 5.763 3.009 9.588 661 HZ1 LYS 35 3HZ LYS 35 6.692 1.143 10.701 662 HZ2 LYS 35 1HZ LYS 35 7.306 2.498 11.414 663 HZ3 LYS 35 2HZ LYS 35 8.231 1.597 10.378 664 HA PRO 36 HA PRO 36 9.074 -2.362 6.754 665 HB2 PRO 36 2HB PRO 36 11.205 -1.496 8.303 666 HB3 PRO 36 3HB PRO 36 11.268 -1.703 6.533 667 HG2 PRO 36 2HG PRO 36 10.787 0.859 8.080 668 HG3 PRO 36 3HG PRO 36 11.932 0.574 6.728 669 HD2 PRO 36 2HD PRO 36 9.516 1.690 6.311 670 HD3 PRO 36 3HD PRO 36 10.188 0.507 5.144 671 H TYR 37 HN TYR 37 7.571 -3.126 8.150 672 HA TYR 37 HA TYR 37 7.598 -1.988 10.952 673 HD1 TYR 37 1HD TYR 37 5.305 -0.966 12.276 674 HD2 TYR 37 2HD TYR 37 4.724 -1.360 8.025 675 HE1 TYR 37 1HE TYR 37 4.177 1.244 12.239 676 HE2 TYR 37 2HE TYR 37 3.594 0.884 7.987 677 HH TYR 37 HH TYR 37 3.132 2.846 10.916 678 HB2 TYR 37 2HB TYR 37 5.362 -3.263 9.331 679 HB3 TYR 37 3HB TYR 37 5.320 -3.204 11.062 680 H GLN 38 HN GLN 38 7.062 -3.684 12.645 681 HA GLN 38 HA GLN 38 7.731 -6.485 11.848 682 HB2 GLN 38 2HB GLN 38 9.797 -5.669 12.831 683 HB3 GLN 38 3HB GLN 38 8.946 -4.977 14.216 684 HG2 GLN 38 2HG GLN 38 8.371 -7.161 15.084 685 HG3 GLN 38 3HG GLN 38 8.904 -7.960 13.596 686 HE21 GLN 38 1HE2 GLN 38 9.805 -8.953 16.106 687 HE22 GLN 38 2HE2 GLN 38 11.514 -8.565 16.110 688 H CYS 39 HN CYS 39 6.710 -8.080 13.100 689 HA CYS 39 HA CYS 39 4.113 -7.659 13.921 690 HB2 CYS 39 2HB CYS 39 5.165 -9.882 13.587 691 HB3 CYS 39 3HB CYS 39 6.053 -9.671 15.107 692 H ASP 40 HN ASP 40 3.043 -6.796 15.626 693 HA ASP 40 HA ASP 40 4.509 -5.363 17.683 694 HB2 ASP 40 2HB ASP 40 1.527 -5.960 17.460 695 HB3 ASP 40 3HB ASP 40 2.270 -4.781 18.531 696 H PHE 41 HN PHE 41 3.496 -8.629 17.343 697 HA PHE 41 HA PHE 41 2.832 -9.326 20.036 698 HD1 PHE 41 1HD PHE 41 1.176 -11.289 20.073 699 HD2 PHE 41 2HD PHE 41 4.907 -13.084 18.884 700 HE1 PHE 41 1HE PHE 41 0.535 -13.396 21.223 701 HE2 PHE 41 2HE PHE 41 4.282 -15.172 20.041 702 HZ PHE 41 HZ PHE 41 2.088 -15.341 21.214 703 HB2 PHE 41 2HB PHE 41 2.587 -10.692 17.917 704 HB3 PHE 41 3HB PHE 41 4.309 -11.021 17.997 705 H LYS 42 HN LYS 42 5.889 -8.539 18.473 706 HA LYS 42 HA LYS 42 7.943 -8.017 19.400 707 HB2 LYS 42 2HB LYS 42 6.178 -7.564 21.516 708 HB3 LYS 42 3HB LYS 42 7.328 -8.675 22.235 709 HG2 LYS 42 2HG LYS 42 7.927 -6.325 22.590 710 HG3 LYS 42 3HG LYS 42 9.178 -7.165 21.678 711 HD2 LYS 42 2HD LYS 42 8.643 -4.806 20.913 712 HD3 LYS 42 3HD LYS 42 8.619 -6.026 19.650 713 HE2 LYS 42 2HE LYS 42 6.107 -6.150 19.879 714 HE3 LYS 42 3HE LYS 42 6.186 -4.820 21.040 715 HZ1 LYS 42 3HZ LYS 42 7.067 -4.743 18.225 716 HZ2 LYS 42 1HZ LYS 42 7.213 -3.488 19.286 717 HZ3 LYS 42 2HZ LYS 42 5.722 -4.025 18.840 718 H ASP 43 HN ASP 43 6.498 -10.924 20.946 719 HA ASP 43 HA ASP 43 9.034 -12.352 21.163 720 HB2 ASP 43 2HB ASP 43 7.087 -12.949 22.536 721 HB3 ASP 43 3HB ASP 43 6.136 -13.294 21.099 722 H CYS 44 HN CYS 44 6.866 -11.542 18.583 723 HA CYS 44 HA CYS 44 7.771 -13.696 16.792 724 HB2 CYS 44 2HB CYS 44 5.453 -12.933 16.665 725 HB3 CYS 44 3HB CYS 44 5.960 -11.278 16.404 726 H GLU 45 HN GLU 45 8.565 -12.954 14.556 727 HA GLU 45 HA GLU 45 10.400 -10.627 14.734 728 HB2 GLU 45 2HB GLU 45 11.484 -12.981 15.400 729 HB3 GLU 45 3HB GLU 45 11.493 -13.228 13.663 730 HG2 GLU 45 2HG GLU 45 13.600 -12.331 14.046 731 HG3 GLU 45 3HG GLU 45 12.719 -10.880 13.596 732 H ARG 46 HN ARG 46 7.850 -11.482 13.244 733 HA ARG 46 HA ARG 46 8.816 -11.685 10.441 734 HE ARG 46 HE ARG 46 5.373 -13.619 12.791 735 HB2 ARG 46 2HB ARG 46 6.071 -11.799 11.760 736 HB3 ARG 46 3HB ARG 46 6.260 -11.617 10.014 737 HG2 ARG 46 2HG ARG 46 7.439 -13.658 9.754 738 HG3 ARG 46 3HG ARG 46 7.669 -13.870 11.493 739 HD2 ARG 46 2HD ARG 46 4.915 -13.832 10.213 740 HD3 ARG 46 3HD ARG 46 5.883 -15.308 10.384 741 HH11 ARG 46 1HH1 ARG 46 4.752 -16.751 11.315 742 HH12 ARG 46 2HH1 ARG 46 4.464 -17.475 12.888 743 HH21 ARG 46 1HH2 ARG 46 4.971 -14.501 14.579 744 HH22 ARG 46 2HH2 ARG 46 4.572 -16.221 14.751 745 H ARG 47 HN ARG 47 8.868 -10.034 9.052 746 HA ARG 47 HA ARG 47 8.054 -7.372 10.109 747 HE ARG 47 HE ARG 47 11.636 -7.237 12.690 748 HB2 ARG 47 2HB ARG 47 10.250 -8.256 8.198 749 HB3 ARG 47 3HB ARG 47 9.671 -6.597 8.221 750 HG2 ARG 47 2HG ARG 47 11.656 -6.739 9.559 751 HG3 ARG 47 3HG ARG 47 10.279 -6.340 10.581 752 HD2 ARG 47 2HD ARG 47 10.191 -8.664 11.398 753 HD3 ARG 47 3HD ARG 47 11.529 -9.110 10.334 754 HH11 ARG 47 1HH2 ARG 47 13.414 -9.544 10.704 755 HH12 ARG 47 2HH2 ARG 47 14.792 -9.463 11.785 756 HH21 ARG 47 1HH1 ARG 47 13.214 -7.331 13.992 757 HH22 ARG 47 2HH1 ARG 47 14.698 -8.219 13.645 758 H PHE 48 HN PHE 48 7.127 -5.855 8.666 759 HA PHE 48 HA PHE 48 5.767 -7.059 6.288 760 HD1 PHE 48 1HD PHE 48 3.387 -8.407 6.639 761 HD2 PHE 48 2HD PHE 48 4.804 -6.789 10.378 762 HE1 PHE 48 1HE PHE 48 3.197 -10.636 7.682 763 HE2 PHE 48 2HE PHE 48 4.618 -9.037 11.419 764 HZ PHE 48 HZ PHE 48 3.917 -10.975 10.033 765 HB2 PHE 48 2HB PHE 48 4.456 -5.329 8.439 766 HB3 PHE 48 3HB PHE 48 3.687 -5.944 6.976 767 H SER 49 HN SER 49 4.799 -5.346 4.853 768 HA SER 49 HA SER 49 6.739 -3.065 4.766 769 HG SER 49 HG SER 49 4.842 -3.049 1.565 770 HB2 SER 49 2HB SER 49 6.753 -3.288 2.479 771 HB3 SER 49 3HB SER 49 6.383 -4.936 2.910 772 H ARG 50 HN ARG 50 3.746 -3.481 5.977 773 HA ARG 50 HA ARG 50 3.097 -0.665 5.692 774 HE ARG 50 HE ARG 50 -1.177 -2.084 3.058 775 HB2 ARG 50 2HB ARG 50 2.177 -1.733 3.569 776 HB3 ARG 50 3HB ARG 50 1.054 -2.637 4.581 777 HG2 ARG 50 2HG ARG 50 -0.136 -0.653 5.174 778 HG3 ARG 50 3HG ARG 50 1.209 0.403 4.706 779 HD2 ARG 50 2HD ARG 50 -0.717 0.404 3.093 780 HD3 ARG 50 3HD ARG 50 0.850 0.049 2.401 781 HH11 ARG 50 2HH2 ARG 50 0.976 -0.751 0.670 782 HH12 ARG 50 1HH2 ARG 50 0.790 -2.171 -0.335 783 HH21 ARG 50 1HH1 ARG 50 -1.324 -3.787 1.670 784 HH22 ARG 50 2HH1 ARG 50 -0.388 -3.770 0.221 785 H SER 51 HN SER 51 1.401 0.014 7.133 786 HA SER 51 HA SER 51 1.291 -1.408 9.602 787 HG SER 51 HG SER 51 -1.670 0.911 8.695 788 HB2 SER 51 2HB SER 51 -0.403 0.262 10.243 789 HB3 SER 51 3HB SER 51 0.956 1.032 9.413 790 H ASP 52 HN ASP 52 -0.819 -1.426 6.736 791 HA ASP 52 HA ASP 52 -3.067 -2.724 7.932 792 HB2 ASP 52 2HB ASP 52 -3.061 -1.527 5.761 793 HB3 ASP 52 3HB ASP 52 -2.044 -2.770 5.063 794 H GLN 53 HN GLN 53 -0.136 -3.957 6.269 795 HA GLN 53 HA GLN 53 -0.890 -6.738 6.326 796 HB2 GLN 53 2HB GLN 53 1.781 -5.338 6.212 797 HB3 GLN 53 3HB GLN 53 1.587 -7.085 6.006 798 HG2 GLN 53 2HG GLN 53 0.548 -6.837 3.906 799 HG3 GLN 53 3HG GLN 53 0.169 -5.123 4.180 800 HE21 GLN 53 1HE2 GLN 53 1.394 -4.114 2.464 801 HE22 GLN 53 2HE2 GLN 53 3.159 -4.340 2.464 802 H LEU 54 HN LEU 54 1.058 -4.628 8.478 803 HA LEU 54 HA LEU 54 1.805 -6.666 10.337 804 HG LEU 54 HG LEU 54 1.313 -4.293 12.822 805 HB2 LEU 54 2HB LEU 54 2.962 -4.570 10.294 806 HB3 LEU 54 3HB LEU 54 1.485 -3.651 10.521 807 HD11 LEU 54 1HD1 LEU 54 2.199 -6.611 12.707 808 HD12 LEU 54 2HD1 LEU 54 3.063 -5.642 13.909 809 HD13 LEU 54 3HD1 LEU 54 3.805 -5.976 12.334 810 HD21 LEU 54 3HD2 LEU 54 4.243 -3.692 12.713 811 HD22 LEU 54 1HD2 LEU 54 2.963 -2.923 13.609 812 HD23 LEU 54 2HD2 LEU 54 3.129 -2.534 11.894 813 H LYS 55 HN LYS 55 -0.958 -4.304 10.384 814 HA LYS 55 HA LYS 55 -2.122 -5.259 12.837 815 HB2 LYS 55 2HB LYS 55 -3.254 -3.765 10.434 816 HB3 LYS 55 3HB LYS 55 -4.246 -4.195 11.835 817 HG2 LYS 55 2HG LYS 55 -2.821 -2.936 13.352 818 HG3 LYS 55 3HG LYS 55 -1.652 -2.612 12.078 819 HD2 LYS 55 2HD LYS 55 -2.934 -0.623 12.391 820 HD3 LYS 55 3HD LYS 55 -3.407 -1.314 10.831 821 HE2 LYS 55 2HE LYS 55 -5.424 -2.314 11.909 822 HE3 LYS 55 3HE LYS 55 -4.923 -1.633 13.467 823 HZ1 LYS 55 3HZ LYS 55 -6.552 -0.257 12.373 824 HZ2 LYS 55 1HZ LYS 55 -5.587 -0.087 11.052 825 HZ3 LYS 55 2HZ LYS 55 -5.126 0.561 12.495 826 H ARG 56 HN ARG 56 -2.647 -6.175 9.395 827 HA ARG 56 HA ARG 56 -4.658 -8.162 9.820 828 HE ARG 56 HE ARG 56 -4.107 -8.788 4.919 829 HB2 ARG 56 2HB ARG 56 -4.051 -7.428 7.575 830 HB3 ARG 56 3HB ARG 56 -2.395 -7.929 7.815 831 HG2 ARG 56 2HG ARG 56 -3.622 -10.355 8.125 832 HG3 ARG 56 3HG ARG 56 -4.781 -9.570 7.065 833 HD2 ARG 56 2HD ARG 56 -1.780 -9.559 6.500 834 HD3 ARG 56 3HD ARG 56 -2.786 -10.939 6.089 835 HH11 ARG 56 1HH2 ARG 56 -0.855 -10.065 4.637 836 HH12 ARG 56 2HH2 ARG 56 -0.777 -9.779 2.908 837 HH21 ARG 56 2HH1 ARG 56 -3.958 -8.452 2.662 838 HH22 ARG 56 1HH1 ARG 56 -2.530 -9.053 1.842 839 H HIS 57 HN HIS 57 -1.065 -8.381 9.854 840 HA HIS 57 HA HIS 57 -0.895 -11.149 10.335 841 HD1 HIS 57 1HD HIS 57 1.182 -12.661 10.237 842 HD2 HIS 57 2HD HIS 57 2.600 -9.847 13.013 843 HE1 HIS 57 1HE HIS 57 2.662 -13.947 11.915 844 HB2 HIS 57 2HB HIS 57 1.029 -9.797 9.667 845 HB3 HIS 57 3HB HIS 57 1.011 -8.912 11.194 846 H GLN 58 HN GLN 58 -1.243 -8.436 12.672 847 HA GLN 58 HA GLN 58 -0.877 -9.862 15.075 848 HB2 GLN 58 2HB GLN 58 -2.820 -7.569 14.475 849 HB3 GLN 58 3HB GLN 58 -2.489 -8.218 16.065 850 HG2 GLN 58 2HG GLN 58 -0.609 -6.649 14.311 851 HG3 GLN 58 3HG GLN 58 -1.096 -6.351 15.967 852 HE21 GLN 58 1HE2 GLN 58 1.279 -7.819 13.944 853 HE22 GLN 58 2HE2 GLN 58 2.148 -8.710 15.218 854 H ARG 59 HN ARG 59 -3.728 -9.805 12.887 855 HA ARG 59 HA ARG 59 -5.629 -11.007 14.655 856 HE ARG 59 HE ARG 59 -7.763 -10.334 9.870 857 HB2 ARG 59 2HB ARG 59 -5.436 -11.304 11.614 858 HB3 ARG 59 3HB ARG 59 -6.807 -11.714 12.638 859 HG2 ARG 59 2HG ARG 59 -6.627 -9.275 13.566 860 HG3 ARG 59 3HG ARG 59 -5.677 -8.936 12.122 861 HD2 ARG 59 2HD ARG 59 -8.478 -10.140 12.088 862 HD3 ARG 59 3HD ARG 59 -8.171 -8.406 12.052 863 HH11 ARG 59 1HH1 ARG 59 -7.106 -7.011 10.864 864 HH12 ARG 59 2HH1 ARG 59 -6.897 -6.513 9.197 865 HH21 ARG 59 1HH2 ARG 59 -7.532 -9.668 7.940 866 HH22 ARG 59 2HH2 ARG 59 -7.089 -7.998 7.532 867 H ARG 60 HN ARG 60 -2.957 -12.416 12.765 868 HA ARG 60 HA ARG 60 -3.722 -15.206 13.056 869 HE ARG 60 HE ARG 60 0.552 -18.008 12.335 870 HB2 ARG 60 2HB ARG 60 -2.037 -14.404 11.391 871 HB3 ARG 60 3HB ARG 60 -0.964 -13.944 12.720 872 HG2 ARG 60 2HG ARG 60 -0.851 -16.334 13.451 873 HG3 ARG 60 3HG ARG 60 -1.760 -16.766 11.999 874 HD2 ARG 60 2HD ARG 60 0.082 -15.668 10.641 875 HD3 ARG 60 3HD ARG 60 0.928 -15.324 12.152 876 HH11 ARG 60 1HH2 ARG 60 2.038 -16.135 9.698 877 HH12 ARG 60 2HH2 ARG 60 3.106 -17.460 9.314 878 HH21 ARG 60 2HH1 ARG 60 1.942 -19.593 11.727 879 HH22 ARG 60 1HH1 ARG 60 3.072 -19.330 10.422 880 H HIS 61 HN HIS 61 -1.873 -12.895 15.091 881 HA HIS 61 HA HIS 61 -0.976 -15.028 16.928 882 HD1 HIS 61 1HD HIS 61 1.433 -15.135 17.901 883 HD2 HIS 61 2HD HIS 61 1.632 -11.782 15.363 884 HE1 HIS 61 1HE HIS 61 3.770 -15.137 16.860 885 HB2 HIS 61 2HB HIS 61 -0.587 -12.027 16.731 886 HB3 HIS 61 3HB HIS 61 -0.268 -12.848 18.250 887 H THR 62 HN THR 62 -3.520 -12.581 16.733 888 HA THR 62 HA THR 62 -4.254 -12.851 19.560 889 HB THR 62 HB THR 62 -6.235 -11.413 18.826 890 HG1 THR 62 1HG THR 62 -4.675 -11.092 16.514 891 HG21 THR 62 3HG2 THR 62 -3.436 -10.366 18.151 892 HG22 THR 62 1HG2 THR 62 -4.195 -10.371 19.753 893 HG23 THR 62 2HG2 THR 62 -4.881 -9.377 18.457 894 H GLY 63 HN GLY 63 -5.564 -13.955 16.356 895 HA2 GLY 63 2HA GLY 63 -6.490 -16.207 16.240 896 HA3 GLY 63 3HA GLY 63 -7.097 -16.024 17.895 897 H VAL 64 HN VAL 64 -7.647 -13.073 16.455 898 HA VAL 64 HA VAL 64 -10.501 -13.544 16.411 899 HB VAL 64 HB VAL 64 -10.679 -11.180 15.845 900 HG11 VAL 64 1HG1 VAL 64 -10.231 -11.854 18.193 901 HG12 VAL 64 2HG1 VAL 64 -8.496 -11.572 17.927 902 HG13 VAL 64 3HG1 VAL 64 -9.642 -10.227 17.815 903 HG21 VAL 64 3HG2 VAL 64 -7.667 -11.156 15.492 904 HG22 VAL 64 1HG2 VAL 64 -8.888 -10.796 14.262 905 HG23 VAL 64 2HG2 VAL 64 -8.685 -9.709 15.639 906 H LYS 65 HN LYS 65 -11.968 -13.542 14.739 907 HA LYS 65 HA LYS 65 -10.936 -13.338 11.943 908 HB2 LYS 65 2HB LYS 65 -12.772 -15.517 13.035 909 HB3 LYS 65 3HB LYS 65 -12.467 -15.232 11.316 910 HG2 LYS 65 2HG LYS 65 -10.056 -15.692 11.668 911 HG3 LYS 65 3HG LYS 65 -10.373 -15.990 13.386 912 HD2 LYS 65 2HD LYS 65 -11.926 -17.862 12.729 913 HD3 LYS 65 3HD LYS 65 -11.486 -17.583 11.036 914 HE2 LYS 65 2HE LYS 65 -10.142 -19.409 11.857 915 HE3 LYS 65 3HE LYS 65 -9.086 -18.005 11.628 916 HZ1 LYS 65 3HZ LYS 65 -8.647 -19.085 13.719 917 HZ2 LYS 65 1HZ LYS 65 -10.212 -18.918 14.200 918 HZ3 LYS 65 2HZ LYS 65 -9.268 -17.589 14.011 919 HA PRO 66 HA PRO 66 -14.509 -10.646 12.954 920 HB2 PRO 66 2HB PRO 66 -13.709 -8.379 11.608 921 HB3 PRO 66 3HB PRO 66 -13.035 -8.882 13.182 922 HG2 PRO 66 2HG PRO 66 -11.877 -9.362 10.428 923 HG3 PRO 66 3HG PRO 66 -11.045 -8.718 11.879 924 HD2 PRO 66 2HD PRO 66 -10.888 -11.331 11.168 925 HD3 PRO 66 3HD PRO 66 -10.964 -10.846 12.890 926 H PHE 67 HN PHE 67 -13.370 -11.768 9.826 927 HA PHE 67 HA PHE 67 -15.685 -10.523 8.392 928 HD1 PHE 67 2HD PHE 67 -14.672 -8.946 6.319 929 HD2 PHE 67 1HD PHE 67 -11.519 -11.158 8.230 930 HE1 PHE 67 2HE PHE 67 -13.249 -6.911 6.328 931 HE2 PHE 67 1HE PHE 67 -10.072 -9.132 8.199 932 HZ PHE 67 HZ PHE 67 -10.942 -7.006 7.244 933 HB2 PHE 67 2HB PHE 67 -13.437 -12.320 7.355 934 HB3 PHE 67 3HB PHE 67 -14.598 -11.465 6.364 935 H GLN 68 HN GLN 68 -17.607 -11.573 8.825 936 HA GLN 68 HA GLN 68 -17.568 -14.582 8.914 937 HB2 GLN 68 2HB GLN 68 -18.345 -13.302 10.953 938 HB3 GLN 68 3HB GLN 68 -19.709 -12.691 10.012 939 HG2 GLN 68 2HG GLN 68 -20.623 -14.909 9.744 940 HG3 GLN 68 3HG GLN 68 -19.114 -15.661 10.277 941 HE21 GLN 68 1HE2 GLN 68 -20.526 -16.886 11.773 942 HE22 GLN 68 2HE2 GLN 68 -20.996 -16.061 13.288 943 H CYS 69 HN CYS 69 -18.697 -15.740 7.474 944 HA CYS 69 HA CYS 69 -19.792 -14.511 5.133 945 HB2 CYS 69 2HB CYS 69 -18.897 -16.821 5.150 946 HB3 CYS 69 3HB CYS 69 -20.179 -17.333 6.247 947 H LYS 70 HN LYS 70 -21.934 -14.335 4.425 948 HA LYS 70 HA LYS 70 -23.937 -14.015 6.616 949 HB2 LYS 70 2HB LYS 70 -24.203 -13.205 3.691 950 HB3 LYS 70 3HB LYS 70 -25.204 -12.683 5.050 951 HG2 LYS 70 2HG LYS 70 -22.287 -11.963 4.517 952 HG3 LYS 70 3HG LYS 70 -23.678 -10.899 4.395 953 HD2 LYS 70 2HD LYS 70 -23.981 -10.855 6.798 954 HD3 LYS 70 3HD LYS 70 -22.839 -12.183 7.038 955 HE2 LYS 70 2HE LYS 70 -21.745 -10.153 7.654 956 HE3 LYS 70 3HE LYS 70 -20.981 -10.833 6.217 957 HZ1 LYS 70 3HZ LYS 70 -22.224 -9.248 4.893 958 HZ2 LYS 70 1HZ LYS 70 -21.306 -8.465 6.013 959 HZ3 LYS 70 2HZ LYS 70 -22.932 -8.615 6.240 960 H THR 71 HN THR 71 -22.898 -16.386 4.518 961 HA THR 71 HA THR 71 -25.641 -17.476 4.025 962 HB THR 71 HB THR 71 -23.502 -18.980 2.718 963 HG1 THR 71 1HG THR 71 -22.355 -17.044 2.709 964 HG21 THR 71 3HG2 THR 71 -25.859 -18.984 2.044 965 HG22 THR 71 1HG2 THR 71 -24.776 -18.504 0.724 966 HG23 THR 71 2HG2 THR 71 -25.720 -17.268 1.582 967 H CYS 72 HN CYS 72 -22.345 -18.921 4.550 968 HA CYS 72 HA CYS 72 -23.582 -21.155 6.028 969 HB2 CYS 72 2HB CYS 72 -21.334 -22.081 6.060 970 HB3 CYS 72 3HB CYS 72 -21.702 -21.514 4.418 971 H GLN 73 HN GLN 73 -22.101 -18.067 6.755 972 HA GLN 73 HA GLN 73 -22.068 -16.940 8.788 973 HB2 GLN 73 2HB GLN 73 -22.701 -19.473 10.358 974 HB3 GLN 73 3HB GLN 73 -22.894 -17.808 10.809 975 HG2 GLN 73 2HG GLN 73 -24.640 -19.342 8.856 976 HG3 GLN 73 3HG GLN 73 -25.065 -18.690 10.425 977 HE21 GLN 73 1HE2 GLN 73 -25.483 -18.140 7.137 978 HE22 GLN 73 2HE2 GLN 73 -25.751 -16.401 7.248 979 H ARG 74 HN ARG 74 -19.979 -19.057 7.558 980 HA ARG 74 HA ARG 74 -18.244 -19.603 9.794 981 HE ARG 74 HE ARG 74 -14.781 -23.433 7.813 982 HB2 ARG 74 2HB ARG 74 -18.388 -20.915 7.639 983 HB3 ARG 74 3HB ARG 74 -17.547 -19.583 6.821 984 HG2 ARG 74 2HG ARG 74 -15.599 -19.924 8.347 985 HG3 ARG 74 3HG ARG 74 -16.479 -21.237 9.156 986 HD2 ARG 74 2HD ARG 74 -16.613 -22.412 6.924 987 HD3 ARG 74 3HD ARG 74 -15.570 -21.163 6.244 988 HH11 ARG 74 1HH1 ARG 74 -13.792 -20.070 7.397 989 HH12 ARG 74 2HH1 ARG 74 -12.142 -20.416 7.822 990 HH21 ARG 74 1HH2 ARG 74 -12.680 -23.795 8.350 991 HH22 ARG 74 2HH2 ARG 74 -11.509 -22.503 8.270 992 H LYS 75 HN LYS 75 -16.399 -18.592 10.508 993 HA LYS 75 HA LYS 75 -16.120 -15.793 9.638 994 HB2 LYS 75 2HB LYS 75 -15.069 -17.342 12.053 995 HB3 LYS 75 3HB LYS 75 -14.702 -15.644 11.707 996 HG2 LYS 75 2HG LYS 75 -17.094 -15.084 11.710 997 HG3 LYS 75 3HG LYS 75 -17.498 -16.754 12.151 998 HD2 LYS 75 2HD LYS 75 -16.262 -16.509 14.268 999 HD3 LYS 75 3HD LYS 75 -15.761 -14.867 13.806 1000 HE2 LYS 75 2HE LYS 75 -18.145 -14.168 13.702 1001 HE3 LYS 75 3HE LYS 75 -18.640 -15.795 14.181 1002 HZ1 LYS 75 3HZ LYS 75 -17.444 -15.483 16.247 1003 HZ2 LYS 75 1HZ LYS 75 -18.576 -14.300 16.051 1004 HZ3 LYS 75 2HZ LYS 75 -16.984 -13.967 15.795 1005 H PHE 76 HN PHE 76 -14.250 -14.833 9.007 1006 HA PHE 76 HA PHE 76 -11.835 -16.510 8.519 1007 HD1 PHE 76 1HD PHE 76 -11.733 -17.960 5.938 1008 HD2 PHE 76 2HD PHE 76 -15.254 -15.471 6.148 1009 HE1 PHE 76 1HE PHE 76 -13.094 -19.792 4.956 1010 HE2 PHE 76 2HE PHE 76 -16.616 -17.330 5.232 1011 HZ PHE 76 HZ PHE 76 -15.547 -19.485 4.658 1012 HB2 PHE 76 2HB PHE 76 -13.059 -14.536 6.535 1013 HB3 PHE 76 3HB PHE 76 -11.601 -15.476 6.292 1014 H SER 77 HN SER 77 -9.886 -15.157 8.157 1015 HA SER 77 HA SER 77 -10.029 -12.799 9.954 1016 HG SER 77 HG SER 77 -6.756 -15.122 9.137 1017 HB2 SER 77 2HB SER 77 -7.533 -13.156 10.104 1018 HB3 SER 77 3HB SER 77 -8.475 -14.568 10.613 1019 H ARG 78 HN ARG 78 -10.045 -13.320 6.617 1020 HA ARG 78 HA ARG 78 -8.842 -10.625 6.154 1021 HE ARG 78 HE ARG 78 -6.020 -13.212 3.302 1022 HB2 ARG 78 2HB ARG 78 -8.251 -13.040 4.384 1023 HB3 ARG 78 3HB ARG 78 -7.679 -11.381 4.200 1024 HG2 ARG 78 2HG ARG 78 -6.714 -11.858 6.678 1025 HG3 ARG 78 3HG ARG 78 -6.730 -13.518 6.073 1026 HD2 ARG 78 2HD ARG 78 -5.361 -11.078 4.862 1027 HD3 ARG 78 3HD ARG 78 -4.584 -12.396 5.756 1028 HH11 ARG 78 1HH1 ARG 78 -2.982 -11.948 4.503 1029 HH12 ARG 78 2HH1 ARG 78 -2.094 -12.662 3.158 1030 HH21 ARG 78 1HH2 ARG 78 -4.781 -14.186 1.728 1031 HH22 ARG 78 2HH2 ARG 78 -3.129 -13.638 1.476 1032 H SER 79 HN SER 79 -10.148 -9.356 5.073 1033 HA SER 79 HA SER 79 -12.643 -9.931 4.013 1034 HG SER 79 HG SER 79 -10.322 -6.743 2.995 1035 HB2 SER 79 2HB SER 79 -12.320 -7.864 2.576 1036 HB3 SER 79 3HB SER 79 -11.950 -7.641 4.291 1037 H ASP 80 HN ASP 80 -9.524 -9.962 2.207 1038 HA ASP 80 HA ASP 80 -10.580 -10.595 -0.347 1039 HB2 ASP 80 2HB ASP 80 -8.245 -11.488 -0.797 1040 HB3 ASP 80 3HB ASP 80 -8.418 -9.837 -0.187 1041 H HIS 81 HN HIS 81 -9.821 -12.733 2.405 1042 HA HIS 81 HA HIS 81 -10.167 -15.231 0.870 1043 HD1 HIS 81 1HD HIS 81 -7.681 -15.738 4.809 1044 HD2 HIS 81 2HD HIS 81 -7.926 -15.153 0.651 1045 HE1 HIS 81 1HE HIS 81 -5.398 -15.690 4.007 1046 HB2 HIS 81 2HB HIS 81 -9.954 -14.658 3.858 1047 HB3 HIS 81 3HB HIS 81 -10.184 -16.262 3.178 1048 H LEU 82 HN LEU 82 -12.153 -13.148 3.018 1049 HA LEU 82 HA LEU 82 -14.425 -14.947 3.076 1050 HG LEU 82 HG LEU 82 -16.508 -13.924 3.572 1051 HB2 LEU 82 2HB LEU 82 -14.144 -13.159 4.701 1052 HB3 LEU 82 3HB LEU 82 -14.264 -11.911 3.460 1053 HD11 LEU 82 1HD1 LEU 82 -16.507 -11.680 5.589 1054 HD12 LEU 82 2HD1 LEU 82 -16.026 -13.383 5.949 1055 HD13 LEU 82 3HD1 LEU 82 -17.642 -13.000 5.375 1056 HD21 LEU 82 3HD2 LEU 82 -16.526 -10.877 3.303 1057 HD22 LEU 82 1HD2 LEU 82 -17.936 -11.952 3.170 1058 HD23 LEU 82 2HD2 LEU 82 -16.668 -12.019 1.958 1059 H LYS 83 HN LYS 83 -13.508 -12.136 1.013 1060 HA LYS 83 HA LYS 83 -15.806 -12.224 -0.730 1061 HB2 LYS 83 2HB LYS 83 -14.196 -10.331 -0.568 1062 HB3 LYS 83 3HB LYS 83 -12.932 -11.330 -1.283 1063 HG2 LYS 83 2HG LYS 83 -14.245 -11.475 -3.396 1064 HG3 LYS 83 3HG LYS 83 -15.523 -10.489 -2.654 1065 HD2 LYS 83 2HD LYS 83 -13.885 -8.620 -2.370 1066 HD3 LYS 83 3HD LYS 83 -12.615 -9.639 -3.067 1067 HE2 LYS 83 2HE LYS 83 -13.366 -8.173 -4.798 1068 HE3 LYS 83 3HE LYS 83 -13.948 -9.799 -5.182 1069 HZ1 LYS 83 3HZ LYS 83 -16.092 -9.154 -4.266 1070 HZ2 LYS 83 1HZ LYS 83 -15.659 -8.153 -5.498 1071 HZ3 LYS 83 2HZ LYS 83 -15.533 -7.638 -3.941 1072 H THR 84 HN THR 84 -12.683 -13.972 -0.702 1073 HA THR 84 HA THR 84 -13.043 -15.285 -3.249 1074 HB THR 84 HB THR 84 -11.431 -15.963 -0.768 1075 HG1 THR 84 1HG THR 84 -10.684 -14.199 -1.708 1076 HG21 THR 84 3HG2 THR 84 -11.656 -18.084 -1.887 1077 HG22 THR 84 1HG2 THR 84 -10.034 -17.409 -2.071 1078 HG23 THR 84 2HG2 THR 84 -11.192 -17.327 -3.441 1079 H HIS 85 HN HIS 85 -13.623 -16.337 0.156 1080 HA HIS 85 HA HIS 85 -14.767 -18.876 -0.463 1081 HD1 HIS 85 1HD HIS 85 -15.922 -20.716 1.991 1082 HD2 HIS 85 2HD HIS 85 -17.364 -16.784 2.569 1083 HE1 HIS 85 1HE HIS 85 -18.358 -20.899 2.852 1084 HB2 HIS 85 2HB HIS 85 -14.099 -18.567 1.783 1085 HB3 HIS 85 3HB HIS 85 -14.869 -16.989 1.898 1086 H THR 86 HN THR 86 -16.126 -15.611 -0.328 1087 HA THR 86 HA THR 86 -18.885 -16.143 -0.323 1088 HB THR 86 HB THR 86 -17.326 -14.000 -1.807 1089 HG1 THR 86 1HG THR 86 -17.135 -14.045 0.471 1090 HG21 THR 86 3HG2 THR 86 -19.248 -12.573 -1.679 1091 HG22 THR 86 1HG2 THR 86 -20.277 -13.959 -1.212 1092 HG23 THR 86 2HG2 THR 86 -19.484 -13.903 -2.818 1093 H ARG 87 HN ARG 87 -16.525 -16.314 -3.025 1094 HA ARG 87 HA ARG 87 -18.452 -16.556 -5.150 1095 HE ARG 87 HE ARG 87 -15.064 -13.517 -6.967 1096 HB2 ARG 87 2HB ARG 87 -15.631 -17.678 -5.000 1097 HB3 ARG 87 3HB ARG 87 -16.586 -17.431 -6.453 1098 HG2 ARG 87 2HG ARG 87 -16.619 -14.950 -5.954 1099 HG3 ARG 87 3HG ARG 87 -15.562 -15.254 -4.584 1100 HD2 ARG 87 2HD ARG 87 -13.778 -16.018 -5.956 1101 HD3 ARG 87 3HD ARG 87 -14.797 -16.039 -7.407 1102 HH11 ARG 87 1HH2 ARG 87 -12.006 -15.264 -6.711 1103 HH12 ARG 87 2HH2 ARG 87 -11.086 -13.765 -6.671 1104 HH21 ARG 87 1HH1 ARG 87 -13.856 -11.759 -7.130 1105 HH22 ARG 87 2HH1 ARG 87 -12.103 -11.821 -7.025 1106 H THR 88 HN THR 88 -17.325 -18.810 -2.719 1107 HA THR 88 HA THR 88 -17.958 -21.329 -3.954 1108 HB THR 88 HB THR 88 -18.465 -20.651 -1.036 1109 HG1 THR 88 1HG THR 88 -16.588 -19.978 -1.159 1110 HG21 THR 88 3HG2 THR 88 -17.689 -23.201 -2.445 1111 HG22 THR 88 1HG2 THR 88 -19.180 -22.863 -1.549 1112 HG23 THR 88 2HG2 THR 88 -17.639 -22.984 -0.679 1113 H HIS 89 HN HIS 89 -19.952 -18.902 -2.219 1114 HA HIS 89 HA HIS 89 -22.374 -20.589 -2.556 1115 HD1 HIS 89 1HD HIS 89 -22.887 -21.529 -0.193 1116 HD2 HIS 89 2HD HIS 89 -20.859 -18.081 1.131 1117 HE1 HIS 89 1HE HIS 89 -22.020 -22.029 2.170 1118 HB2 HIS 89 2HB HIS 89 -21.946 -17.875 -1.230 1119 HB3 HIS 89 3HB HIS 89 -23.461 -18.771 -1.246 1120 H THR 90 HN THR 90 -20.700 -17.973 -4.111 1121 HA THR 90 HA THR 90 -23.153 -16.863 -5.324 1122 HB THR 90 HB THR 90 -20.271 -15.964 -5.700 1123 HG1 THR 90 1HG THR 90 -20.727 -15.967 -3.490 1124 HG21 THR 90 3HG2 THR 90 -22.859 -14.399 -5.894 1125 HG22 THR 90 1HG2 THR 90 -21.735 -14.752 -7.228 1126 HG23 THR 90 2HG2 THR 90 -21.229 -13.698 -5.911 1127 H GLY 91 HN GLY 91 -21.188 -19.447 -6.127 1128 HA2 GLY 91 2HA GLY 91 -20.585 -20.504 -8.100 1129 HA3 GLY 91 3HA GLY 91 -21.986 -19.672 -8.800 1130 H GLU 92 HN GLU 92 -19.520 -17.583 -7.551 1131 HA GLU 92 HA GLU 92 -19.138 -16.473 -10.208 1132 HB2 GLU 92 2HB GLU 92 -19.435 -15.115 -8.158 1133 HB3 GLU 92 3HB GLU 92 -17.914 -15.705 -7.526 1134 HG2 GLU 92 2HG GLU 92 -16.723 -14.600 -9.444 1135 HG3 GLU 92 3HG GLU 92 -18.282 -14.043 -10.060 1136 H LYS 93 HN LYS 93 -18.015 -18.148 -11.346 1137 HA LYS 93 HA LYS 93 -15.133 -18.424 -10.564 1138 HB2 LYS 93 2HB LYS 93 -16.938 -20.270 -12.186 1139 HB3 LYS 93 3HB LYS 93 -15.196 -20.499 -11.989 1140 HG2 LYS 93 2HG LYS 93 -15.448 -20.750 -9.571 1141 HG3 LYS 93 3HG LYS 93 -17.190 -20.427 -9.679 1142 HD2 LYS 93 2HD LYS 93 -17.479 -22.454 -11.078 1143 HD3 LYS 93 3HD LYS 93 -15.736 -22.777 -10.961 1144 HE2 LYS 93 2HE LYS 93 -15.933 -22.919 -8.488 1145 HE3 LYS 93 3HE LYS 93 -17.679 -22.640 -8.618 1146 HZ1 LYS 93 3HZ LYS 93 -17.150 -24.982 -8.454 1147 HZ2 LYS 93 1HZ LYS 93 -16.218 -24.909 -9.810 1148 HZ3 LYS 93 2HZ LYS 93 -17.840 -24.658 -9.914 1149 HA PRO 94 HA PRO 94 -15.205 -15.990 -14.459 1150 HB2 PRO 94 2HB PRO 94 -13.487 -13.987 -13.773 1151 HB3 PRO 94 3HB PRO 94 -15.160 -14.054 -13.146 1152 HG2 PRO 94 2HG PRO 94 -12.621 -14.976 -11.762 1153 HG3 PRO 94 3HG PRO 94 -13.928 -13.945 -11.103 1154 HD2 PRO 94 2HD PRO 94 -13.792 -16.650 -10.679 1155 HD3 PRO 94 3HD PRO 94 -15.344 -15.765 -10.789 1156 H PHE 95 HN PHE 95 -12.479 -17.356 -12.598 1157 HA PHE 95 HA PHE 95 -10.457 -16.770 -14.644 1158 HD1 PHE 95 2HD PHE 95 -8.184 -15.888 -13.348 1159 HD2 PHE 95 1HD PHE 95 -11.113 -17.266 -10.517 1160 HE1 PHE 95 2HE PHE 95 -7.722 -13.911 -11.914 1161 HE2 PHE 95 1HE PHE 95 -10.655 -15.287 -9.079 1162 HZ PHE 95 HZ PHE 95 -8.960 -13.613 -9.779 1163 HB2 PHE 95 2HB PHE 95 -10.396 -18.710 -12.287 1164 HB3 PHE 95 3HB PHE 95 -9.028 -18.255 -13.291 1165 H SER 96 HN SER 96 -11.635 -17.616 -16.513 1166 HA SER 96 HA SER 96 -12.053 -20.507 -16.747 1167 HG SER 96 HG SER 96 -13.479 -17.833 -17.213 1168 HB2 SER 96 2HB SER 96 -12.028 -18.417 -18.964 1169 HB3 SER 96 3HB SER 96 -12.828 -19.997 -18.976 1170 H CYS 97 HN CYS 97 -10.880 -21.991 -17.953 1171 HA CYS 97 HA CYS 97 -8.061 -21.500 -18.291 1172 HB2 CYS 97 2HB CYS 97 -9.168 -23.736 -17.789 1173 HB3 CYS 97 3HB CYS 97 -9.710 -23.768 -19.464 1174 H ARG 98 HN ARG 98 -6.866 -21.862 -20.325 1175 HA ARG 98 HA ARG 98 -8.283 -20.635 -22.664 1176 HE ARG 98 HE ARG 98 -8.856 -18.304 -19.542 1177 HB2 ARG 98 2HB ARG 98 -5.400 -20.094 -21.844 1178 HB3 ARG 98 3HB ARG 98 -6.298 -19.307 -23.140 1179 HG2 ARG 98 2HG ARG 98 -6.837 -19.044 -20.156 1180 HG3 ARG 98 3HG ARG 98 -6.021 -17.858 -21.157 1181 HD2 ARG 98 2HD ARG 98 -7.953 -17.078 -22.125 1182 HD3 ARG 98 3HD ARG 98 -8.776 -18.643 -22.052 1183 HH11 ARG 98 1HH1 ARG 98 -9.240 -15.524 -21.679 1184 HH12 ARG 98 2HH1 ARG 98 -10.145 -14.656 -20.456 1185 HH21 ARG 98 1HH2 ARG 98 -9.857 -17.222 -18.145 1186 HH22 ARG 98 2HH2 ARG 98 -10.519 -15.601 -18.439 1187 H TRP 99 HN TRP 99 -7.059 -23.444 -21.606 1188 HA TRP 99 HA TRP 99 -5.130 -24.170 -23.617 1189 HD1 TRP 99 1HD TRP 99 -5.003 -23.846 -20.387 1190 HE1 TRP 99 1HE TRP 99 -2.719 -24.440 -19.404 1191 HE3 TRP 99 3HE TRP 99 -4.150 -28.198 -22.933 1192 HZ2 TRP 99 2HZ TRP 99 -0.728 -26.500 -19.736 1193 HZ3 TRP 99 3HZ TRP 99 -2.031 -29.449 -22.594 1194 HH2 TRP 99 2HH TRP 99 -0.311 -28.605 -21.016 1195 HB2 TRP 99 2HB TRP 99 -6.901 -25.681 -21.676 1196 HB3 TRP 99 3HB TRP 99 -6.057 -26.554 -22.939 1197 HA PRO 100 HA PRO 100 -7.608 -24.551 -27.167 1198 HB2 PRO 100 2HB PRO 100 -6.278 -26.485 -28.641 1199 HB3 PRO 100 3HB PRO 100 -5.609 -24.871 -28.284 1200 HG2 PRO 100 2HG PRO 100 -5.103 -27.457 -26.774 1201 HG3 PRO 100 3HG PRO 100 -3.893 -26.299 -27.422 1202 HD2 PRO 100 2HD PRO 100 -4.660 -26.201 -24.834 1203 HD3 PRO 100 3HD PRO 100 -4.419 -24.685 -25.761 1204 H SER 101 HN SER 101 -8.057 -26.696 -24.794 1205 HA SER 101 HA SER 101 -10.205 -28.105 -26.233 1206 HG SER 101 HG SER 101 -10.233 -30.308 -24.578 1207 HB2 SER 101 2HB SER 101 -8.286 -29.645 -26.502 1208 HB3 SER 101 3HB SER 101 -7.999 -29.608 -24.750 1209 H CYS 102 HN CYS 102 -9.796 -26.029 -24.000 1210 HA CYS 102 HA CYS 102 -11.455 -27.422 -21.947 1211 HB2 CYS 102 2HB CYS 102 -9.062 -27.378 -21.213 1212 HB3 CYS 102 3HB CYS 102 -9.094 -25.602 -21.313 1213 H GLN 103 HN GLN 103 -12.794 -26.095 -20.710 1214 HA GLN 103 HA GLN 103 -12.788 -23.193 -21.157 1215 HB2 GLN 103 2HB GLN 103 -15.206 -24.943 -21.800 1216 HB3 GLN 103 3HB GLN 103 -15.351 -23.222 -21.460 1217 HG2 GLN 103 2HG GLN 103 -13.754 -24.348 -23.784 1218 HG3 GLN 103 3HG GLN 103 -15.388 -23.715 -23.858 1219 HE21 GLN 103 1HE2 GLN 103 -11.978 -22.796 -23.356 1220 HE22 GLN 103 2HE2 GLN 103 -12.300 -21.061 -23.614 1221 H LYS 104 HN LYS 104 -12.146 -25.174 -18.996 1222 HA LYS 104 HA LYS 104 -14.357 -25.116 -17.063 1223 HB2 LYS 104 2HB LYS 104 -11.418 -25.886 -16.786 1224 HB3 LYS 104 3HB LYS 104 -12.641 -26.105 -15.530 1225 HG2 LYS 104 2HG LYS 104 -13.919 -27.644 -16.984 1226 HG3 LYS 104 3HG LYS 104 -12.760 -27.403 -18.288 1227 HD2 LYS 104 2HD LYS 104 -11.015 -28.176 -16.374 1228 HD3 LYS 104 3HD LYS 104 -12.467 -28.935 -15.720 1229 HE2 LYS 104 2HE LYS 104 -11.502 -30.606 -17.092 1230 HE3 LYS 104 3HE LYS 104 -12.801 -29.925 -18.089 1231 HZ1 LYS 104 3HZ LYS 104 -11.042 -28.481 -19.087 1232 HZ2 LYS 104 1HZ LYS 104 -10.838 -30.089 -19.403 1233 HZ3 LYS 104 2HZ LYS 104 -9.914 -29.314 -18.276 1234 H LYS 105 HN LYS 105 -14.397 -23.943 -15.120 1235 HA LYS 105 HA LYS 105 -12.704 -21.489 -15.192 1236 HB2 LYS 105 2HB LYS 105 -15.643 -21.536 -14.401 1237 HB3 LYS 105 3HB LYS 105 -14.576 -20.159 -14.762 1238 HG2 LYS 105 2HG LYS 105 -14.397 -21.015 -17.130 1239 HG3 LYS 105 3HG LYS 105 -15.641 -22.208 -16.742 1240 HD2 LYS 105 2HD LYS 105 -17.301 -20.508 -16.367 1241 HD3 LYS 105 3HD LYS 105 -16.084 -19.221 -16.411 1242 HE2 LYS 105 2HE LYS 105 -17.313 -19.299 -18.529 1243 HE3 LYS 105 3HE LYS 105 -15.598 -19.668 -18.760 1244 HZ1 LYS 105 3HZ LYS 105 -17.745 -21.683 -18.602 1245 HZ2 LYS 105 1HZ LYS 105 -16.147 -21.994 -18.872 1246 HZ3 LYS 105 2HZ LYS 105 -17.022 -21.165 -19.990 1247 H PHE 106 HN PHE 106 -12.083 -20.570 -13.307 1248 HA PHE 106 HA PHE 106 -12.808 -22.059 -10.797 1249 HD1 PHE 106 1HD PHE 106 -10.942 -24.053 -9.902 1250 HD2 PHE 106 2HD PHE 106 -9.832 -22.133 -13.597 1251 HE1 PHE 106 1HE PHE 106 -10.715 -26.272 -10.994 1252 HE2 PHE 106 2HE PHE 106 -9.666 -24.341 -14.704 1253 HZ PHE 106 HZ PHE 106 -10.138 -26.412 -13.411 1254 HB2 PHE 106 2HB PHE 106 -10.114 -20.824 -11.558 1255 HB3 PHE 106 3HB PHE 106 -10.501 -21.597 -10.021 1256 H ALA 107 HN ALA 107 -12.537 -20.803 -8.804 1257 HA ALA 107 HA ALA 107 -13.493 -18.031 -9.253 1258 HB1 ALA 107 1HB ALA 107 -14.114 -18.213 -6.804 1259 HB2 ALA 107 2HB ALA 107 -14.896 -19.425 -7.820 1260 HB3 ALA 107 3HB ALA 107 -13.501 -19.872 -6.806 1261 H ARG 108 HN ARG 108 -10.539 -19.515 -8.807 1262 HA ARG 108 HA ARG 108 -9.427 -17.027 -7.608 1263 HE ARG 108 HE ARG 108 -7.262 -19.828 -4.802 1264 HB2 ARG 108 2HB ARG 108 -8.663 -19.866 -6.848 1265 HB3 ARG 108 3HB ARG 108 -7.765 -18.402 -6.417 1266 HG2 ARG 108 2HG ARG 108 -9.332 -17.653 -4.912 1267 HG3 ARG 108 3HG ARG 108 -10.650 -18.610 -5.599 1268 HD2 ARG 108 2HD ARG 108 -9.896 -19.484 -3.436 1269 HD3 ARG 108 3HD ARG 108 -9.796 -20.657 -4.744 1270 HH11 ARG 108 2HH2 ARG 108 -9.169 -20.385 -1.922 1271 HH12 ARG 108 1HH2 ARG 108 -7.825 -21.117 -1.066 1272 HH21 ARG 108 2HH1 ARG 108 -5.596 -20.791 -3.713 1273 HH22 ARG 108 1HH1 ARG 108 -5.861 -21.365 -2.068 1274 H SER 109 HN SER 109 -7.533 -16.336 -8.471 1275 HA SER 109 HA SER 109 -6.847 -17.094 -11.105 1276 HG SER 109 HG SER 109 -5.690 -14.532 -8.450 1277 HB2 SER 109 2HB SER 109 -4.714 -15.741 -10.576 1278 HB3 SER 109 3HB SER 109 -6.252 -14.899 -10.389 1279 H ASP 110 HN ASP 110 -5.351 -17.967 -7.946 1280 HA ASP 110 HA ASP 110 -3.177 -19.464 -9.114 1281 HB2 ASP 110 2HB ASP 110 -2.674 -20.159 -6.925 1282 HB3 ASP 110 3HB ASP 110 -3.190 -18.487 -6.808 1283 H GLU 111 HN GLU 111 -6.531 -20.294 -8.130 1284 HA GLU 111 HA GLU 111 -6.266 -23.163 -8.275 1285 HB2 GLU 111 2HB GLU 111 -8.607 -21.246 -8.537 1286 HB3 GLU 111 3HB GLU 111 -8.781 -22.927 -8.999 1287 HG2 GLU 111 2HG GLU 111 -8.015 -23.677 -6.785 1288 HG3 GLU 111 3HG GLU 111 -7.948 -22.002 -6.239 1289 H LEU 112 HN LEU 112 -7.003 -20.624 -10.724 1290 HA LEU 112 HA LEU 112 -7.295 -22.452 -12.926 1291 HG LEU 112 HG LEU 112 -5.736 -20.612 -14.990 1292 HB2 LEU 112 2HB LEU 112 -8.047 -20.162 -13.060 1293 HB3 LEU 112 3HB LEU 112 -6.404 -19.536 -12.870 1294 HD11 LEU 112 1HD1 LEU 112 -7.311 -21.593 -16.482 1295 HD12 LEU 112 2HD1 LEU 112 -8.681 -21.304 -15.401 1296 HD13 LEU 112 3HD1 LEU 112 -7.416 -22.503 -15.016 1297 HD21 LEU 112 3HD2 LEU 112 -6.884 -19.139 -16.512 1298 HD22 LEU 112 1HD2 LEU 112 -6.567 -18.285 -14.991 1299 HD23 LEU 112 2HD2 LEU 112 -8.203 -18.892 -15.360 1300 H VAL 113 HN VAL 113 -4.385 -20.572 -11.757 1301 HA VAL 113 HA VAL 113 -2.492 -21.634 -13.501 1302 HB VAL 113 HB VAL 113 -2.132 -21.068 -10.511 1303 HG11 VAL 113 1HG1 VAL 113 0.254 -20.677 -11.072 1304 HG12 VAL 113 2HG1 VAL 113 -0.218 -22.359 -11.301 1305 HG13 VAL 113 3HG1 VAL 113 -0.045 -21.292 -12.711 1306 HG21 VAL 113 3HG2 VAL 113 -1.367 -18.874 -11.088 1307 HG22 VAL 113 1HG2 VAL 113 -1.441 -19.236 -12.824 1308 HG23 VAL 113 2HG2 VAL 113 -2.922 -19.078 -11.900 1309 H ARG 114 HN ARG 114 -3.465 -23.021 -10.346 1310 HA ARG 114 HA ARG 114 -1.949 -25.393 -10.446 1311 HE ARG 114 HE ARG 114 -2.388 -25.817 -6.742 1312 HB2 ARG 114 2HB ARG 114 -3.191 -24.671 -8.462 1313 HB3 ARG 114 3HB ARG 114 -4.740 -24.979 -9.255 1314 HG2 ARG 114 2HG ARG 114 -4.298 -27.365 -9.398 1315 HG3 ARG 114 3HG ARG 114 -2.623 -27.148 -8.865 1316 HD2 ARG 114 2HD ARG 114 -5.069 -26.505 -7.172 1317 HD3 ARG 114 3HD ARG 114 -4.183 -28.041 -7.127 1318 HH11 ARG 114 1HH1 ARG 114 -4.793 -27.725 -4.999 1319 HH12 ARG 114 2HH1 ARG 114 -4.081 -27.376 -3.456 1320 HH21 ARG 114 1HH2 ARG 114 -1.542 -25.369 -4.683 1321 HH22 ARG 114 2HH2 ARG 114 -2.413 -26.024 -3.292 1322 H HIS 115 HN HIS 115 -5.259 -24.786 -11.745 1323 HA HIS 115 HA HIS 115 -5.799 -27.399 -12.723 1324 HD1 HIS 115 1HD HIS 115 -8.038 -28.265 -14.100 1325 HD2 HIS 115 2HD HIS 115 -7.166 -24.784 -16.313 1326 HE1 HIS 115 1HE HIS 115 -8.780 -28.688 -16.523 1327 HB2 HIS 115 2HB HIS 115 -7.533 -25.754 -12.695 1328 HB3 HIS 115 3HB HIS 115 -6.650 -24.653 -13.735 1329 H HIS 116 HN HIS 116 -4.237 -24.603 -14.406 1330 HA HIS 116 HA HIS 116 -3.645 -25.947 -16.833 1331 HD1 HIS 116 1HD HIS 116 -5.167 -24.202 -17.838 1332 HD2 HIS 116 2HD HIS 116 -2.552 -21.299 -16.197 1333 HE1 HIS 116 1HE HIS 116 -6.044 -21.969 -18.499 1334 HB2 HIS 116 2HB HIS 116 -2.094 -23.766 -15.386 1335 HB3 HIS 116 3HB HIS 116 -1.796 -24.282 -17.032 1336 H ASN 117 HN ASN 117 -1.957 -25.965 -13.664 1337 HA ASN 117 HA ASN 117 0.482 -27.216 -14.652 1338 HB2 ASN 117 2HB ASN 117 -0.002 -25.862 -12.441 1339 HB3 ASN 117 3HB ASN 117 -0.506 -27.416 -11.784 1340 HD21 ASN 117 1HD2 ASN 117 1.504 -29.126 -13.008 1341 HD22 ASN 117 2HD2 ASN 117 3.043 -28.564 -12.302 1342 H MET 118 HN MET 118 -2.716 -28.375 -14.009 1343 HA MET 118 HA MET 118 -1.725 -31.205 -13.889 1344 HB2 MET 118 2HB MET 118 -4.380 -29.996 -12.983 1345 HB3 MET 118 3HB MET 118 -3.976 -31.719 -12.920 1346 HG2 MET 118 2HG MET 118 -2.129 -31.267 -11.377 1347 HG3 MET 118 3HG MET 118 -2.464 -29.535 -11.438 1348 HE1 MET 118 3HE MET 118 -2.362 -29.599 -8.799 1349 HE2 MET 118 1HE MET 118 -3.436 -30.594 -7.785 1350 HE3 MET 118 2HE MET 118 -2.185 -31.369 -8.782 1351 H HIS 119 HN HIS 119 -2.603 -29.033 -16.156 1352 HA HIS 119 HA HIS 119 -4.891 -30.246 -17.395 1353 HD1 HIS 119 1HD HIS 119 -5.243 -30.170 -20.273 1354 HD2 HIS 119 2HD HIS 119 -5.839 -26.606 -18.134 1355 HE1 HIS 119 1HE HIS 119 -7.648 -29.332 -20.822 1356 HB2 HIS 119 2HB HIS 119 -3.694 -27.862 -17.636 1357 HB3 HIS 119 3HB HIS 119 -2.954 -28.641 -19.035 Start of MODEL 5 1 H5 DC 124 5H C 124 -4.006 -31.441 -5.050 2 H6 DC 124 6H C 124 -5.927 -31.100 -6.519 3 H5' DC 124 H5' C 124 -9.042 -32.550 -9.843 4 H5'' DC 124 H5" C 124 -7.543 -32.291 -8.909 5 H4' DC 124 H4' C 124 -10.360 -32.466 -7.738 6 H3' DC 124 H3' C 124 -9.118 -30.255 -8.953 7 H2' DC 124 H2' C 124 -7.418 -29.994 -7.386 8 H2'' DC 124 H2" C 124 -8.668 -29.040 -6.548 9 H1' DC 124 H1' C 124 -9.426 -30.895 -5.242 10 H41 DC 124 1H4 C 124 -4.491 -32.206 -1.498 11 H42 DC 124 2H4 C 124 -3.348 -31.895 -2.790 12 H8 DG 125 8H G 125 -9.154 -26.970 -5.651 13 H1 DG 125 1H G 125 -6.448 -29.014 -0.194 14 H5' DG 125 H5' G 125 -12.895 -29.656 -6.383 15 H5'' DG 125 H5" G 125 -14.030 -28.353 -6.789 16 H4' DG 125 H4' G 125 -13.803 -28.576 -4.372 17 H3' DG 125 H3' G 125 -13.399 -26.131 -5.708 18 H2' DG 125 H2' G 125 -11.122 -26.027 -5.322 19 H2'' DG 125 H2" G 125 -11.640 -25.267 -3.789 20 H1' DG 125 H1' G 125 -11.550 -27.364 -2.606 21 H21 DG 125 1H2 G 125 -7.931 -29.256 1.351 22 H22 DG 125 2H2 G 125 -9.635 -28.953 1.056 23 H5 DC 126 5H C 126 -8.058 -23.960 -4.330 24 H6 DC 126 6H C 126 -10.029 -23.572 -2.936 25 H5' DC 126 H5' C 126 -13.604 -26.208 -1.091 26 H5'' DC 126 H5" C 126 -14.595 -24.854 -0.501 27 H4' DC 126 H4' C 126 -12.670 -25.173 0.948 28 H3' DC 126 H3' C 126 -13.279 -22.666 -0.195 29 H2' DC 126 H2' C 126 -11.439 -22.800 -1.685 30 H2'' DC 126 H2" C 126 -10.660 -21.939 -0.318 31 H1' DC 126 H1' C 126 -10.022 -24.098 0.747 32 H41 DC 126 1H4 C 126 -5.006 -25.437 -2.905 33 H42 DC 126 2H4 C 126 -5.819 -24.882 -4.349 34 H8 DG 127 8H G 127 -9.634 -21.630 1.664 35 H1 DG 127 1H G 127 -3.447 -23.008 0.640 36 H5' DG 127 H5' G 127 -12.093 -23.657 3.920 37 H5'' DG 127 H5" G 127 -12.599 -22.598 5.249 38 H4' DG 127 H4' G 127 -10.511 -23.714 5.842 39 H3' DG 127 H3' G 127 -10.697 -20.880 5.774 40 H2' DG 127 H2' G 127 -9.216 -20.512 4.046 41 H2'' DG 127 H2" G 127 -7.971 -20.747 5.311 42 H1' DG 127 H1' G 127 -7.625 -23.006 4.702 43 H21 DG 127 1H2 G 127 -2.459 -23.312 2.564 44 H22 DG 127 2H2 G 127 -3.310 -23.103 4.084 45 H8 DG 128 8H G 128 -7.447 -18.572 4.106 46 H1 DG 128 1H G 128 -2.580 -19.747 0.092 47 H5' DG 128 H5' G 128 -6.817 -21.848 7.583 48 H5'' DG 128 H5" G 128 -6.542 -21.089 9.147 49 H4' DG 128 H4' G 128 -4.576 -20.682 8.019 50 H3' DG 128 H3' G 128 -6.286 -18.472 8.523 51 H2' DG 128 H2' G 128 -6.776 -18.099 6.234 52 H2'' DG 128 H2" G 128 -5.276 -17.112 6.374 53 H1' DG 128 H1' G 128 -3.913 -18.974 5.715 54 H21 DG 128 1H2 G 128 -0.752 -19.983 1.195 55 H22 DG 128 2H2 G 128 -0.727 -20.015 2.949 56 H8 DG 129 8H G 129 -3.426 -16.353 5.560 57 H1 DG 129 1H G 129 -1.045 -16.462 -0.375 58 H5' DG 129 H5' G 129 -1.441 -18.282 8.958 59 H5'' DG 129 H5" G 129 -1.052 -16.877 9.950 60 H4' DG 129 H4' G 129 0.566 -17.267 8.163 61 H3' DG 129 H3' G 129 -0.657 -14.850 8.635 62 H2' DG 129 H2' G 129 -1.879 -14.961 6.655 63 H2'' DG 129 H2" G 129 -0.457 -14.073 6.044 64 H1' DG 129 H1' G 129 0.476 -16.201 5.278 65 H21 DG 129 1H2 G 129 1.106 -16.578 -0.307 66 H22 DG 129 2H2 G 129 1.993 -16.537 1.208 67 H8 DG 130 8H G 130 0.556 -13.413 4.196 68 H1 DG 130 1H G 130 -0.534 -12.659 -2.051 69 H5' DG 130 H5' G 130 3.011 -15.563 5.552 70 H5'' DG 130 H5" G 130 4.037 -14.635 6.651 71 H4' DG 130 H4' G 130 5.084 -14.421 4.587 72 H3' DG 130 H3' G 130 4.004 -12.073 5.806 73 H2' DG 130 H2' G 130 2.400 -11.595 4.260 74 H2'' DG 130 H2" G 130 3.714 -11.048 3.213 75 H1' DG 130 H1' G 130 3.709 -12.963 1.937 76 H21 DG 130 1H2 G 130 1.324 -12.354 -3.156 77 H22 DG 130 2H2 G 130 2.877 -12.252 -2.341 78 H8 DG 131 8H G 131 2.582 -9.524 2.460 79 H1 DG 131 1H G 131 -1.911 -9.369 -2.118 80 H5' DG 131 H5' G 131 5.875 -11.800 1.755 81 H5'' DG 131 H5" G 131 7.386 -10.876 1.790 82 H4' DG 131 H4' G 131 6.539 -10.436 -0.341 83 H3' DG 131 H3' G 131 6.584 -8.238 1.445 84 H2' DG 131 H2' G 131 4.299 -8.098 1.680 85 H2'' DG 131 H2" G 131 4.396 -7.104 0.216 86 H1' DG 131 H1' G 131 3.870 -8.962 -1.208 87 H21 DG 131 1H2 G 131 -1.015 -8.899 -4.065 88 H22 DG 131 2H2 G 131 0.706 -8.585 -4.234 89 H5 DC 132 5H C 132 1.287 -6.331 1.652 90 H6 DC 132 6H C 132 2.819 -5.707 -0.163 91 H5' DC 132 H5' C 132 5.211 -7.608 -2.777 92 H5'' DC 132 H5" C 132 6.306 -6.406 -3.465 93 H4' DC 132 H4' C 132 4.292 -6.146 -4.687 94 H3' DC 132 H3' C 132 5.288 -4.055 -3.014 95 H2' DC 132 H2' C 132 3.616 -4.237 -1.443 96 H2'' DC 132 H2" C 132 2.751 -3.167 -2.551 97 H1' DC 132 H1' C 132 1.643 -5.038 -3.661 98 H41 DC 132 1H4 C 132 -2.322 -6.673 1.025 99 H42 DC 132 2H4 C 132 -1.009 -6.841 2.195 100 H8 DG 133 8H G 133 1.263 -1.962 -3.120 101 H1 DG 133 1H G 133 -4.893 -2.776 -1.495 102 H5' DG 133 H5' G 133 2.597 -3.263 -6.624 103 H5'' DG 133 H5" G 133 3.243 -1.928 -7.594 104 H4' DG 133 H4' G 133 0.899 -1.982 -7.987 105 H3' DG 133 H3' G 133 2.045 0.332 -6.829 106 H2' DG 133 H2' G 133 1.190 -0.108 -4.679 107 H2'' DG 133 H2" G 133 -0.210 0.783 -5.314 108 H1' DG 133 H1' G 133 -1.337 -1.275 -5.950 109 H21 DG 133 1H2 G 133 -6.206 -2.304 -3.163 110 H22 DG 133 2H2 G 133 -5.581 -1.759 -4.704 111 H5' DT 134 H5' T 134 -2.425 -0.139 -7.304 112 H5'' DT 134 H5" T 134 -2.878 1.043 -8.536 113 H4' DT 134 H4' T 134 -4.751 1.029 -7.100 114 H3' DT 134 H3' T 134 -3.043 3.345 -7.241 115 H2' DT 134 H2' T 134 -2.347 3.192 -5.056 116 H2'' DT 134 H2" T 134 -3.844 4.094 -4.800 117 H1' DT 134 H1' T 134 -5.085 2.002 -4.356 118 H3 DT 134 3H T 134 -4.218 0.344 -0.193 119 H71 DT 134 1H7 T 134 0.550 1.282 -2.540 120 H72 DT 134 2H7 T 134 0.377 2.053 -0.949 121 H73 DT 134 3H7 T 134 0.364 0.281 -1.084 122 H6 DT 134 6H T 134 -1.392 1.947 -3.731 123 H5 DC 135 5H C 135 -3.621 4.874 -2.763 124 H6 DC 135 6H C 135 -5.486 5.294 -4.276 125 H5' DC 135 H5' C 135 -7.497 3.549 -7.364 126 H5'' DC 135 H5" C 135 -8.244 4.948 -8.162 127 H4' DC 135 H4' C 135 -9.635 4.296 -6.267 128 H3' DC 135 H3' C 135 -8.566 6.908 -6.473 129 H2' DC 135 H2' C 135 -6.961 6.555 -4.858 130 H2'' DC 135 H2" C 135 -8.188 7.170 -3.789 131 H1' DC 135 H1' C 135 -9.032 4.906 -3.267 132 H41 DC 135 1H4 C 135 -4.130 3.377 0.523 133 H42 DC 135 2H4 C 135 -2.998 3.984 -0.655 134 H5' DT 136 H5' T 136 -10.980 5.307 -2.542 135 H5'' DT 136 H5" T 136 -12.353 6.319 -2.986 136 H4' DT 136 H4' T 136 -12.516 6.064 -0.668 137 H3' DT 136 H3' T 136 -12.269 8.593 -1.789 138 H2' DT 136 H2' T 136 -10.110 9.019 -1.313 139 H2'' DT 136 H2" T 136 -10.674 9.538 0.240 140 H1' DT 136 H1' T 136 -10.188 7.546 1.352 141 H3 DT 136 3H T 136 -5.838 6.351 1.750 142 H71 DT 136 1H7 T 136 -5.170 7.709 -2.825 143 H72 DT 136 2H7 T 136 -6.464 8.921 -2.973 144 H73 DT 136 3H7 T 136 -5.057 9.245 -1.932 145 H6 DT 136 6H T 136 -8.400 8.257 -1.831 146 H8 DG 137 8H G 137 -9.692 10.349 1.771 147 H1 DG 137 1H G 137 -3.780 9.287 4.014 148 H5' DG 137 H5' G 137 -12.084 7.494 2.430 149 H5'' DG 137 H5" G 137 -13.608 8.146 3.033 150 H4' DG 137 H4' G 137 -12.378 7.853 4.996 151 H3' DG 137 H3' G 137 -13.030 10.466 4.219 152 H2' DG 137 H2' G 137 -10.964 11.073 3.403 153 H2'' DG 137 H2" G 137 -10.673 11.569 5.054 154 H1' DG 137 H1' G 137 -9.461 9.559 5.571 155 H21 DG 137 1H2 G 137 -3.816 8.763 6.115 156 H22 DG 137 2H2 G 137 -5.310 8.785 7.039 157 H5 DC 138 5H C 138 -8.548 13.141 4.028 158 H6 DC 138 6H C 138 -9.162 12.352 6.260 159 H5' DC 138 H5' C 138 -10.365 9.264 7.632 160 H5'' DC 138 H5" C 138 -11.306 9.820 9.011 161 H4' DC 138 H4' C 138 -9.147 9.601 9.821 162 H3' DC 138 H3' C 138 -10.390 12.085 9.903 163 H2' DC 138 H2' C 138 -9.235 13.058 8.214 164 H2'' DC 138 H2" C 138 -8.069 13.449 9.448 165 H1' DC 138 H1' C 138 -6.620 11.665 8.908 166 H41 DC 138 1H4 C 138 -5.026 13.304 3.000 167 H42 DC 138 2H4 C 138 -6.703 13.502 2.534 168 H8 DG 139 8H G 139 -6.437 14.669 9.674 169 H1 DG 139 1H G 139 -2.172 15.851 5.037 170 H5' DG 139 H5' G 139 -6.211 11.167 11.108 171 H5'' DG 139 H5" G 139 -6.292 11.420 12.852 172 H4' DG 139 H4' G 139 -4.010 11.462 12.352 173 H3' DG 139 H3' G 139 -5.220 13.687 13.508 174 H2' DG 139 H2' G 139 -5.362 14.960 11.602 175 H2'' DG 139 H2" G 139 -3.757 15.489 12.050 176 H1' DG 139 H1' G 139 -2.687 14.034 10.541 177 H21 DG 139 1H2 G 139 -0.173 15.355 5.710 178 H22 DG 139 2H2 G 139 0.138 14.830 7.358 179 H5 DC 140 5H C 140 -4.186 17.663 10.549 180 H6 DC 140 6H C 140 -2.157 16.824 11.635 181 H5' DC 140 H5' C 140 -0.761 13.403 12.219 182 H5'' DC 140 H5" C 140 0.168 13.804 13.668 183 H4' DC 140 H4' C 140 1.541 14.178 11.714 184 H3' DC 140 H3' C 140 1.229 16.068 13.707 185 H2' DC 140 H2' C 140 -0.312 17.432 12.602 186 H2'' DC 140 H2" C 140 1.182 18.205 11.999 187 H1' DC 140 H1' C 140 1.195 16.949 9.986 188 H41 DC 140 1H4 C 140 -4.073 18.959 7.121 189 H42 DC 140 2H4 C 140 -5.059 18.574 8.514 190 H8 DG 141 8H G 141 -3.444 21.658 0.903 191 H1 DG 141 1H G 141 -1.647 18.782 6.336 192 H5' DG 141 H5' G 141 -0.816 24.557 -0.674 193 H5'' DG 141 H5" G 141 -0.978 23.841 -2.291 194 H4' DG 141 H4' G 141 0.849 22.849 -0.901 195 H3' DG 141 H3' G 141 -0.942 21.411 -2.496 196 H2' DG 141 H2' G 141 -2.221 20.585 -0.774 197 H2'' DG 141 H2" G 141 -1.000 19.299 -0.757 198 H1' DG 141 H1' G 141 0.216 20.322 1.028 199 H21 DG 141 1H2 G 141 0.455 18.285 6.295 200 H22 DG 141 2H2 G 141 1.427 18.505 4.846 201 H5 DC 142 5H C 142 -2.616 17.700 0.412 202 H6 DC 142 6H C 142 -0.253 17.299 -0.015 203 H5' DC 142 H5' C 142 2.074 19.646 0.352 204 H5'' DC 142 H5" C 142 3.296 19.189 -0.828 205 H4' DC 142 H4' C 142 3.936 18.033 0.979 206 H3' DC 142 H3' C 142 3.178 16.608 -1.261 207 H2' DC 142 H2' C 142 1.127 15.915 -0.533 208 H2'' DC 142 H2" C 142 1.988 14.604 0.170 209 H1' DC 142 H1' C 142 1.956 15.509 2.371 210 H41 DC 142 1H4 C 142 -4.115 16.850 3.646 211 H42 DC 142 2H4 C 142 -4.310 17.663 2.107 212 H8 DG 143 8H G 143 1.637 13.056 1.363 213 H1 DG 143 1H G 143 -3.698 12.499 4.838 214 H5' DG 143 H5' G 143 4.231 15.351 3.265 215 H5'' DG 143 H5" G 143 5.688 14.443 2.863 216 H4' DG 143 H4' G 143 4.943 13.601 4.955 217 H3' DG 143 H3' G 143 5.353 11.945 2.770 218 H2' DG 143 H2' G 143 3.167 11.786 2.063 219 H2'' DG 143 H2" G 143 3.084 10.413 3.103 220 H1' DG 143 H1' G 143 2.090 11.605 4.890 221 H21 DG 143 1H2 G 143 -3.250 11.630 6.768 222 H22 DG 143 2H2 G 143 -1.611 11.171 7.209 223 H5 DC 144 5H C 144 0.748 9.485 1.970 224 H6 DC 144 6H C 144 1.788 8.779 4.068 225 H5' DC 144 H5' C 144 3.031 10.991 6.446 226 H5'' DC 144 H5" C 144 4.331 10.030 7.094 227 H4' DC 144 H4' C 144 2.535 9.473 8.382 228 H3' DC 144 H3' C 144 3.777 7.423 6.970 229 H2' DC 144 H2' C 144 2.234 7.178 5.292 230 H2'' DC 144 H2" C 144 1.429 6.141 6.445 231 H1' DC 144 H1' C 144 -0.176 7.743 7.051 232 H41 DC 144 1H4 C 144 -2.899 9.746 1.683 233 H42 DC 144 2H4 C 144 -1.343 9.842 0.849 234 H8 DA 145 8H A 145 -0.225 5.052 6.031 235 H2 DA 145 2H A 145 -6.301 6.159 4.347 236 H5' DA 145 H5' A 145 0.024 7.282 9.778 237 H5'' DA 145 H5" A 145 0.171 5.891 10.869 238 H4' DA 145 H4' A 145 -2.186 6.373 10.354 239 H3' DA 145 H3' A 145 -1.006 3.813 10.166 240 H2' DA 145 H2' A 145 -0.981 3.840 7.847 241 H2'' DA 145 H2" A 145 -2.590 3.147 8.043 242 H1' DA 145 H1' A 145 -3.668 5.324 7.851 243 H61 DA 145 2H6 A 145 -1.877 5.868 1.583 244 H62 DA 145 1H6 A 145 -3.445 6.291 0.931 245 H8 DG 146 8H G 146 -3.842 1.737 7.233 246 H1 DG 146 1H G 146 -5.821 3.304 1.345 247 H5' DG 146 H5' G 146 -5.319 4.629 9.934 248 H5'' DG 146 H5" G 146 -6.547 4.427 11.155 249 H4' DG 146 H4' G 146 -7.887 3.838 9.506 250 H3' DG 146 H3' G 146 -6.771 1.349 10.364 251 H2' DG 146 H2' G 146 -5.597 0.940 8.419 252 H2'' DG 146 H2" G 146 -7.176 0.413 7.801 253 H1' DG 146 H1' G 146 -7.654 2.506 6.818 254 H21 DG 146 1H2 G 146 -7.959 3.627 1.345 255 H22 DG 146 2H2 G 146 -8.894 3.647 2.818 256 H8 DA 147 8H A 147 -6.855 -1.203 6.411 257 H2 DA 147 2H A 147 -6.527 0.304 0.198 258 H5' DA 147 H5' A 147 -10.161 1.861 7.516 259 H5'' DA 147 H5" A 147 -11.549 0.787 7.818 260 H4' DA 147 H4' A 147 -11.247 1.102 5.396 261 H3' DA 147 H3' A 147 -11.265 -1.481 6.635 262 H2' DA 147 H2' A 147 -9.055 -1.955 6.077 263 H2'' DA 147 H2" A 147 -9.774 -2.439 4.514 264 H1' DA 147 H1' A 147 -9.381 -0.250 3.559 265 H61 DA 147 2H6 A 147 -2.780 -0.590 3.740 266 H62 DA 147 1H6 A 147 -2.531 -0.304 2.021 267 H5 DC 148 5H C 148 -7.089 -3.482 3.242 268 H6 DC 148 6H C 148 -9.388 -3.381 2.393 269 H5' DC 148 H5' C 148 -12.209 -0.779 2.008 270 H5'' DC 148 H5" C 148 -13.733 -1.671 1.850 271 H4' DC 148 H4' C 148 -12.787 -1.661 -0.315 272 H3' DC 148 H3' C 148 -13.167 -4.175 0.862 273 H2' DC 148 H2' C 148 -10.922 -4.464 1.419 274 H2'' DC 148 H2" C 148 -10.863 -5.229 -0.176 275 H1' DC 148 H1' C 148 -10.166 -3.181 -1.255 276 H41 DC 148 1H4 C 148 -4.221 -3.160 0.949 277 H42 DC 148 2H4 C 148 -4.764 -3.381 2.601 278 H8 DG 149 8H G 149 -9.105 -7.048 -0.956 279 H1 DG 149 1H G 149 -2.793 -5.816 -1.173 280 H5' DG 149 H5' G 149 -10.872 -3.543 -3.036 281 H5'' DG 149 H5" G 149 -12.037 -4.199 -4.170 282 H4' DG 149 H4' G 149 -10.026 -4.387 -5.321 283 H3' DG 149 H3' G 149 -11.465 -6.690 -4.609 284 H2' DG 149 H2' G 149 -10.046 -7.365 -2.929 285 H2'' DG 149 H2" G 149 -9.248 -8.228 -4.238 286 H1' DG 149 H1' G 149 -7.635 -6.441 -4.542 287 H21 DG 149 1H2 G 149 -2.156 -5.508 -3.236 288 H22 DG 149 2H2 G 149 -3.315 -5.443 -4.551 289 H5 DC 150 5H C 150 -6.926 -9.408 -1.660 290 H6 DC 150 6H C 150 -7.102 -9.802 -4.063 291 H5' DC 150 H5' C 150 -8.128 -9.048 -5.751 292 H5'' DC 150 H5" C 150 -7.950 -7.401 -6.396 293 H4' DC 150 H4' C 150 -6.606 -8.241 -8.255 294 H3' DC 150 H3' C 150 -7.692 -10.739 -7.724 295 H2' DC 150 H2' C 150 -6.778 -11.092 -5.670 296 H2'' DC 150 H2" C 150 -5.439 -11.707 -6.600 297 H1' DC 150 H1' C 150 -4.123 -9.749 -6.346 298 H41 DC 150 1H4 C 150 -3.649 -9.346 -0.029 299 H42 DC 150 2H4 C 150 -5.382 -9.339 0.183 300 H5 DC 151 5H C 151 -5.102 -12.956 -4.340 301 H6 DC 151 6H C 151 -3.912 -12.932 -6.477 302 H5' DC 151 H5' C 151 -3.490 -10.249 -9.080 303 H5'' DC 151 H5" C 151 -3.230 -11.212 -10.549 304 H4' DC 151 H4' C 151 -1.109 -10.928 -9.511 305 H3' DC 151 H3' C 151 -2.042 -13.496 -9.961 306 H2' DC 151 H2' C 151 -2.647 -14.014 -7.776 307 H2'' DC 151 H2" C 151 -0.967 -14.527 -7.659 308 H1' DC 151 H1' C 151 -0.232 -12.444 -6.745 309 H41 DC 151 1H4 C 151 -3.286 -12.821 -1.195 310 H42 DC 151 2H4 C 151 -4.860 -12.773 -1.977 311 H5 DC 152 5H C 152 -3.120 -15.782 -4.949 312 H6 DC 152 6H C 152 -0.938 -15.894 -6.065 313 H5' DC 152 H5' C 152 1.558 -13.311 -7.377 314 H5'' DC 152 H5" C 152 2.892 -13.901 -8.365 315 H4' DC 152 H4' C 152 3.559 -14.612 -6.235 316 H3' DC 152 H3' C 152 2.640 -16.696 -7.975 317 H2' DC 152 H2' C 152 0.715 -17.168 -6.751 318 H2'' DC 152 H2" C 152 1.828 -18.194 -5.806 319 H1' DC 152 H1' C 152 2.258 -16.425 -4.197 320 H41 DC 152 1H4 C 152 -3.390 -16.255 -1.309 321 H42 DC 152 2H4 C 152 -4.234 -15.992 -2.823 322 H5 DC 153 5H C 153 -1.343 -19.591 -4.634 323 H6 DC 153 6H C 153 1.068 -19.972 -4.443 324 H5' DC 153 H5' C 153 4.627 -17.536 -4.068 325 H5'' DC 153 H5" C 153 5.956 -18.664 -4.389 326 H4' DC 153 H4' C 153 5.201 -19.129 -2.163 327 H3' DC 153 H3' C 153 4.916 -21.115 -4.274 328 H2' DC 153 H2' C 153 2.644 -21.320 -4.078 329 H2'' DC 153 H2" C 153 2.991 -22.318 -2.664 330 H1' DC 153 H1' C 153 2.776 -20.462 -1.139 331 H41 DC 153 1H4 C 153 -3.436 -19.159 -1.642 332 H42 DC 153 2H4 C 153 -3.350 -19.059 -3.393 333 H5 DC 154 5H C 154 -0.196 -22.941 -3.102 334 H6 DC 154 6H C 154 1.666 -23.486 -1.602 335 H5' DC 154 H5' C 154 4.746 -21.849 0.236 336 H5'' DC 154 H5" C 154 5.773 -23.246 0.602 337 H4' DC 154 H4' C 154 4.037 -23.104 2.261 338 H3' DC 154 H3' C 154 4.429 -25.391 0.567 339 H2' DC 154 H2' C 154 2.315 -25.470 -0.305 340 H2'' DC 154 H2" C 154 1.846 -26.074 1.320 341 H1' DC 154 H1' C 154 1.178 -23.980 2.080 342 H41 DC 154 1H4 C 154 -3.643 -22.809 -1.818 343 H42 DC 154 2H4 C 154 -2.579 -22.595 -3.195 344 H8 DG 155 8H G 155 0.553 -27.652 0.967 345 H1 DG 155 1H G 155 -5.467 -25.892 -0.348 346 H5' DG 155 H5' G 155 2.351 -25.549 4.574 347 H5'' DG 155 H5" G 155 2.800 -26.917 5.617 348 H4' DG 155 H4' G 155 0.429 -26.480 5.877 349 H3' DG 155 H3' G 155 1.474 -28.967 5.006 350 H2' DG 155 H2' G 155 0.554 -28.852 2.898 351 H2'' DG 155 H2" G 155 -0.873 -29.518 3.738 352 H1' DG 155 H1' G 155 -1.853 -27.332 4.030 353 H21 DG 155 1H2 G 155 -6.671 -25.927 1.449 354 H22 DG 155 2H2 G 155 -5.981 -26.310 3.020 355 H5 DC 156 5H C 156 -1.623 -30.612 1.174 356 H6 DC 156 6H C 156 -2.491 -30.889 3.445 357 H5' DC 156 H5' C 156 -2.625 -28.751 6.960 358 H5'' DC 156 H5" C 156 -2.946 -30.047 8.121 359 H4' DC 156 H4' C 156 -5.019 -29.403 7.041 360 H3' DC 156 H3' C 156 -3.997 -32.044 6.977 361 H2' DC 156 H2' C 156 -3.711 -32.169 4.699 362 H2'' DC 156 H2" C 156 -5.470 -32.476 4.744 363 H1' DC 156 H1' C 156 -6.066 -30.248 4.311 364 H41 DC 156 1H4 C 156 -3.777 -29.314 -1.511 365 H42 DC 156 2H4 C 156 -2.147 -29.703 -1.006 366 H8 DG 157 8H G 157 -6.444 -34.825 4.681 367 H1 DG 157 1H G 157 -6.845 -32.254 -1.167 368 H5' DG 157 H5' G 157 -8.708 -31.534 7.239 369 H5'' DG 157 H5" G 157 -9.513 -32.727 8.271 370 H4' DG 157 H4' G 157 -10.806 -32.324 6.221 371 H3' DG 157 H3' G 157 -10.214 -34.886 7.073 372 H2' DG 157 H2' G 157 -8.362 -35.211 5.643 373 H2'' DG 157 H2" G 157 -9.658 -35.870 4.592 374 H1' DG 157 H1' G 157 -9.977 -33.791 3.485 375 H21 DG 157 1H2 G 157 -8.903 -31.787 -1.607 376 H22 DG 157 2H2 G 157 -10.160 -31.942 -0.400 377 HA ALA 1 HA ALA 1 9.950 26.744 -14.845 378 H1 ALA 1 HN ALA 1 12.034 27.292 -13.679 379 HB1 ALA 1 1HB ALA 1 11.509 24.290 -15.775 380 HB2 ALA 1 2HB ALA 1 9.805 24.644 -16.142 381 HB3 ALA 1 3HB ALA 1 11.087 25.695 -16.777 382 H SER 2 HN SER 2 12.055 25.285 -12.595 383 HA SER 2 HA SER 2 10.525 23.095 -11.603 384 HG SER 2 HG SER 2 12.776 22.943 -8.947 385 HB2 SER 2 2HB SER 2 12.933 23.723 -11.061 386 HB3 SER 2 3HB SER 2 12.286 24.940 -9.946 387 H GLU 3 HN GLU 3 10.030 26.548 -11.322 388 HA GLU 3 HA GLU 3 8.471 26.644 -8.921 389 HB2 GLU 3 2HB GLU 3 7.852 28.408 -11.298 390 HB3 GLU 3 3HB GLU 3 7.821 28.779 -9.588 391 HG2 GLU 3 2HG GLU 3 9.624 30.015 -10.335 392 HG3 GLU 3 3HG GLU 3 10.424 28.576 -9.695 393 H LYS 4 HN LYS 4 7.722 25.516 -12.186 394 HA LYS 4 HA LYS 4 4.805 25.646 -11.795 395 HB2 LYS 4 2HB LYS 4 6.523 24.394 -14.012 396 HB3 LYS 4 3HB LYS 4 4.763 24.436 -13.980 397 HG2 LYS 4 2HG LYS 4 5.192 26.237 -15.316 398 HG3 LYS 4 3HG LYS 4 4.997 27.021 -13.749 399 HD2 LYS 4 2HD LYS 4 7.525 27.110 -13.558 400 HD3 LYS 4 3HD LYS 4 7.626 26.356 -15.162 401 HE2 LYS 4 2HE LYS 4 6.408 28.286 -16.122 402 HE3 LYS 4 3HE LYS 4 6.269 29.007 -14.509 403 HZ1 LYS 4 3HZ LYS 4 8.678 29.114 -14.415 404 HZ2 LYS 4 1HZ LYS 4 8.106 29.942 -15.715 405 HZ3 LYS 4 2HZ LYS 4 8.798 28.465 -15.924 406 H ARG 5 HN ARG 5 4.976 24.415 -9.718 407 HA ARG 5 HA ARG 5 5.056 21.455 -10.230 408 HE ARG 5 HE ARG 5 8.974 23.132 -8.004 409 HB2 ARG 5 2HB ARG 5 5.880 21.301 -7.828 410 HB3 ARG 5 3HB ARG 5 6.994 21.952 -9.025 411 HG2 ARG 5 2HG ARG 5 6.746 24.208 -8.208 412 HG3 ARG 5 3HG ARG 5 5.486 23.725 -7.074 413 HD2 ARG 5 2HD ARG 5 7.602 23.991 -5.917 414 HD3 ARG 5 3HD ARG 5 7.074 22.307 -5.869 415 HH11 ARG 5 1HH2 ARG 5 8.659 21.423 -4.920 416 HH12 ARG 5 2HH2 ARG 5 10.055 20.407 -5.237 417 HH21 ARG 5 1HH1 ARG 5 10.872 21.980 -8.202 418 HH22 ARG 5 2HH1 ARG 5 11.288 20.785 -6.969 419 HA PRO 6 HA PRO 6 0.721 22.314 -8.772 420 HB2 PRO 6 2HB PRO 6 0.603 19.548 -9.989 421 HB3 PRO 6 3HB PRO 6 -0.580 20.880 -10.120 422 HG2 PRO 6 2HG PRO 6 1.063 20.327 -12.182 423 HG3 PRO 6 3HG PRO 6 0.793 22.034 -11.705 424 HD2 PRO 6 2HD PRO 6 3.150 20.256 -11.026 425 HD3 PRO 6 3HD PRO 6 3.129 21.961 -11.572 426 H PHE 7 HN PHE 7 2.886 19.484 -8.481 427 HA PHE 7 HA PHE 7 2.165 19.362 -5.603 428 HD1 PHE 7 1HD PHE 7 0.507 17.531 -8.820 429 HD2 PHE 7 2HD PHE 7 0.039 16.927 -4.631 430 HE1 PHE 7 1HE PHE 7 -1.961 17.606 -9.094 431 HE2 PHE 7 2HE PHE 7 -2.376 17.171 -4.845 432 HZ PHE 7 HZ PHE 7 -3.430 17.563 -7.086 433 HB2 PHE 7 2HB PHE 7 2.398 16.926 -7.387 434 HB3 PHE 7 3HB PHE 7 2.254 16.909 -5.642 435 H MET 8 HN MET 8 3.980 18.997 -4.281 436 HA MET 8 HA MET 8 6.377 17.803 -5.623 437 HB2 MET 8 2HB MET 8 7.821 19.239 -4.228 438 HB3 MET 8 3HB MET 8 6.882 20.130 -5.424 439 HG2 MET 8 2HG MET 8 5.966 19.894 -2.538 440 HG3 MET 8 3HG MET 8 7.135 21.107 -3.039 441 HE1 MET 8 3HE MET 8 3.562 22.858 -2.382 442 HE2 MET 8 1HE MET 8 4.058 21.305 -1.680 443 HE3 MET 8 2HE MET 8 5.208 22.665 -1.729 444 H CYS 9 HN CYS 9 7.719 16.531 -4.375 445 HA CYS 9 HA CYS 9 6.489 15.182 -2.110 446 HB2 CYS 9 2HB CYS 9 8.150 14.139 -3.728 447 HB3 CYS 9 3HB CYS 9 9.421 15.121 -2.973 448 H ALA 10 HN ALA 10 7.709 14.982 0.005 449 HA ALA 10 HA ALA 10 9.127 17.413 0.888 450 HB1 ALA 10 1HB ALA 10 6.426 16.617 2.076 451 HB2 ALA 10 2HB ALA 10 7.480 17.932 2.647 452 HB3 ALA 10 3HB ALA 10 6.719 18.034 1.048 453 H TYR 11 HN TYR 11 9.246 14.237 0.725 454 HA TYR 11 HA TYR 11 9.570 13.347 3.475 455 HD1 TYR 11 1HD TYR 11 8.953 10.547 3.622 456 HD2 TYR 11 2HD TYR 11 12.814 11.116 1.800 457 HE1 TYR 11 1HE TYR 11 9.888 8.732 5.050 458 HE2 TYR 11 2HE TYR 11 13.776 9.406 3.343 459 HH TYR 11 HH TYR 11 11.904 7.391 5.516 460 HB2 TYR 11 2HB TYR 11 9.289 11.859 1.452 461 HB3 TYR 11 3HB TYR 11 10.903 12.307 0.940 462 HA PRO 12 HA PRO 12 13.209 15.424 4.762 463 HB2 PRO 12 2HB PRO 12 14.187 12.685 5.633 464 HB3 PRO 12 3HB PRO 12 14.211 14.223 6.551 465 HG2 PRO 12 2HG PRO 12 12.282 12.423 7.069 466 HG3 PRO 12 3HG PRO 12 11.826 14.146 6.867 467 HD2 PRO 12 2HD PRO 12 11.619 11.895 4.889 468 HD3 PRO 12 3HD PRO 12 10.421 13.176 5.279 469 H GLY 13 HN GLY 13 13.463 12.905 2.390 470 HA2 GLY 13 2HA GLY 13 16.256 13.774 1.723 471 HA3 GLY 13 3HA GLY 13 15.710 12.099 1.541 472 H CYS 14 HN CYS 14 13.204 14.325 0.735 473 HA CYS 14 HA CYS 14 13.976 14.392 -2.154 474 HB2 CYS 14 2HB CYS 14 12.652 12.301 -1.637 475 HB3 CYS 14 3HB CYS 14 11.301 13.342 -1.159 476 H ASN 15 HN ASN 15 12.295 15.621 -3.459 477 HA ASN 15 HA ASN 15 10.517 17.487 -2.215 478 HB2 ASN 15 2HB ASN 15 13.265 18.304 -2.056 479 HB3 ASN 15 3HB ASN 15 12.579 19.287 -3.318 480 HD21 ASN 15 1HD2 ASN 15 11.673 18.008 -0.094 481 HD22 ASN 15 2HD2 ASN 15 11.006 19.574 0.467 482 H LYS 16 HN LYS 16 10.913 15.584 -4.547 483 HA LYS 16 HA LYS 16 11.280 17.161 -6.938 484 HB2 LYS 16 2HB LYS 16 10.284 14.323 -6.474 485 HB3 LYS 16 3HB LYS 16 10.647 14.981 -8.074 486 HG2 LYS 16 2HG LYS 16 12.987 15.178 -7.590 487 HG3 LYS 16 3HG LYS 16 12.728 14.959 -5.859 488 HD2 LYS 16 2HD LYS 16 11.876 12.613 -6.345 489 HD3 LYS 16 3HD LYS 16 12.373 12.848 -8.025 490 HE2 LYS 16 2HE LYS 16 14.066 11.603 -6.784 491 HE3 LYS 16 3HE LYS 16 14.722 13.174 -7.277 492 HZ1 LYS 16 3HZ LYS 16 13.561 12.671 -4.613 493 HZ2 LYS 16 1HZ LYS 16 14.418 13.970 -5.081 494 HZ3 LYS 16 2HZ LYS 16 15.181 12.515 -4.932 495 H ARG 17 HN ARG 17 9.801 17.575 -8.605 496 HA ARG 17 HA ARG 17 7.149 18.163 -7.466 497 HE ARG 17 HE ARG 17 7.479 21.654 -11.493 498 HB2 ARG 17 2HB ARG 17 7.000 19.636 -9.554 499 HB3 ARG 17 3HB ARG 17 8.195 20.063 -8.330 500 HG2 ARG 17 2HG ARG 17 9.996 19.059 -9.726 501 HG3 ARG 17 3HG ARG 17 8.816 18.707 -10.996 502 HD2 ARG 17 2HD ARG 17 9.220 21.509 -9.889 503 HD3 ARG 17 3HD ARG 17 10.298 20.855 -11.107 504 HH11 ARG 17 1HH1 ARG 17 10.224 20.029 -12.991 505 HH12 ARG 17 2HH1 ARG 17 9.615 20.360 -14.602 506 HH21 ARG 17 1HH2 ARG 17 6.794 21.986 -13.471 507 HH22 ARG 17 2HH2 ARG 17 7.709 21.454 -14.889 508 H TYR 18 HN TYR 18 5.433 17.048 -7.949 509 HA TYR 18 HA TYR 18 5.277 15.470 -10.450 510 HD1 TYR 18 2HD TYR 18 6.046 15.149 -6.698 511 HD2 TYR 18 1HD TYR 18 4.493 12.372 -9.628 512 HE1 TYR 18 2HE TYR 18 7.958 13.655 -6.293 513 HE2 TYR 18 1HE TYR 18 6.460 10.918 -9.267 514 HH TYR 18 HH TYR 18 8.886 11.577 -6.836 515 HB2 TYR 18 2HB TYR 18 3.793 15.427 -7.818 516 HB3 TYR 18 3HB TYR 18 3.321 14.425 -9.153 517 H PHE 19 HN PHE 19 2.966 15.313 -11.326 518 HA PHE 19 HA PHE 19 1.801 18.076 -11.392 519 HD1 PHE 19 2HD PHE 19 2.686 19.540 -13.643 520 HD2 PHE 19 1HD PHE 19 4.159 15.487 -13.768 521 HE1 PHE 19 2HE PHE 19 4.947 20.379 -14.190 522 HE2 PHE 19 1HE PHE 19 6.422 16.336 -14.329 523 HZ PHE 19 HZ PHE 19 6.822 18.775 -14.535 524 HB2 PHE 19 2HB PHE 19 1.767 15.917 -13.548 525 HB3 PHE 19 3HB PHE 19 1.122 17.554 -13.694 526 H LYS 20 HN LYS 20 1.194 14.836 -10.419 527 HA LYS 20 HA LYS 20 -1.760 15.363 -10.378 528 HB2 LYS 20 2HB LYS 20 -0.289 13.223 -11.706 529 HB3 LYS 20 3HB LYS 20 -1.256 12.542 -10.395 530 HG2 LYS 20 2HG LYS 20 -2.469 12.507 -12.497 531 HG3 LYS 20 3HG LYS 20 -3.289 13.478 -11.278 532 HD2 LYS 20 2HD LYS 20 -3.405 14.483 -13.536 533 HD3 LYS 20 3HD LYS 20 -2.626 15.544 -12.373 534 HE2 LYS 20 2HE LYS 20 -0.383 14.682 -13.247 535 HE3 LYS 20 3HE LYS 20 -1.287 13.873 -14.541 536 HZ1 LYS 20 3HZ LYS 20 -0.508 16.043 -15.211 537 HZ2 LYS 20 1HZ LYS 20 -1.287 16.759 -13.945 538 HZ3 LYS 20 2HZ LYS 20 -2.156 16.047 -15.151 539 H LEU 21 HN LEU 21 -2.892 14.780 -8.602 540 HA LEU 21 HA LEU 21 -1.542 14.677 -6.121 541 HG LEU 21 HG LEU 21 -2.856 14.995 -4.327 542 HB2 LEU 21 2HB LEU 21 -3.978 15.341 -6.774 543 HB3 LEU 21 3HB LEU 21 -4.387 13.669 -6.574 544 HD11 LEU 21 1HD1 LEU 21 -5.815 15.460 -4.871 545 HD12 LEU 21 2HD1 LEU 21 -4.557 16.697 -5.028 546 HD13 LEU 21 3HD1 LEU 21 -4.909 15.995 -3.446 547 HD21 LEU 21 3HD2 LEU 21 -4.328 13.624 -2.927 548 HD22 LEU 21 1HD2 LEU 21 -3.523 12.615 -4.140 549 HD23 LEU 21 2HD2 LEU 21 -5.223 13.077 -4.357 550 H SER 22 HN SER 22 -3.378 12.083 -7.828 551 HA SER 22 HA SER 22 -2.674 10.060 -5.942 552 HG SER 22 HG SER 22 -4.408 9.561 -9.583 553 HB2 SER 22 2HB SER 22 -3.487 8.508 -7.788 554 HB3 SER 22 3HB SER 22 -4.630 9.759 -7.265 555 H HIS 23 HN HIS 23 -1.165 11.125 -8.983 556 HA HIS 23 HA HIS 23 0.599 8.806 -9.172 557 HD1 HIS 23 1HD HIS 23 2.463 10.580 -12.865 558 HD2 HIS 23 2HD HIS 23 1.654 13.067 -9.608 559 HE1 HIS 23 1HE HIS 23 3.672 12.785 -13.318 560 HB2 HIS 23 2HB HIS 23 0.970 9.555 -11.164 561 HB3 HIS 23 3HB HIS 23 -0.205 10.767 -10.960 562 H LEU 24 HN LEU 24 0.592 11.868 -7.513 563 HA LEU 24 HA LEU 24 3.464 11.776 -6.795 564 HG LEU 24 HG LEU 24 3.629 14.935 -5.752 565 HB2 LEU 24 2HB LEU 24 2.237 13.916 -7.055 566 HB3 LEU 24 3HB LEU 24 1.202 13.470 -5.742 567 HD11 LEU 24 1HD1 LEU 24 1.466 15.264 -4.486 568 HD12 LEU 24 2HD1 LEU 24 2.971 15.571 -3.586 569 HD13 LEU 24 3HD1 LEU 24 2.063 14.070 -3.336 570 HD21 LEU 24 3HD2 LEU 24 4.841 12.713 -5.346 571 HD22 LEU 24 1HD2 LEU 24 4.074 12.763 -3.726 572 HD23 LEU 24 2HD2 LEU 24 5.131 14.057 -4.242 573 H GLN 25 HN GLN 25 0.212 11.030 -5.394 574 HA GLN 25 HA GLN 25 1.113 10.156 -2.819 575 HB2 GLN 25 2HB GLN 25 -1.296 9.411 -4.516 576 HB3 GLN 25 3HB GLN 25 -0.997 8.660 -2.968 577 HG2 GLN 25 2HG GLN 25 -1.348 11.647 -3.373 578 HG3 GLN 25 3HG GLN 25 -2.579 10.533 -2.787 579 HE21 GLN 25 1HE2 GLN 25 -1.617 12.912 -1.443 580 HE22 GLN 25 2HE2 GLN 25 -0.902 12.372 0.067 581 H MET 26 HN MET 26 0.861 8.446 -5.972 582 HA MET 26 HA MET 26 1.668 5.869 -5.026 583 HB2 MET 26 2HB MET 26 2.047 7.191 -7.759 584 HB3 MET 26 3HB MET 26 2.408 5.516 -7.381 585 HG2 MET 26 2HG MET 26 -0.261 6.805 -7.731 586 HG3 MET 26 3HG MET 26 0.375 5.316 -8.342 587 HE1 MET 26 3HE MET 26 -2.290 5.814 -4.683 588 HE2 MET 26 1HE MET 26 -0.860 6.847 -4.675 589 HE3 MET 26 2HE MET 26 -2.020 6.944 -6.023 590 H HIS 27 HN HIS 27 3.575 8.678 -6.324 591 HA HIS 27 HA HIS 27 6.171 7.534 -5.969 592 HD1 HIS 27 1HD HIS 27 8.620 8.626 -6.043 593 HD2 HIS 27 2HD HIS 27 6.658 11.879 -4.222 594 HE1 HIS 27 1HE HIS 27 10.340 9.808 -4.526 595 HB2 HIS 27 2HB HIS 27 6.036 9.608 -7.128 596 HB3 HIS 27 3HB HIS 27 5.164 10.420 -5.837 597 H SER 28 HN SER 28 4.084 9.348 -3.687 598 HA SER 28 HA SER 28 5.790 9.468 -1.524 599 HG SER 28 HG SER 28 3.405 10.760 -2.827 600 HB2 SER 28 2HB SER 28 2.780 8.983 -1.313 601 HB3 SER 28 3HB SER 28 3.829 9.780 -0.157 602 H ARG 29 HN ARG 29 3.874 6.665 -2.667 603 HA ARG 29 HA ARG 29 3.956 5.105 -0.269 604 HE ARG 29 HE ARG 29 3.765 -0.235 -1.603 605 HB2 ARG 29 2HB ARG 29 2.690 4.655 -2.441 606 HB3 ARG 29 3HB ARG 29 4.181 3.994 -3.106 607 HG2 ARG 29 2HG ARG 29 2.867 2.969 -0.537 608 HG3 ARG 29 3HG ARG 29 2.491 2.372 -2.153 609 HD2 ARG 29 2HD ARG 29 4.797 1.614 -2.477 610 HD3 ARG 29 3HD ARG 29 5.226 2.134 -0.855 611 HH11 ARG 29 1HH2 ARG 29 4.457 1.827 1.245 612 HH12 ARG 29 2HH2 ARG 29 4.522 0.440 2.290 613 HH21 ARG 29 1HH1 ARG 29 3.816 -1.872 -0.189 614 HH22 ARG 29 2HH1 ARG 29 4.244 -1.601 1.484 615 H LYS 30 HN LYS 30 6.392 5.642 -2.848 616 HA LYS 30 HA LYS 30 8.292 3.615 -2.065 617 HB2 LYS 30 2HB LYS 30 8.286 5.048 -4.152 618 HB3 LYS 30 3HB LYS 30 8.885 6.393 -3.201 619 HG2 LYS 30 2HG LYS 30 10.351 3.726 -3.365 620 HG3 LYS 30 3HG LYS 30 10.503 4.945 -4.617 621 HD2 LYS 30 2HD LYS 30 11.400 5.255 -1.730 622 HD3 LYS 30 3HD LYS 30 12.394 5.075 -3.166 623 HE2 LYS 30 2HE LYS 30 11.323 7.241 -4.037 624 HE3 LYS 30 3HE LYS 30 10.662 7.453 -2.402 625 HZ1 LYS 30 3HZ LYS 30 12.717 8.589 -2.572 626 HZ2 LYS 30 1HZ LYS 30 13.508 7.257 -3.141 627 HZ3 LYS 30 2HZ LYS 30 12.961 7.274 -1.593 628 H HIS 31 HN HIS 31 7.574 6.874 -0.849 629 HA HIS 31 HA HIS 31 9.861 6.907 0.983 630 HD1 HIS 31 1HD HIS 31 11.443 8.559 0.755 631 HD2 HIS 31 2HD HIS 31 8.377 10.621 -1.302 632 HE1 HIS 31 1HE HIS 31 12.575 10.132 -0.863 633 HB2 HIS 31 2HB HIS 31 7.533 8.793 0.447 634 HB3 HIS 31 3HB HIS 31 8.584 8.989 1.830 635 H THR 32 HN THR 32 6.739 5.406 1.080 636 HA THR 32 HA THR 32 6.342 5.792 4.006 637 HB THR 32 HB THR 32 4.445 4.308 3.769 638 HG1 THR 32 1HG THR 32 5.316 3.954 1.102 639 HG21 THR 32 3HG2 THR 32 4.276 6.446 1.632 640 HG22 THR 32 1HG2 THR 32 3.954 6.640 3.362 641 HG23 THR 32 2HG2 THR 32 2.917 5.589 2.380 642 H GLY 33 HN GLY 33 7.510 3.536 1.500 643 HA2 GLY 33 2HA GLY 33 8.045 1.319 3.289 644 HA3 GLY 33 3HA GLY 33 8.751 1.585 1.683 645 H GLU 34 HN GLU 34 9.584 4.397 2.719 646 HA GLU 34 HA GLU 34 12.157 3.598 3.930 647 HB2 GLU 34 2HB GLU 34 11.042 6.318 3.043 648 HB3 GLU 34 3HB GLU 34 12.642 6.063 3.780 649 HG2 GLU 34 2HG GLU 34 13.335 4.538 2.066 650 HG3 GLU 34 3HG GLU 34 11.757 4.574 1.292 651 H LYS 35 HN LYS 35 9.216 3.646 5.202 652 HA LYS 35 HA LYS 35 10.328 4.191 7.881 653 HB2 LYS 35 2HB LYS 35 9.126 6.304 7.107 654 HB3 LYS 35 3HB LYS 35 7.628 5.382 7.071 655 HG2 LYS 35 2HG LYS 35 7.979 4.884 9.555 656 HG3 LYS 35 3HG LYS 35 9.455 5.849 9.481 657 HD2 LYS 35 2HD LYS 35 7.769 7.252 10.402 658 HD3 LYS 35 3HD LYS 35 8.048 7.829 8.751 659 HE2 LYS 35 2HE LYS 35 6.031 6.558 7.996 660 HE3 LYS 35 3HE LYS 35 5.781 5.991 9.652 661 HZ1 LYS 35 3HZ LYS 35 5.528 8.292 10.328 662 HZ2 LYS 35 1HZ LYS 35 4.407 7.870 9.197 663 HZ3 LYS 35 2HZ LYS 35 5.709 8.799 8.768 664 HA PRO 36 HA PRO 36 7.610 0.435 7.261 665 HB2 PRO 36 2HB PRO 36 9.419 -1.590 7.491 666 HB3 PRO 36 3HB PRO 36 9.374 -0.544 6.041 667 HG2 PRO 36 2HG PRO 36 11.180 -0.258 8.476 668 HG3 PRO 36 3HG PRO 36 11.662 -0.304 6.749 669 HD2 PRO 36 2HD PRO 36 11.273 2.045 8.139 670 HD3 PRO 36 3HD PRO 36 10.935 1.883 6.389 671 H TYR 37 HN TYR 37 7.369 -1.677 8.698 672 HA TYR 37 HA TYR 37 7.917 -0.997 11.594 673 HD1 TYR 37 1HD TYR 37 6.187 0.962 12.516 674 HD2 TYR 37 2HD TYR 37 4.543 -0.657 8.875 675 HE1 TYR 37 1HE TYR 37 5.976 3.263 11.596 676 HE2 TYR 37 2HE TYR 37 4.325 1.670 7.960 677 HH TYR 37 HH TYR 37 6.100 3.562 8.491 678 HB2 TYR 37 2HB TYR 37 5.254 -2.088 10.584 679 HB3 TYR 37 3HB TYR 37 5.681 -1.455 12.192 680 H GLN 38 HN GLN 38 9.175 -2.616 12.363 681 HA GLN 38 HA GLN 38 8.760 -5.411 11.515 682 HB2 GLN 38 2HB GLN 38 11.030 -4.371 11.951 683 HB3 GLN 38 3HB GLN 38 10.606 -4.262 13.651 684 HG2 GLN 38 2HG GLN 38 10.438 -6.720 13.807 685 HG3 GLN 38 3HG GLN 38 10.760 -6.870 12.073 686 HE21 GLN 38 1HE2 GLN 38 12.350 -7.318 15.016 687 HE22 GLN 38 2HE2 GLN 38 13.930 -6.827 14.409 688 H CYS 39 HN CYS 39 7.665 -6.948 12.606 689 HA CYS 39 HA CYS 39 5.908 -6.351 14.744 690 HB2 CYS 39 2HB CYS 39 5.686 -8.338 13.243 691 HB3 CYS 39 3HB CYS 39 7.107 -9.064 14.025 692 H ASP 40 HN ASP 40 6.065 -6.291 16.926 693 HA ASP 40 HA ASP 40 8.755 -6.494 18.123 694 HB2 ASP 40 2HB ASP 40 7.226 -4.577 18.615 695 HB3 ASP 40 3HB ASP 40 6.078 -5.699 19.354 696 H PHE 41 HN PHE 41 6.267 -8.680 17.492 697 HA PHE 41 HA PHE 41 6.227 -10.202 19.961 698 HD1 PHE 41 1HD PHE 41 3.651 -11.191 20.182 699 HD2 PHE 41 2HD PHE 41 5.806 -13.565 17.308 700 HE1 PHE 41 1HE PHE 41 2.480 -13.231 20.989 701 HE2 PHE 41 2HE PHE 41 4.611 -15.594 18.091 702 HZ PHE 41 HZ PHE 41 2.962 -15.435 19.941 703 HB2 PHE 41 2HB PHE 41 4.594 -10.297 17.998 704 HB3 PHE 41 3HB PHE 41 5.791 -11.213 17.129 705 H LYS 42 HN LYS 42 7.947 -11.179 20.842 706 HA LYS 42 HA LYS 42 10.481 -11.212 19.615 707 HB2 LYS 42 2HB LYS 42 9.435 -12.789 22.001 708 HB3 LYS 42 3HB LYS 42 11.137 -12.704 21.560 709 HG2 LYS 42 2HG LYS 42 9.407 -10.309 22.343 710 HG3 LYS 42 3HG LYS 42 10.568 -11.148 23.361 711 HD2 LYS 42 2HD LYS 42 12.015 -9.539 22.708 712 HD3 LYS 42 3HD LYS 42 12.219 -10.548 21.285 713 HE2 LYS 42 2HE LYS 42 11.893 -8.384 20.419 714 HE3 LYS 42 3HE LYS 42 10.321 -9.149 20.208 715 HZ1 LYS 42 3HZ LYS 42 10.143 -6.938 21.131 716 HZ2 LYS 42 1HZ LYS 42 11.046 -7.360 22.449 717 HZ3 LYS 42 2HZ LYS 42 9.561 -8.045 22.177 718 H ASP 43 HN ASP 43 7.926 -13.476 19.141 719 HA ASP 43 HA ASP 43 9.816 -15.570 18.148 720 HB2 ASP 43 2HB ASP 43 6.811 -15.714 18.597 721 HB3 ASP 43 3HB ASP 43 7.849 -17.054 18.126 722 H CYS 44 HN CYS 44 8.654 -12.826 16.918 723 HA CYS 44 HA CYS 44 8.000 -14.021 14.248 724 HB2 CYS 44 2HB CYS 44 6.065 -12.884 15.183 725 HB3 CYS 44 3HB CYS 44 7.007 -11.418 15.491 726 H GLU 45 HN GLU 45 8.595 -10.565 14.971 727 HA GLU 45 HA GLU 45 10.321 -9.141 14.469 728 HB2 GLU 45 2HB GLU 45 12.133 -11.591 14.083 729 HB3 GLU 45 3HB GLU 45 12.623 -9.933 14.261 730 HG2 GLU 45 2HG GLU 45 11.218 -11.551 16.428 731 HG3 GLU 45 3HG GLU 45 12.941 -11.238 16.316 732 H ARG 46 HN ARG 46 8.475 -10.424 12.433 733 HA ARG 46 HA ARG 46 10.071 -10.186 9.926 734 HE ARG 46 HE ARG 46 7.814 -12.864 11.954 735 HB2 ARG 46 2HB ARG 46 7.227 -10.992 10.589 736 HB3 ARG 46 3HB ARG 46 7.535 -10.263 9.035 737 HG2 ARG 46 2HG ARG 46 7.684 -12.606 8.713 738 HG3 ARG 46 3HG ARG 46 9.290 -11.914 8.515 739 HD2 ARG 46 2HD ARG 46 9.446 -14.017 9.737 740 HD3 ARG 46 3HD ARG 46 9.895 -12.690 10.809 741 HH11 ARG 46 1HH1 ARG 46 7.994 -15.475 9.598 742 HH12 ARG 46 2HH1 ARG 46 6.576 -16.250 10.289 743 HH21 ARG 46 1HH2 ARG 46 6.160 -13.765 12.674 744 HH22 ARG 46 2HH2 ARG 46 5.520 -15.307 12.063 745 H ARG 47 HN ARG 47 9.485 -8.586 8.299 746 HA ARG 47 HA ARG 47 8.735 -6.001 9.598 747 HE ARG 47 HE ARG 47 13.292 -5.506 10.642 748 HB2 ARG 47 2HB ARG 47 10.567 -6.615 7.232 749 HB3 ARG 47 3HB ARG 47 10.088 -4.982 7.728 750 HG2 ARG 47 2HG ARG 47 11.015 -5.406 9.985 751 HG3 ARG 47 3HG ARG 47 11.604 -6.988 9.456 752 HD2 ARG 47 2HD ARG 47 13.084 -5.925 7.818 753 HD3 ARG 47 3HD ARG 47 12.425 -4.321 8.230 754 HH11 ARG 47 1HH2 ARG 47 14.941 -4.281 7.780 755 HH12 ARG 47 2HH2 ARG 47 16.384 -3.939 8.717 756 HH21 ARG 47 1HH1 ARG 47 14.975 -5.064 11.679 757 HH22 ARG 47 2HH1 ARG 47 16.429 -4.378 10.936 758 H PHE 48 HN PHE 48 7.311 -4.619 8.664 759 HA PHE 48 HA PHE 48 6.000 -5.497 6.122 760 HD1 PHE 48 1HD PHE 48 3.320 -6.917 6.338 761 HD2 PHE 48 2HD PHE 48 5.537 -6.307 9.983 762 HE1 PHE 48 1HE PHE 48 3.129 -9.323 6.867 763 HE2 PHE 48 2HE PHE 48 5.325 -8.722 10.523 764 HZ PHE 48 HZ PHE 48 4.205 -10.239 8.905 765 HB2 PHE 48 2HB PHE 48 4.700 -4.364 8.627 766 HB3 PHE 48 3HB PHE 48 3.861 -4.647 7.102 767 H SER 49 HN SER 49 5.581 -3.881 4.659 768 HA SER 49 HA SER 49 6.964 -1.338 5.227 769 HG SER 49 HG SER 49 5.978 -3.236 1.837 770 HB2 SER 49 2HB SER 49 6.605 -0.974 2.742 771 HB3 SER 49 3HB SER 49 7.475 -2.465 3.145 772 H ARG 50 HN ARG 50 3.993 -2.258 6.062 773 HA ARG 50 HA ARG 50 3.026 0.513 5.965 774 HE ARG 50 HE ARG 50 -0.751 -1.613 3.140 775 HB2 ARG 50 2HB ARG 50 1.384 -1.787 4.832 776 HB3 ARG 50 3HB ARG 50 0.722 -0.224 5.310 777 HG2 ARG 50 2HG ARG 50 2.300 0.848 3.624 778 HG3 ARG 50 3HG ARG 50 2.594 -0.790 3.005 779 HD2 ARG 50 2HD ARG 50 -0.109 0.615 3.196 780 HD3 ARG 50 3HD ARG 50 0.834 0.422 1.725 781 HH11 ARG 50 1HH1 ARG 50 1.616 -1.142 0.571 782 HH12 ARG 50 2HH1 ARG 50 0.852 -2.416 -0.387 783 HH21 ARG 50 1HH2 ARG 50 -1.369 -3.392 1.968 784 HH22 ARG 50 2HH2 ARG 50 -0.615 -3.728 0.454 785 H SER 51 HN SER 51 1.739 1.032 7.720 786 HA SER 51 HA SER 51 1.962 -0.539 10.058 787 HG SER 51 HG SER 51 2.524 1.915 10.308 788 HB2 SER 51 2HB SER 51 -0.186 1.550 9.509 789 HB3 SER 51 3HB SER 51 0.485 1.075 11.080 790 H ASP 52 HN ASP 52 -0.851 -0.104 7.832 791 HA ASP 52 HA ASP 52 -2.655 -1.773 9.188 792 HB2 ASP 52 2HB ASP 52 -3.964 -1.722 7.271 793 HB3 ASP 52 3HB ASP 52 -3.037 -0.235 7.152 794 H GLN 53 HN GLN 53 -0.002 -2.646 6.971 795 HA GLN 53 HA GLN 53 -0.874 -5.382 6.594 796 HB2 GLN 53 2HB GLN 53 1.785 -3.964 6.107 797 HB3 GLN 53 3HB GLN 53 1.507 -5.672 5.753 798 HG2 GLN 53 2HG GLN 53 -0.136 -3.383 4.587 799 HG3 GLN 53 3HG GLN 53 1.157 -4.253 3.755 800 HE21 GLN 53 1HE2 GLN 53 -2.273 -4.244 4.425 801 HE22 GLN 53 2HE2 GLN 53 -2.522 -5.863 3.760 802 H LEU 54 HN LEU 54 1.495 -3.735 8.749 803 HA LEU 54 HA LEU 54 2.321 -6.104 10.165 804 HG LEU 54 HG LEU 54 2.326 -4.671 13.063 805 HB2 LEU 54 2HB LEU 54 3.501 -3.929 10.358 806 HB3 LEU 54 3HB LEU 54 2.087 -3.202 11.097 807 HD11 LEU 54 1HD1 LEU 54 3.556 -6.594 11.869 808 HD12 LEU 54 2HD1 LEU 54 4.195 -6.111 13.442 809 HD13 LEU 54 3HD1 LEU 54 5.009 -5.604 11.963 810 HD21 LEU 54 3HD2 LEU 54 4.212 -3.613 14.045 811 HD22 LEU 54 1HD2 LEU 54 3.602 -2.453 12.849 812 HD23 LEU 54 2HD2 LEU 54 5.042 -3.467 12.503 813 H LYS 55 HN LYS 55 -0.351 -3.719 10.751 814 HA LYS 55 HA LYS 55 -1.433 -4.926 13.086 815 HB2 LYS 55 2HB LYS 55 -2.019 -2.669 12.113 816 HB3 LYS 55 3HB LYS 55 -2.982 -3.490 10.882 817 HG2 LYS 55 2HG LYS 55 -4.326 -4.542 12.781 818 HG3 LYS 55 3HG LYS 55 -3.447 -3.492 13.895 819 HD2 LYS 55 2HD LYS 55 -5.201 -2.583 11.561 820 HD3 LYS 55 3HD LYS 55 -5.685 -2.624 13.260 821 HE2 LYS 55 2HE LYS 55 -3.883 -0.983 13.805 822 HE3 LYS 55 3HE LYS 55 -3.466 -0.896 12.085 823 HZ1 LYS 55 3HZ LYS 55 -5.727 -0.148 11.662 824 HZ2 LYS 55 1HZ LYS 55 -4.943 0.877 12.684 825 HZ3 LYS 55 2HZ LYS 55 -6.067 -0.175 13.271 826 H ARG 56 HN ARG 56 -2.233 -5.520 9.616 827 HA ARG 56 HA ARG 56 -4.231 -7.521 10.035 828 HE ARG 56 HE ARG 56 -1.865 -8.921 6.132 829 HB2 ARG 56 2HB ARG 56 -3.662 -6.372 7.865 830 HB3 ARG 56 3HB ARG 56 -2.188 -7.328 7.771 831 HG2 ARG 56 2HG ARG 56 -3.657 -9.416 7.716 832 HG3 ARG 56 3HG ARG 56 -5.056 -8.334 7.687 833 HD2 ARG 56 2HD ARG 56 -4.664 -8.850 5.414 834 HD3 ARG 56 3HD ARG 56 -3.999 -7.225 5.617 835 HH11 ARG 56 1HH1 ARG 56 -3.828 -8.362 3.204 836 HH12 ARG 56 2HH1 ARG 56 -2.533 -9.022 2.212 837 HH21 ARG 56 1HH2 ARG 56 -0.371 -9.665 4.770 838 HH22 ARG 56 2HH2 ARG 56 -0.635 -9.677 3.051 839 H HIS 57 HN HIS 57 -0.676 -7.758 9.625 840 HA HIS 57 HA HIS 57 -0.484 -10.579 9.808 841 HD1 HIS 57 1HD HIS 57 2.614 -11.921 10.254 842 HD2 HIS 57 2HD HIS 57 2.461 -8.295 12.399 843 HE1 HIS 57 1HE HIS 57 4.105 -12.198 12.309 844 HB2 HIS 57 2HB HIS 57 1.439 -9.615 9.044 845 HB3 HIS 57 3HB HIS 57 1.357 -8.237 10.121 846 H GLN 58 HN GLN 58 -0.523 -8.065 12.408 847 HA GLN 58 HA GLN 58 0.134 -9.659 14.644 848 HB2 GLN 58 2HB GLN 58 -1.817 -7.315 14.427 849 HB3 GLN 58 3HB GLN 58 -1.445 -8.123 15.924 850 HG2 GLN 58 2HG GLN 58 0.484 -6.532 14.233 851 HG3 GLN 58 3HG GLN 58 -0.066 -6.214 15.863 852 HE21 GLN 58 1HE2 GLN 58 2.615 -7.196 14.215 853 HE22 GLN 58 2HE2 GLN 58 3.352 -8.249 15.392 854 H ARG 59 HN ARG 59 -2.810 -9.740 12.678 855 HA ARG 59 HA ARG 59 -4.649 -10.817 14.536 856 HE ARG 59 HE ARG 59 -6.843 -7.599 11.835 857 HB2 ARG 59 2HB ARG 59 -4.387 -11.390 11.552 858 HB3 ARG 59 3HB ARG 59 -5.768 -11.828 12.553 859 HG2 ARG 59 2HG ARG 59 -6.142 -9.483 13.208 860 HG3 ARG 59 3HG ARG 59 -4.773 -8.960 12.244 861 HD2 ARG 59 2HD ARG 59 -5.910 -9.824 10.199 862 HD3 ARG 59 3HD ARG 59 -7.332 -10.218 11.194 863 HH11 ARG 59 1HH2 ARG 59 -7.463 -9.147 8.734 864 HH12 ARG 59 2HH2 ARG 59 -7.760 -7.593 7.956 865 HH21 ARG 59 1HH1 ARG 59 -7.404 -5.726 10.813 866 HH22 ARG 59 2HH1 ARG 59 -7.822 -5.750 9.118 867 H ARG 60 HN ARG 60 -1.944 -12.406 12.823 868 HA ARG 60 HA ARG 60 -2.774 -15.143 13.415 869 HE ARG 60 HE ARG 60 -1.358 -12.559 9.388 870 HB2 ARG 60 2HB ARG 60 0.122 -14.352 13.096 871 HB3 ARG 60 3HB ARG 60 -0.696 -15.817 12.614 872 HG2 ARG 60 2HG ARG 60 -0.340 -13.255 11.168 873 HG3 ARG 60 3HG ARG 60 -0.130 -14.881 10.643 874 HD2 ARG 60 2HD ARG 60 -2.481 -15.148 10.259 875 HD3 ARG 60 3HD ARG 60 -2.923 -13.758 11.162 876 HH11 ARG 60 1HH2 ARG 60 -4.117 -14.695 8.753 877 HH12 ARG 60 2HH2 ARG 60 -4.340 -13.979 7.173 878 HH21 ARG 60 1HH1 ARG 60 -1.595 -11.945 7.357 879 HH22 ARG 60 2HH1 ARG 60 -2.931 -12.538 6.390 880 H HIS 61 HN HIS 61 -0.984 -12.632 15.182 881 HA HIS 61 HA HIS 61 -0.066 -14.548 17.252 882 HD1 HIS 61 1HD HIS 61 2.088 -14.823 16.313 883 HD2 HIS 61 2HD HIS 61 2.440 -10.642 15.894 884 HE1 HIS 61 1HE HIS 61 4.145 -14.383 14.840 885 HB2 HIS 61 2HB HIS 61 0.204 -11.514 17.049 886 HB3 HIS 61 3HB HIS 61 0.961 -12.527 18.274 887 H THR 62 HN THR 62 -2.954 -12.993 16.563 888 HA THR 62 HA THR 62 -3.685 -12.750 19.466 889 HB THR 62 HB THR 62 -5.266 -10.914 18.704 890 HG1 THR 62 1HG THR 62 -3.603 -10.858 16.442 891 HG21 THR 62 3HG2 THR 62 -2.307 -10.399 18.052 892 HG22 THR 62 1HG2 THR 62 -3.058 -10.272 19.649 893 HG23 THR 62 2HG2 THR 62 -3.550 -9.167 18.356 894 H GLY 63 HN GLY 63 -4.215 -14.550 16.693 895 HA2 GLY 63 2HA GLY 63 -5.796 -16.147 16.165 896 HA3 GLY 63 3HA GLY 63 -6.268 -16.047 17.870 897 H VAL 64 HN VAL 64 -6.640 -13.102 16.035 898 HA VAL 64 HA VAL 64 -9.563 -13.331 16.404 899 HB VAL 64 HB VAL 64 -8.240 -11.353 17.159 900 HG11 VAL 64 1HG1 VAL 64 -8.062 -10.505 14.248 901 HG12 VAL 64 2HG1 VAL 64 -7.484 -9.633 15.681 902 HG13 VAL 64 3HG1 VAL 64 -6.708 -11.146 15.199 903 HG21 VAL 64 3HG2 VAL 64 -10.678 -11.230 16.801 904 HG22 VAL 64 1HG2 VAL 64 -9.865 -9.683 16.524 905 HG23 VAL 64 2HG2 VAL 64 -10.402 -10.648 15.140 906 H LYS 65 HN LYS 65 -11.112 -13.272 14.825 907 HA LYS 65 HA LYS 65 -10.244 -12.979 11.980 908 HB2 LYS 65 2HB LYS 65 -12.221 -15.068 13.038 909 HB3 LYS 65 3HB LYS 65 -11.906 -14.730 11.353 910 HG2 LYS 65 2HG LYS 65 -10.512 -16.504 11.543 911 HG3 LYS 65 3HG LYS 65 -9.369 -15.270 12.084 912 HD2 LYS 65 2HD LYS 65 -10.118 -15.801 14.482 913 HD3 LYS 65 3HD LYS 65 -11.057 -17.141 13.812 914 HE2 LYS 65 2HE LYS 65 -8.994 -18.141 12.899 915 HE3 LYS 65 3HE LYS 65 -8.055 -16.751 13.477 916 HZ1 LYS 65 3HZ LYS 65 -7.906 -18.575 15.013 917 HZ2 LYS 65 1HZ LYS 65 -9.545 -18.629 15.187 918 HZ3 LYS 65 2HZ LYS 65 -8.706 -17.312 15.715 919 HA PRO 66 HA PRO 66 -13.521 -10.068 13.236 920 HB2 PRO 66 2HB PRO 66 -12.738 -7.898 11.725 921 HB3 PRO 66 3HB PRO 66 -11.932 -8.395 13.237 922 HG2 PRO 66 2HG PRO 66 -11.098 -9.019 10.397 923 HG3 PRO 66 3HG PRO 66 -10.083 -8.404 11.739 924 HD2 PRO 66 2HD PRO 66 -10.183 -11.022 11.078 925 HD3 PRO 66 3HD PRO 66 -10.023 -10.515 12.783 926 H PHE 67 HN PHE 67 -12.775 -11.264 9.996 927 HA PHE 67 HA PHE 67 -15.166 -9.952 8.780 928 HD1 PHE 67 2HD PHE 67 -14.392 -8.722 6.298 929 HD2 PHE 67 1HD PHE 67 -11.152 -10.780 8.250 930 HE1 PHE 67 2HE PHE 67 -12.942 -6.733 5.987 931 HE2 PHE 67 1HE PHE 67 -9.702 -8.822 7.902 932 HZ PHE 67 HZ PHE 67 -10.586 -6.775 6.774 933 HB2 PHE 67 2HB PHE 67 -13.202 -11.991 7.624 934 HB3 PHE 67 3HB PHE 67 -14.440 -11.139 6.748 935 H GLN 68 HN GLN 68 -17.108 -10.975 8.318 936 HA GLN 68 HA GLN 68 -17.349 -13.865 9.101 937 HB2 GLN 68 2HB GLN 68 -18.320 -12.357 10.875 938 HB3 GLN 68 3HB GLN 68 -19.453 -11.716 9.687 939 HG2 GLN 68 2HG GLN 68 -20.479 -13.925 9.416 940 HG3 GLN 68 3HG GLN 68 -19.246 -14.664 10.445 941 HE21 GLN 68 1HE2 GLN 68 -22.532 -13.818 10.580 942 HE22 GLN 68 2HE2 GLN 68 -22.467 -13.386 12.291 943 H CYS 69 HN CYS 69 -18.477 -15.130 7.674 944 HA CYS 69 HA CYS 69 -19.173 -14.140 5.076 945 HB2 CYS 69 2HB CYS 69 -18.618 -16.521 5.505 946 HB3 CYS 69 3HB CYS 69 -20.078 -16.692 6.486 947 H LYS 70 HN LYS 70 -21.259 -13.991 4.083 948 HA LYS 70 HA LYS 70 -23.273 -12.759 5.911 949 HB2 LYS 70 2HB LYS 70 -22.917 -12.745 2.878 950 HB3 LYS 70 3HB LYS 70 -24.370 -12.152 3.674 951 HG2 LYS 70 2HG LYS 70 -22.989 -10.292 3.148 952 HG3 LYS 70 3HG LYS 70 -23.091 -10.452 4.898 953 HD2 LYS 70 2HD LYS 70 -20.830 -11.320 5.029 954 HD3 LYS 70 3HD LYS 70 -20.705 -11.446 3.265 955 HE2 LYS 70 2HE LYS 70 -21.087 -8.851 4.820 956 HE3 LYS 70 3HE LYS 70 -19.514 -9.495 4.330 957 HZ1 LYS 70 3HZ LYS 70 -20.220 -9.361 2.043 958 HZ2 LYS 70 1HZ LYS 70 -20.328 -7.880 2.759 959 HZ3 LYS 70 2HZ LYS 70 -21.690 -8.767 2.483 960 H THR 71 HN THR 71 -22.469 -15.760 4.688 961 HA THR 71 HA THR 71 -25.320 -16.604 4.318 962 HB THR 71 HB THR 71 -23.318 -18.490 3.252 963 HG1 THR 71 1HG THR 71 -22.050 -16.714 2.893 964 HG21 THR 71 3HG2 THR 71 -25.452 -16.858 1.871 965 HG22 THR 71 1HG2 THR 71 -25.681 -18.469 2.598 966 HG23 THR 71 2HG2 THR 71 -24.585 -18.263 1.216 967 H CYS 72 HN CYS 72 -22.258 -18.431 4.928 968 HA CYS 72 HA CYS 72 -23.700 -20.141 6.853 969 HB2 CYS 72 2HB CYS 72 -21.579 -21.437 6.837 970 HB3 CYS 72 3HB CYS 72 -22.200 -21.164 5.193 971 H GLN 73 HN GLN 73 -22.324 -17.157 7.142 972 HA GLN 73 HA GLN 73 -21.441 -15.916 8.864 973 HB2 GLN 73 2HB GLN 73 -22.391 -18.118 10.753 974 HB3 GLN 73 3HB GLN 73 -22.205 -16.405 11.072 975 HG2 GLN 73 2HG GLN 73 -24.338 -17.748 9.374 976 HG3 GLN 73 3HG GLN 73 -24.546 -16.849 10.870 977 HE21 GLN 73 1HE2 GLN 73 -25.048 -16.583 7.557 978 HE22 GLN 73 2HE2 GLN 73 -24.916 -14.818 7.492 979 H ARG 74 HN ARG 74 -19.752 -18.162 7.627 980 HA ARG 74 HA ARG 74 -17.947 -19.043 9.736 981 HE ARG 74 HE ARG 74 -14.985 -23.047 7.606 982 HB2 ARG 74 2HB ARG 74 -18.298 -20.214 7.538 983 HB3 ARG 74 3HB ARG 74 -17.438 -18.893 6.719 984 HG2 ARG 74 2HG ARG 74 -15.430 -19.403 8.082 985 HG3 ARG 74 3HG ARG 74 -16.339 -20.627 8.989 986 HD2 ARG 74 2HD ARG 74 -16.732 -21.839 6.795 987 HD3 ARG 74 3HD ARG 74 -15.580 -20.739 6.041 988 HH11 ARG 74 1HH2 ARG 74 -13.720 -19.778 7.255 989 HH12 ARG 74 2HH2 ARG 74 -12.137 -20.233 7.821 990 HH21 ARG 74 1HH1 ARG 74 -12.958 -23.557 8.321 991 HH22 ARG 74 2HH1 ARG 74 -11.711 -22.335 8.377 992 H LYS 75 HN LYS 75 -16.149 -18.062 10.507 993 HA LYS 75 HA LYS 75 -15.815 -15.253 9.705 994 HB2 LYS 75 2HB LYS 75 -14.602 -16.779 12.062 995 HB3 LYS 75 3HB LYS 75 -14.543 -15.033 11.771 996 HG2 LYS 75 2HG LYS 75 -17.228 -15.329 11.645 997 HG3 LYS 75 3HG LYS 75 -16.866 -16.755 12.608 998 HD2 LYS 75 2HD LYS 75 -17.081 -15.342 14.353 999 HD3 LYS 75 3HD LYS 75 -15.424 -14.859 13.995 1000 HE2 LYS 75 2HE LYS 75 -17.977 -13.514 12.974 1001 HE3 LYS 75 3HE LYS 75 -16.977 -12.931 14.307 1002 HZ1 LYS 75 3HZ LYS 75 -15.159 -12.664 12.744 1003 HZ2 LYS 75 1HZ LYS 75 -16.467 -11.766 12.294 1004 HZ3 LYS 75 2HZ LYS 75 -16.100 -13.159 11.497 1005 H PHE 76 HN PHE 76 -13.935 -14.293 9.062 1006 HA PHE 76 HA PHE 76 -11.578 -16.063 8.530 1007 HD1 PHE 76 1HD PHE 76 -11.401 -17.485 6.016 1008 HD2 PHE 76 2HD PHE 76 -14.966 -15.047 6.150 1009 HE1 PHE 76 1HE PHE 76 -12.718 -19.342 5.020 1010 HE2 PHE 76 2HE PHE 76 -16.274 -16.913 5.194 1011 HZ PHE 76 HZ PHE 76 -15.160 -19.061 4.639 1012 HB2 PHE 76 2HB PHE 76 -12.780 -14.057 6.565 1013 HB3 PHE 76 3HB PHE 76 -11.302 -14.972 6.316 1014 H SER 77 HN SER 77 -9.559 -14.831 8.186 1015 HA SER 77 HA SER 77 -9.518 -12.513 10.027 1016 HG SER 77 HG SER 77 -6.518 -15.081 9.040 1017 HB2 SER 77 2HB SER 77 -7.035 -12.966 10.044 1018 HB3 SER 77 3HB SER 77 -8.018 -14.353 10.549 1019 H ARG 78 HN ARG 78 -9.526 -13.046 6.658 1020 HA ARG 78 HA ARG 78 -8.521 -10.277 6.208 1021 HE ARG 78 HE ARG 78 -5.038 -13.648 4.353 1022 HB2 ARG 78 2HB ARG 78 -7.698 -12.733 4.568 1023 HB3 ARG 78 3HB ARG 78 -7.405 -11.052 4.118 1024 HG2 ARG 78 2HG ARG 78 -6.235 -10.875 6.460 1025 HG3 ARG 78 3HG ARG 78 -6.143 -12.637 6.375 1026 HD2 ARG 78 2HD ARG 78 -5.120 -10.723 4.233 1027 HD3 ARG 78 3HD ARG 78 -4.121 -11.311 5.556 1028 HH11 ARG 78 1HH1 ARG 78 -3.406 -10.773 2.984 1029 HH12 ARG 78 2HH1 ARG 78 -2.763 -11.757 1.689 1030 HH21 ARG 78 1HH2 ARG 78 -3.936 -14.730 2.712 1031 HH22 ARG 78 2HH2 ARG 78 -3.102 -13.769 1.489 1032 H SER 79 HN SER 79 -9.690 -9.107 4.762 1033 HA SER 79 HA SER 79 -12.275 -9.921 3.905 1034 HG SER 79 HG SER 79 -10.148 -6.699 2.584 1035 HB2 SER 79 2HB SER 79 -12.060 -7.936 2.330 1036 HB3 SER 79 3HB SER 79 -11.748 -7.569 4.032 1037 H ASP 80 HN ASP 80 -9.120 -9.924 2.223 1038 HA ASP 80 HA ASP 80 -9.967 -10.721 -0.305 1039 HB2 ASP 80 2HB ASP 80 -7.639 -10.068 0.321 1040 HB3 ASP 80 3HB ASP 80 -7.429 -11.621 1.132 1041 H HIS 81 HN HIS 81 -9.263 -12.869 2.536 1042 HA HIS 81 HA HIS 81 -9.851 -15.363 1.167 1043 HD1 HIS 81 1HD HIS 81 -7.547 -15.673 1.358 1044 HD2 HIS 81 2HD HIS 81 -7.893 -15.675 5.549 1045 HE1 HIS 81 1HE HIS 81 -5.297 -16.097 2.220 1046 HB2 HIS 81 2HB HIS 81 -9.929 -14.595 4.126 1047 HB3 HIS 81 3HB HIS 81 -10.178 -16.221 3.519 1048 H LEU 82 HN LEU 82 -11.794 -13.051 3.144 1049 HA LEU 82 HA LEU 82 -14.157 -14.654 3.226 1050 HG LEU 82 HG LEU 82 -16.173 -13.498 3.683 1051 HB2 LEU 82 2HB LEU 82 -13.756 -12.725 4.683 1052 HB3 LEU 82 3HB LEU 82 -13.862 -11.606 3.324 1053 HD11 LEU 82 1HD1 LEU 82 -16.009 -11.068 5.460 1054 HD12 LEU 82 2HD1 LEU 82 -15.653 -12.768 6.023 1055 HD13 LEU 82 3HD1 LEU 82 -17.218 -12.326 5.361 1056 HD21 LEU 82 3HD2 LEU 82 -17.513 -11.498 3.121 1057 HD22 LEU 82 1HD2 LEU 82 -16.278 -11.747 1.898 1058 HD23 LEU 82 2HD2 LEU 82 -16.051 -10.489 3.125 1059 H LYS 83 HN LYS 83 -13.160 -12.038 0.944 1060 HA LYS 83 HA LYS 83 -15.500 -12.208 -0.740 1061 HB2 LYS 83 2HB LYS 83 -13.845 -10.309 -0.661 1062 HB3 LYS 83 3HB LYS 83 -12.663 -11.326 -1.499 1063 HG2 LYS 83 2HG LYS 83 -14.167 -11.495 -3.454 1064 HG3 LYS 83 3HG LYS 83 -15.436 -10.619 -2.577 1065 HD2 LYS 83 2HD LYS 83 -13.953 -8.615 -2.471 1066 HD3 LYS 83 3HD LYS 83 -12.719 -9.496 -3.402 1067 HE2 LYS 83 2HE LYS 83 -14.345 -9.789 -5.259 1068 HE3 LYS 83 3HE LYS 83 -15.573 -8.919 -4.323 1069 HZ1 LYS 83 3HZ LYS 83 -14.488 -7.489 -5.902 1070 HZ2 LYS 83 1HZ LYS 83 -13.010 -7.807 -5.250 1071 HZ3 LYS 83 2HZ LYS 83 -14.144 -6.980 -4.373 1072 H THR 84 HN THR 84 -12.369 -13.936 -0.681 1073 HA THR 84 HA THR 84 -12.718 -15.343 -3.165 1074 HB THR 84 HB THR 84 -11.174 -15.979 -0.637 1075 HG1 THR 84 1HG THR 84 -10.355 -14.265 -1.581 1076 HG21 THR 84 3HG2 THR 84 -11.428 -18.132 -1.790 1077 HG22 THR 84 1HG2 THR 84 -9.783 -17.492 -1.773 1078 HG23 THR 84 2HG2 THR 84 -10.760 -17.389 -3.274 1079 H HIS 85 HN HIS 85 -13.401 -16.265 0.250 1080 HA HIS 85 HA HIS 85 -14.638 -18.772 -0.319 1081 HD1 HIS 85 1HD HIS 85 -15.763 -20.584 1.886 1082 HD2 HIS 85 2HD HIS 85 -17.258 -16.744 2.830 1083 HE1 HIS 85 1HE HIS 85 -18.176 -20.885 2.750 1084 HB2 HIS 85 2HB HIS 85 -13.964 -18.338 1.929 1085 HB3 HIS 85 3HB HIS 85 -14.816 -16.796 1.981 1086 H THR 86 HN THR 86 -15.883 -15.439 -0.221 1087 HA THR 86 HA THR 86 -18.651 -15.905 -0.316 1088 HB THR 86 HB THR 86 -17.047 -13.749 -1.756 1089 HG1 THR 86 1HG THR 86 -16.822 -13.857 0.549 1090 HG21 THR 86 3HG2 THR 86 -19.282 -13.690 -2.682 1091 HG22 THR 86 1HG2 THR 86 -18.981 -12.335 -1.583 1092 HG23 THR 86 2HG2 THR 86 -19.978 -13.712 -1.034 1093 H ARG 87 HN ARG 87 -16.214 -16.079 -2.973 1094 HA ARG 87 HA ARG 87 -18.133 -16.200 -5.130 1095 HE ARG 87 HE ARG 87 -13.070 -16.469 -6.796 1096 HB2 ARG 87 2HB ARG 87 -15.246 -17.193 -4.933 1097 HB3 ARG 87 3HB ARG 87 -16.221 -17.243 -6.399 1098 HG2 ARG 87 2HG ARG 87 -16.650 -14.751 -6.126 1099 HG3 ARG 87 3HG ARG 87 -15.420 -14.739 -4.865 1100 HD2 ARG 87 2HD ARG 87 -14.994 -15.603 -7.756 1101 HD3 ARG 87 3HD ARG 87 -14.606 -14.006 -7.115 1102 HH11 ARG 87 1HH1 ARG 87 -13.487 -13.302 -5.314 1103 HH12 ARG 87 2HH1 ARG 87 -11.854 -13.344 -4.660 1104 HH21 ARG 87 1HH2 ARG 87 -11.191 -16.472 -5.958 1105 HH22 ARG 87 2HH2 ARG 87 -10.603 -15.180 -4.888 1106 H THR 88 HN THR 88 -17.042 -18.565 -2.769 1107 HA THR 88 HA THR 88 -17.836 -21.000 -4.069 1108 HB THR 88 HB THR 88 -18.269 -20.451 -1.117 1109 HG1 THR 88 1HG THR 88 -16.405 -19.737 -1.221 1110 HG21 THR 88 3HG2 THR 88 -17.460 -22.766 -0.849 1111 HG22 THR 88 1HG2 THR 88 -17.384 -22.908 -2.621 1112 HG23 THR 88 2HG2 THR 88 -18.945 -22.653 -1.816 1113 H HIS 89 HN HIS 89 -19.669 -18.600 -2.098 1114 HA HIS 89 HA HIS 89 -22.171 -20.150 -2.360 1115 HD1 HIS 89 1HD HIS 89 -23.041 -20.857 -0.040 1116 HD2 HIS 89 2HD HIS 89 -20.522 -17.736 1.246 1117 HE1 HIS 89 1HE HIS 89 -22.325 -21.407 2.368 1118 HB2 HIS 89 2HB HIS 89 -21.514 -17.428 -1.150 1119 HB3 HIS 89 3HB HIS 89 -23.133 -18.109 -1.194 1120 H THR 90 HN THR 90 -20.434 -17.715 -4.111 1121 HA THR 90 HA THR 90 -22.841 -16.654 -5.460 1122 HB THR 90 HB THR 90 -19.943 -16.039 -6.125 1123 HG1 THR 90 1HG THR 90 -20.324 -15.717 -3.844 1124 HG21 THR 90 3HG2 THR 90 -20.789 -13.779 -6.640 1125 HG22 THR 90 1HG2 THR 90 -22.446 -14.321 -6.296 1126 HG23 THR 90 2HG2 THR 90 -21.544 -14.992 -7.674 1127 H GLY 91 HN GLY 91 -20.805 -19.356 -5.837 1128 HA2 GLY 91 2HA GLY 91 -20.451 -20.851 -7.572 1129 HA3 GLY 91 3HA GLY 91 -21.903 -20.181 -8.339 1130 H GLU 92 HN GLU 92 -19.166 -18.085 -7.596 1131 HA GLU 92 HA GLU 92 -19.024 -17.415 -10.464 1132 HB2 GLU 92 2HB GLU 92 -19.259 -15.713 -8.572 1133 HB3 GLU 92 3HB GLU 92 -17.599 -16.085 -8.119 1134 HG2 GLU 92 2HG GLU 92 -17.025 -15.501 -10.611 1135 HG3 GLU 92 3HG GLU 92 -18.643 -14.814 -10.678 1136 H LYS 93 HN LYS 93 -17.585 -18.403 -11.765 1137 HA LYS 93 HA LYS 93 -14.840 -18.914 -10.690 1138 HB2 LYS 93 2HB LYS 93 -16.509 -20.639 -12.556 1139 HB3 LYS 93 3HB LYS 93 -14.763 -20.818 -12.382 1140 HG2 LYS 93 2HG LYS 93 -14.929 -21.496 -10.113 1141 HG3 LYS 93 3HG LYS 93 -16.646 -21.076 -10.008 1142 HD2 LYS 93 2HD LYS 93 -17.327 -22.862 -11.370 1143 HD3 LYS 93 3HD LYS 93 -15.734 -23.088 -12.087 1144 HE2 LYS 93 2HE LYS 93 -16.367 -23.683 -9.168 1145 HE3 LYS 93 3HE LYS 93 -16.415 -24.881 -10.474 1146 HZ1 LYS 93 3HZ LYS 93 -14.088 -24.330 -10.932 1147 HZ2 LYS 93 1HZ LYS 93 -14.310 -24.987 -9.432 1148 HZ3 LYS 93 2HZ LYS 93 -14.055 -23.369 -9.594 1149 HA PRO 94 HA PRO 94 -14.762 -16.112 -14.328 1150 HB2 PRO 94 2HB PRO 94 -13.167 -14.129 -13.350 1151 HB3 PRO 94 3HB PRO 94 -14.868 -14.324 -12.829 1152 HG2 PRO 94 2HG PRO 94 -12.365 -15.265 -11.407 1153 HG3 PRO 94 3HG PRO 94 -13.762 -14.385 -10.718 1154 HD2 PRO 94 2HD PRO 94 -13.436 -17.114 -10.620 1155 HD3 PRO 94 3HD PRO 94 -15.044 -16.336 -10.611 1156 H PHE 95 HN PHE 95 -12.186 -17.755 -12.580 1157 HA PHE 95 HA PHE 95 -10.087 -16.947 -14.510 1158 HD1 PHE 95 2HD PHE 95 -7.989 -15.933 -12.972 1159 HD2 PHE 95 1HD PHE 95 -10.888 -17.801 -10.405 1160 HE1 PHE 95 2HE PHE 95 -7.747 -14.072 -11.346 1161 HE2 PHE 95 1HE PHE 95 -10.638 -15.942 -8.763 1162 HZ PHE 95 HZ PHE 95 -9.062 -14.086 -9.231 1163 HB2 PHE 95 2HB PHE 95 -9.993 -19.007 -12.256 1164 HB3 PHE 95 3HB PHE 95 -8.631 -18.375 -13.158 1165 H SER 96 HN SER 96 -11.277 -17.777 -16.428 1166 HA SER 96 HA SER 96 -11.441 -20.707 -16.718 1167 HG SER 96 HG SER 96 -11.534 -18.379 -19.739 1168 HB2 SER 96 2HB SER 96 -12.301 -20.195 -18.965 1169 HB3 SER 96 3HB SER 96 -13.169 -19.306 -17.708 1170 H CYS 97 HN CYS 97 -10.128 -22.014 -17.914 1171 HA CYS 97 HA CYS 97 -7.428 -21.185 -18.230 1172 HB2 CYS 97 2HB CYS 97 -8.229 -23.541 -17.810 1173 HB3 CYS 97 3HB CYS 97 -8.795 -23.596 -19.483 1174 H ARG 98 HN ARG 98 -6.145 -20.740 -19.979 1175 HA ARG 98 HA ARG 98 -7.639 -19.748 -22.361 1176 HE ARG 98 HE ARG 98 -8.820 -18.525 -20.095 1177 HB2 ARG 98 2HB ARG 98 -4.875 -18.999 -21.330 1178 HB3 ARG 98 3HB ARG 98 -5.722 -18.227 -22.663 1179 HG2 ARG 98 2HG ARG 98 -6.572 -18.116 -19.730 1180 HG3 ARG 98 3HG ARG 98 -5.709 -16.877 -20.626 1181 HD2 ARG 98 2HD ARG 98 -7.901 -16.099 -20.623 1182 HD3 ARG 98 3HD ARG 98 -7.706 -16.805 -22.239 1183 HH11 ARG 98 1HH2 ARG 98 -9.800 -16.376 -22.726 1184 HH12 ARG 98 2HH2 ARG 98 -11.313 -17.243 -22.931 1185 HH21 ARG 98 1HH1 ARG 98 -10.431 -19.750 -20.854 1186 HH22 ARG 98 2HH1 ARG 98 -11.723 -19.089 -21.826 1187 H TRP 99 HN TRP 99 -6.103 -22.507 -21.580 1188 HA TRP 99 HA TRP 99 -4.028 -22.770 -23.537 1189 HD1 TRP 99 1HD TRP 99 -4.079 -22.875 -20.295 1190 HE1 TRP 99 1HE TRP 99 -1.763 -23.319 -19.303 1191 HE3 TRP 99 3HE TRP 99 -2.632 -26.700 -23.360 1192 HZ2 TRP 99 2HZ TRP 99 0.486 -25.054 -19.838 1193 HZ3 TRP 99 3HZ TRP 99 -0.381 -27.722 -23.109 1194 HH2 TRP 99 2HH TRP 99 1.186 -26.900 -21.371 1195 HB2 TRP 99 2HB TRP 99 -5.695 -24.684 -21.895 1196 HB3 TRP 99 3HB TRP 99 -4.729 -25.318 -23.211 1197 HA PRO 100 HA PRO 100 -6.220 -23.073 -27.291 1198 HB2 PRO 100 2HB PRO 100 -4.526 -24.589 -28.869 1199 HB3 PRO 100 3HB PRO 100 -4.107 -22.976 -28.244 1200 HG2 PRO 100 2HG PRO 100 -3.385 -25.664 -27.025 1201 HG3 PRO 100 3HG PRO 100 -2.286 -24.303 -27.431 1202 HD2 PRO 100 2HD PRO 100 -3.245 -24.625 -24.921 1203 HD3 PRO 100 3HD PRO 100 -3.110 -22.988 -25.637 1204 H SER 101 HN SER 101 -6.796 -25.307 -25.202 1205 HA SER 101 HA SER 101 -8.576 -26.833 -26.910 1206 HG SER 101 HG SER 101 -6.572 -27.289 -28.015 1207 HB2 SER 101 2HB SER 101 -6.191 -28.252 -25.639 1208 HB3 SER 101 3HB SER 101 -7.642 -29.099 -26.217 1209 H CYS 102 HN CYS 102 -8.413 -25.070 -24.396 1210 HA CYS 102 HA CYS 102 -10.132 -26.783 -22.694 1211 HB2 CYS 102 2HB CYS 102 -7.787 -27.032 -21.826 1212 HB3 CYS 102 3HB CYS 102 -7.720 -25.269 -21.618 1213 H GLN 103 HN GLN 103 -11.330 -25.573 -21.103 1214 HA GLN 103 HA GLN 103 -11.174 -22.655 -21.099 1215 HB2 GLN 103 2HB GLN 103 -13.673 -24.092 -22.105 1216 HB3 GLN 103 3HB GLN 103 -13.735 -22.468 -21.445 1217 HG2 GLN 103 2HG GLN 103 -12.228 -23.231 -23.953 1218 HG3 GLN 103 3HG GLN 103 -13.780 -22.423 -23.850 1219 HE21 GLN 103 1HE2 GLN 103 -10.319 -22.001 -23.501 1220 HE22 GLN 103 2HE2 GLN 103 -10.377 -20.242 -23.324 1221 H LYS 104 HN LYS 104 -10.797 -25.076 -19.295 1222 HA LYS 104 HA LYS 104 -13.035 -25.392 -17.506 1223 HB2 LYS 104 2HB LYS 104 -10.083 -26.044 -17.431 1224 HB3 LYS 104 3HB LYS 104 -10.942 -26.008 -15.914 1225 HG2 LYS 104 2HG LYS 104 -10.865 -28.259 -16.765 1226 HG3 LYS 104 3HG LYS 104 -12.509 -27.687 -16.579 1227 HD2 LYS 104 2HD LYS 104 -13.020 -28.113 -18.712 1228 HD3 LYS 104 3HD LYS 104 -11.651 -27.218 -19.331 1229 HE2 LYS 104 2HE LYS 104 -11.551 -30.101 -18.376 1230 HE3 LYS 104 3HE LYS 104 -11.634 -29.557 -20.063 1231 HZ1 LYS 104 3HZ LYS 104 -9.381 -29.992 -19.534 1232 HZ2 LYS 104 1HZ LYS 104 -9.435 -29.036 -18.185 1233 HZ3 LYS 104 2HZ LYS 104 -9.546 -28.351 -19.659 1234 H LYS 105 HN LYS 105 -13.692 -24.289 -15.735 1235 HA LYS 105 HA LYS 105 -12.333 -21.675 -15.332 1236 HB2 LYS 105 2HB LYS 105 -15.235 -22.389 -14.702 1237 HB3 LYS 105 3HB LYS 105 -14.477 -20.788 -14.780 1238 HG2 LYS 105 2HG LYS 105 -13.906 -21.418 -17.239 1239 HG3 LYS 105 3HG LYS 105 -15.132 -22.680 -17.050 1240 HD2 LYS 105 2HD LYS 105 -16.767 -20.850 -16.393 1241 HD3 LYS 105 3HD LYS 105 -15.524 -19.665 -16.825 1242 HE2 LYS 105 2HE LYS 105 -16.803 -21.748 -18.654 1243 HE3 LYS 105 3HE LYS 105 -17.079 -20.001 -18.699 1244 HZ1 LYS 105 3HZ LYS 105 -14.750 -19.734 -19.302 1245 HZ2 LYS 105 1HZ LYS 105 -15.540 -20.681 -20.395 1246 HZ3 LYS 105 2HZ LYS 105 -14.535 -21.372 -19.292 1247 H PHE 106 HN PHE 106 -11.710 -20.948 -13.403 1248 HA PHE 106 HA PHE 106 -12.403 -22.582 -10.990 1249 HD1 PHE 106 1HD PHE 106 -10.411 -24.575 -10.211 1250 HD2 PHE 106 2HD PHE 106 -9.325 -22.343 -13.736 1251 HE1 PHE 106 1HE PHE 106 -9.934 -26.694 -11.408 1252 HE2 PHE 106 2HE PHE 106 -8.876 -24.458 -14.945 1253 HZ PHE 106 HZ PHE 106 -9.215 -26.637 -13.789 1254 HB2 PHE 106 2HB PHE 106 -9.751 -21.200 -11.611 1255 HB3 PHE 106 3HB PHE 106 -10.139 -22.097 -10.151 1256 H ALA 107 HN ALA 107 -12.420 -21.399 -8.953 1257 HA ALA 107 HA ALA 107 -13.257 -18.601 -9.372 1258 HB1 ALA 107 1HB ALA 107 -13.475 -20.423 -6.925 1259 HB2 ALA 107 2HB ALA 107 -14.239 -18.830 -7.123 1260 HB3 ALA 107 3HB ALA 107 -14.747 -20.184 -8.142 1261 H ARG 108 HN ARG 108 -10.358 -20.044 -8.848 1262 HA ARG 108 HA ARG 108 -9.381 -17.702 -7.292 1263 HE ARG 108 HE ARG 108 -9.125 -19.160 -3.101 1264 HB2 ARG 108 2HB ARG 108 -8.284 -20.491 -6.827 1265 HB3 ARG 108 3HB ARG 108 -8.003 -19.029 -5.893 1266 HG2 ARG 108 2HG ARG 108 -10.383 -19.082 -5.118 1267 HG3 ARG 108 3HG ARG 108 -10.646 -20.560 -6.046 1268 HD2 ARG 108 2HD ARG 108 -10.297 -21.301 -3.864 1269 HD3 ARG 108 3HD ARG 108 -8.781 -21.638 -4.711 1270 HH11 ARG 108 1HH1 ARG 108 -7.278 -22.167 -3.474 1271 HH12 ARG 108 2HH1 ARG 108 -6.170 -21.665 -2.218 1272 HH21 ARG 108 1HH2 ARG 108 -7.691 -18.608 -1.691 1273 HH22 ARG 108 2HH2 ARG 108 -6.313 -19.610 -1.332 1274 H SER 109 HN SER 109 -7.562 -16.806 -8.083 1275 HA SER 109 HA SER 109 -6.678 -17.413 -10.699 1276 HG SER 109 HG SER 109 -5.856 -14.677 -8.062 1277 HB2 SER 109 2HB SER 109 -4.627 -15.965 -9.900 1278 HB3 SER 109 3HB SER 109 -6.215 -15.226 -10.015 1279 H ASP 110 HN ASP 110 -5.402 -18.385 -7.498 1280 HA ASP 110 HA ASP 110 -3.017 -19.660 -8.531 1281 HB2 ASP 110 2HB ASP 110 -3.065 -20.793 -6.231 1282 HB3 ASP 110 3HB ASP 110 -2.879 -19.049 -6.317 1283 H GLU 111 HN GLU 111 -6.386 -20.761 -7.937 1284 HA GLU 111 HA GLU 111 -5.924 -23.582 -8.284 1285 HB2 GLU 111 2HB GLU 111 -8.341 -21.787 -8.656 1286 HB3 GLU 111 3HB GLU 111 -8.366 -23.448 -9.202 1287 HG2 GLU 111 2HG GLU 111 -7.967 -24.308 -7.005 1288 HG3 GLU 111 3HG GLU 111 -7.756 -22.687 -6.352 1289 H LEU 112 HN LEU 112 -6.666 -20.907 -10.581 1290 HA LEU 112 HA LEU 112 -6.615 -22.583 -12.926 1291 HG LEU 112 HG LEU 112 -5.209 -20.441 -14.761 1292 HB2 LEU 112 2HB LEU 112 -7.647 -20.373 -12.930 1293 HB3 LEU 112 3HB LEU 112 -6.092 -19.595 -12.598 1294 HD11 LEU 112 1HD1 LEU 112 -8.057 -21.382 -15.341 1295 HD12 LEU 112 2HD1 LEU 112 -6.680 -22.472 -15.019 1296 HD13 LEU 112 3HD1 LEU 112 -6.653 -21.437 -16.407 1297 HD21 LEU 112 3HD2 LEU 112 -7.815 -18.960 -15.196 1298 HD22 LEU 112 1HD2 LEU 112 -6.391 -18.979 -16.242 1299 HD23 LEU 112 2HD2 LEU 112 -6.292 -18.208 -14.650 1300 H VAL 113 HN VAL 113 -4.068 -20.659 -11.219 1301 HA VAL 113 HA VAL 113 -1.904 -21.177 -13.005 1302 HB VAL 113 HB VAL 113 -1.935 -20.875 -9.970 1303 HG11 VAL 113 1HG1 VAL 113 0.462 -20.870 -11.825 1304 HG12 VAL 113 2HG1 VAL 113 0.478 -20.302 -10.142 1305 HG13 VAL 113 3HG1 VAL 113 0.144 -21.996 -10.488 1306 HG21 VAL 113 3HG2 VAL 113 -0.915 -18.831 -11.943 1307 HG22 VAL 113 1HG2 VAL 113 -2.599 -18.850 -11.477 1308 HG23 VAL 113 2HG2 VAL 113 -1.351 -18.612 -10.237 1309 H ARG 114 HN ARG 114 -3.098 -23.073 -10.197 1310 HA ARG 114 HA ARG 114 -1.218 -25.215 -10.411 1311 HE ARG 114 HE ARG 114 -1.880 -26.258 -6.696 1312 HB2 ARG 114 2HB ARG 114 -2.657 -24.854 -8.450 1313 HB3 ARG 114 3HB ARG 114 -4.101 -25.239 -9.383 1314 HG2 ARG 114 2HG ARG 114 -3.346 -27.546 -9.717 1315 HG3 ARG 114 3HG ARG 114 -1.802 -27.195 -8.923 1316 HD2 ARG 114 2HD ARG 114 -4.525 -26.950 -7.568 1317 HD3 ARG 114 3HD ARG 114 -3.505 -28.400 -7.497 1318 HH11 ARG 114 1HH2 ARG 114 -4.785 -27.809 -5.384 1319 HH12 ARG 114 2HH2 ARG 114 -4.314 -27.479 -3.743 1320 HH21 ARG 114 1HH1 ARG 114 -1.382 -25.809 -4.576 1321 HH22 ARG 114 2HH1 ARG 114 -2.537 -26.264 -3.326 1322 H HIS 115 HN HIS 115 -4.609 -24.992 -11.694 1323 HA HIS 115 HA HIS 115 -4.692 -27.313 -13.156 1324 HD1 HIS 115 1HD HIS 115 -7.189 -28.123 -14.496 1325 HD2 HIS 115 2HD HIS 115 -6.018 -24.663 -16.598 1326 HE1 HIS 115 1HE HIS 115 -7.937 -28.424 -16.935 1327 HB2 HIS 115 2HB HIS 115 -6.587 -25.801 -13.012 1328 HB3 HIS 115 3HB HIS 115 -5.762 -24.569 -13.953 1329 H HIS 116 HN HIS 116 -3.383 -24.177 -14.371 1330 HA HIS 116 HA HIS 116 -2.523 -25.123 -16.908 1331 HD1 HIS 116 1HD HIS 116 -4.198 -23.606 -17.760 1332 HD2 HIS 116 2HD HIS 116 -2.028 -20.453 -15.952 1333 HE1 HIS 116 1HE HIS 116 -5.326 -21.482 -18.409 1334 HB2 HIS 116 2HB HIS 116 -1.416 -22.947 -15.094 1335 HB3 HIS 116 3HB HIS 116 -0.843 -23.236 -16.726 1336 H ASN 117 HN ASN 117 -0.987 -25.329 -13.667 1337 HA ASN 117 HA ASN 117 1.632 -26.137 -14.646 1338 HB2 ASN 117 2HB ASN 117 0.877 -25.153 -12.318 1339 HB3 ASN 117 3HB ASN 117 0.546 -26.827 -11.891 1340 HD21 ASN 117 1HD2 ASN 117 2.830 -28.087 -13.204 1341 HD22 ASN 117 2HD2 ASN 117 4.242 -27.441 -12.329 1342 H MET 118 HN MET 118 -1.413 -27.761 -14.354 1343 HA MET 118 HA MET 118 -0.063 -30.438 -14.495 1344 HB2 MET 118 2HB MET 118 -2.900 -29.691 -13.652 1345 HB3 MET 118 3HB MET 118 -2.273 -31.344 -13.755 1346 HG2 MET 118 2HG MET 118 -0.593 -30.856 -12.044 1347 HG3 MET 118 3HG MET 118 -1.141 -29.180 -11.940 1348 HE1 MET 118 3HE MET 118 -1.198 -29.503 -9.334 1349 HE2 MET 118 1HE MET 118 -2.190 -30.723 -8.499 1350 HE3 MET 118 2HE MET 118 -0.785 -31.227 -9.466 1351 H HIS 119 HN HIS 119 -1.197 -28.107 -16.523 1352 HA HIS 119 HA HIS 119 -3.173 -29.503 -18.059 1353 HD1 HIS 119 1HD HIS 119 -3.418 -29.084 -20.923 1354 HD2 HIS 119 2HD HIS 119 -4.695 -25.986 -18.394 1355 HE1 HIS 119 1HE HIS 119 -5.901 -28.567 -21.523 1356 HB2 HIS 119 2HB HIS 119 -2.396 -26.942 -17.907 1357 HB3 HIS 119 3HB HIS 119 -1.474 -27.384 -19.344 Start of MODEL 6 1 H5 DC 124 5H C 124 -3.974 -31.470 -5.046 2 H6 DC 124 6H C 124 -5.891 -31.084 -6.515 3 H5' DC 124 H5' C 124 -8.869 -32.436 -9.810 4 H5'' DC 124 H5" C 124 -7.468 -32.363 -8.719 5 H4' DC 124 H4' C 124 -10.366 -32.415 -7.791 6 H3' DC 124 H3' C 124 -9.098 -30.226 -8.999 7 H2' DC 124 H2' C 124 -7.376 -30.015 -7.414 8 H2'' DC 124 H2" C 124 -8.591 -29.008 -6.588 9 H1' DC 124 H1' C 124 -9.395 -30.803 -5.236 10 H41 DC 124 1H4 C 124 -4.465 -32.229 -1.487 11 H42 DC 124 2H4 C 124 -3.320 -31.957 -2.787 12 H8 DG 125 8H G 125 -9.123 -26.812 -5.614 13 H1 DG 125 1H G 125 -6.457 -29.044 -0.220 14 H5' DG 125 H5' G 125 -12.786 -29.720 -6.223 15 H5'' DG 125 H5" G 125 -13.989 -28.508 -6.726 16 H4' DG 125 H4' G 125 -13.794 -28.536 -4.275 17 H3' DG 125 H3' G 125 -13.413 -26.145 -5.726 18 H2' DG 125 H2' G 125 -11.137 -26.011 -5.356 19 H2'' DG 125 H2" G 125 -11.630 -25.221 -3.833 20 H1' DG 125 H1' G 125 -11.535 -27.292 -2.608 21 H21 DG 125 1H2 G 125 -7.942 -29.274 1.330 22 H22 DG 125 2H2 G 125 -9.647 -28.979 1.028 23 H5 DC 126 5H C 126 -8.046 -23.873 -4.331 24 H6 DC 126 6H C 126 -9.977 -23.384 -2.909 25 H5' DC 126 H5' C 126 -13.706 -26.119 -1.174 26 H5'' DC 126 H5" C 126 -14.635 -24.719 -0.590 27 H4' DC 126 H4' C 126 -12.740 -25.146 0.871 28 H3' DC 126 H3' C 126 -13.291 -22.631 -0.258 29 H2' DC 126 H2' C 126 -11.406 -22.719 -1.656 30 H2'' DC 126 H2" C 126 -10.670 -21.916 -0.237 31 H1' DC 126 H1' C 126 -10.051 -24.101 0.750 32 H41 DC 126 1H4 C 126 -5.080 -25.534 -2.954 33 H42 DC 126 2H4 C 126 -5.869 -24.908 -4.382 34 H8 DG 127 8H G 127 -9.660 -21.725 1.663 35 H1 DG 127 1H G 127 -3.456 -22.978 0.700 36 H5' DG 127 H5' G 127 -12.032 -23.653 3.843 37 H5'' DG 127 H5" G 127 -12.585 -22.700 5.210 38 H4' DG 127 H4' G 127 -10.542 -23.775 5.851 39 H3' DG 127 H3' G 127 -10.780 -20.982 5.814 40 H2' DG 127 H2' G 127 -9.417 -20.611 3.978 41 H2'' DG 127 H2" G 127 -8.117 -20.664 5.207 42 H1' DG 127 H1' G 127 -7.629 -22.915 4.769 43 H21 DG 127 1H2 G 127 -2.489 -23.381 2.565 44 H22 DG 127 2H2 G 127 -3.338 -23.275 4.097 45 H8 DG 128 8H G 128 -7.421 -18.421 4.180 46 H1 DG 128 1H G 128 -2.749 -20.023 0.149 47 H5' DG 128 H5' G 128 -6.805 -21.861 7.611 48 H5'' DG 128 H5" G 128 -6.647 -21.020 9.157 49 H4' DG 128 H4' G 128 -4.531 -20.662 8.149 50 H3' DG 128 H3' G 128 -6.343 -18.415 8.588 51 H2' DG 128 H2' G 128 -6.820 -18.161 6.259 52 H2'' DG 128 H2" G 128 -5.364 -17.116 6.413 53 H1' DG 128 H1' G 128 -3.910 -18.890 5.736 54 H21 DG 128 1H2 G 128 -0.860 -19.919 1.154 55 H22 DG 128 2H2 G 128 -0.749 -19.759 2.896 56 H8 DG 129 8H G 129 -3.373 -16.411 5.601 57 H1 DG 129 1H G 129 -1.024 -16.401 -0.389 58 H5' DG 129 H5' G 129 -1.575 -18.528 8.503 59 H5'' DG 129 H5" G 129 -1.014 -17.558 9.858 60 H4' DG 129 H4' G 129 0.680 -17.343 8.174 61 H3' DG 129 H3' G 129 -0.804 -14.932 8.768 62 H2' DG 129 H2' G 129 -1.845 -14.872 6.710 63 H2'' DG 129 H2" G 129 -0.379 -14.067 6.160 64 H1' DG 129 H1' G 129 0.526 -16.142 5.283 65 H21 DG 129 1H2 G 129 1.144 -16.352 -0.365 66 H22 DG 129 2H2 G 129 2.054 -16.331 1.138 67 H8 DG 130 8H G 130 0.598 -13.626 4.171 68 H1 DG 130 1H G 130 -0.571 -12.872 -2.076 69 H5' DG 130 H5' G 130 2.850 -15.487 5.373 70 H5'' DG 130 H5" G 130 3.926 -14.782 6.592 71 H4' DG 130 H4' G 130 5.106 -14.371 4.643 72 H3' DG 130 H3' G 130 4.165 -12.021 5.796 73 H2' DG 130 H2' G 130 2.353 -11.734 4.391 74 H2'' DG 130 H2" G 130 3.541 -10.950 3.363 75 H1' DG 130 H1' G 130 3.718 -12.818 1.919 76 H21 DG 130 1H2 G 130 1.251 -12.398 -3.155 77 H22 DG 130 2H2 G 130 2.776 -12.122 -2.328 78 H8 DG 131 8H G 131 2.609 -9.563 2.363 79 H1 DG 131 1H G 131 -1.884 -9.410 -2.171 80 H5' DG 131 H5' G 131 6.199 -11.762 1.627 81 H5'' DG 131 H5" G 131 7.464 -10.531 1.820 82 H4' DG 131 H4' G 131 6.575 -10.340 -0.428 83 H3' DG 131 H3' G 131 6.551 -8.202 1.416 84 H2' DG 131 H2' G 131 4.273 -8.073 1.635 85 H2'' DG 131 H2" G 131 4.403 -7.055 0.193 86 H1' DG 131 H1' G 131 3.872 -8.904 -1.276 87 H21 DG 131 1H2 G 131 -1.037 -8.837 -4.053 88 H22 DG 131 2H2 G 131 0.670 -8.464 -4.225 89 H5 DC 132 5H C 132 1.257 -6.449 1.619 90 H6 DC 132 6H C 132 2.799 -5.734 -0.144 91 H5' DC 132 H5' C 132 5.233 -7.621 -2.788 92 H5'' DC 132 H5" C 132 6.277 -6.382 -3.514 93 H4' DC 132 H4' C 132 4.200 -6.139 -4.604 94 H3' DC 132 H3' C 132 5.228 -4.064 -2.885 95 H2' DC 132 H2' C 132 3.431 -4.014 -1.444 96 H2'' DC 132 H2" C 132 2.624 -3.119 -2.758 97 H1' DC 132 H1' C 132 1.616 -5.053 -3.641 98 H41 DC 132 1H4 C 132 -2.340 -6.712 0.970 99 H42 DC 132 2H4 C 132 -1.022 -7.067 2.068 100 H8 DG 133 8H G 133 1.205 -1.611 -3.037 101 H1 DG 133 1H G 133 -4.937 -2.797 -1.571 102 H5' DG 133 H5' G 133 2.602 -3.331 -6.695 103 H5'' DG 133 H5" G 133 3.327 -1.909 -7.475 104 H4' DG 133 H4' G 133 1.000 -1.976 -8.018 105 H3' DG 133 H3' G 133 2.098 0.314 -6.911 106 H2' DG 133 H2' G 133 1.324 -0.202 -4.726 107 H2'' DG 133 H2" G 133 -0.023 0.803 -5.269 108 H1' DG 133 H1' G 133 -1.357 -1.121 -5.912 109 H21 DG 133 1H2 G 133 -6.203 -2.356 -3.269 110 H22 DG 133 2H2 G 133 -5.549 -1.864 -4.815 111 H5' DT 134 H5' T 134 -2.397 -0.165 -7.381 112 H5'' DT 134 H5" T 134 -2.830 1.102 -8.536 113 H4' DT 134 H4' T 134 -4.654 1.009 -7.103 114 H3' DT 134 H3' T 134 -2.965 3.344 -7.190 115 H2' DT 134 H2' T 134 -2.347 3.130 -5.075 116 H2'' DT 134 H2" T 134 -3.830 3.982 -4.768 117 H1' DT 134 H1' T 134 -5.094 1.862 -4.315 118 H3 DT 134 3H T 134 -4.114 0.206 -0.176 119 H71 DT 134 1H7 T 134 0.515 0.539 -1.395 120 H72 DT 134 2H7 T 134 0.472 1.928 -2.504 121 H73 DT 134 3H7 T 134 0.229 2.176 -0.758 122 H6 DT 134 6H T 134 -1.458 2.032 -3.737 123 H5 DC 135 5H C 135 -3.563 4.769 -2.755 124 H6 DC 135 6H C 135 -5.407 5.282 -4.295 125 H5' DC 135 H5' C 135 -7.358 3.586 -7.334 126 H5'' DC 135 H5" C 135 -8.099 4.967 -8.157 127 H4' DC 135 H4' C 135 -9.541 4.233 -6.327 128 H3' DC 135 H3' C 135 -8.683 6.884 -6.557 129 H2' DC 135 H2' C 135 -6.998 6.692 -4.871 130 H2'' DC 135 H2" C 135 -8.324 7.257 -3.853 131 H1' DC 135 H1' C 135 -9.008 4.981 -3.323 132 H41 DC 135 1H4 C 135 -4.145 3.435 0.596 133 H42 DC 135 2H4 C 135 -2.989 4.022 -0.567 134 H5' DT 136 H5' T 136 -10.837 5.276 -2.635 135 H5'' DT 136 H5" T 136 -12.353 6.090 -3.005 136 H4' DT 136 H4' T 136 -12.450 5.869 -0.696 137 H3' DT 136 H3' T 136 -12.287 8.456 -1.874 138 H2' DT 136 H2' T 136 -10.123 8.989 -1.315 139 H2'' DT 136 H2" T 136 -10.719 9.451 0.239 140 H1' DT 136 H1' T 136 -10.212 7.444 1.326 141 H3 DT 136 3H T 136 -5.830 6.559 1.803 142 H71 DT 136 1H7 T 136 -5.192 9.353 -1.932 143 H72 DT 136 2H7 T 136 -5.236 7.876 -2.922 144 H73 DT 136 3H7 T 136 -6.590 9.031 -2.987 145 H6 DT 136 6H T 136 -8.458 8.205 -1.875 146 H8 DG 137 8H G 137 -9.631 10.356 1.768 147 H1 DG 137 1H G 137 -3.749 9.371 4.019 148 H5' DG 137 H5' G 137 -12.214 7.506 2.532 149 H5'' DG 137 H5" G 137 -13.642 8.330 3.174 150 H4' DG 137 H4' G 137 -12.299 8.002 5.022 151 H3' DG 137 H3' G 137 -12.889 10.630 4.233 152 H2' DG 137 H2' G 137 -10.811 11.136 3.451 153 H2'' DG 137 H2" G 137 -10.502 11.559 5.122 154 H1' DG 137 H1' G 137 -9.351 9.490 5.549 155 H21 DG 137 1H2 G 137 -3.809 8.919 6.141 156 H22 DG 137 2H2 G 137 -5.321 8.921 7.039 157 H5 DC 138 5H C 138 -8.565 13.119 4.102 158 H6 DC 138 6H C 138 -9.118 12.351 6.349 159 H5' DC 138 H5' C 138 -10.404 9.289 7.674 160 H5'' DC 138 H5" C 138 -11.291 9.851 9.094 161 H4' DC 138 H4' C 138 -9.102 9.560 9.827 162 H3' DC 138 H3' C 138 -10.355 12.062 9.909 163 H2' DC 138 H2' C 138 -9.153 13.060 8.260 164 H2'' DC 138 H2" C 138 -7.992 13.379 9.506 165 H1' DC 138 H1' C 138 -6.549 11.608 8.918 166 H41 DC 138 1H4 C 138 -5.079 13.304 2.978 167 H42 DC 138 2H4 C 138 -6.769 13.468 2.551 168 H8 DG 139 8H G 139 -6.400 14.694 9.705 169 H1 DG 139 1H G 139 -2.164 15.885 5.037 170 H5' DG 139 H5' G 139 -6.169 11.035 11.375 171 H5'' DG 139 H5" G 139 -6.199 11.491 13.081 172 H4' DG 139 H4' G 139 -3.930 11.464 12.374 173 H3' DG 139 H3' G 139 -5.043 13.692 13.598 174 H2' DG 139 H2' G 139 -5.339 14.895 11.654 175 H2'' DG 139 H2" G 139 -3.730 15.488 12.043 176 H1' DG 139 H1' G 139 -2.664 13.975 10.547 177 H21 DG 139 1H2 G 139 -0.174 15.343 5.648 178 H22 DG 139 2H2 G 139 0.166 14.754 7.269 179 H5 DC 140 5H C 140 -4.133 17.527 10.519 180 H6 DC 140 6H C 140 -2.087 16.755 11.619 181 H5' DC 140 H5' C 140 -0.682 13.405 12.207 182 H5'' DC 140 H5" C 140 0.276 13.759 13.655 183 H4' DC 140 H4' C 140 1.628 14.186 11.718 184 H3' DC 140 H3' C 140 1.249 16.053 13.745 185 H2' DC 140 H2' C 140 -0.251 17.431 12.603 186 H2'' DC 140 H2" C 140 1.255 18.187 12.025 187 H1' DC 140 H1' C 140 1.272 16.958 10.002 188 H41 DC 140 1H4 C 140 -4.031 18.944 7.143 189 H42 DC 140 2H4 C 140 -5.024 18.384 8.472 190 H8 DG 141 8H G 141 -3.433 21.563 0.860 191 H1 DG 141 1H G 141 -1.569 18.788 6.353 192 H5' DG 141 H5' G 141 -0.740 24.582 -0.564 193 H5'' DG 141 H5" G 141 -0.966 23.935 -2.199 194 H4' DG 141 H4' G 141 0.893 22.894 -0.941 195 H3' DG 141 H3' G 141 -0.886 21.470 -2.525 196 H2' DG 141 H2' G 141 -2.162 20.631 -0.798 197 H2'' DG 141 H2" G 141 -0.971 19.328 -0.820 198 H1' DG 141 H1' G 141 0.260 20.270 0.985 199 H21 DG 141 1H2 G 141 0.524 18.251 6.267 200 H22 DG 141 2H2 G 141 1.468 18.435 4.796 201 H5 DC 142 5H C 142 -2.620 17.779 0.429 202 H6 DC 142 6H C 142 -0.267 17.321 -0.029 203 H5' DC 142 H5' C 142 2.033 19.598 0.352 204 H5'' DC 142 H5" C 142 3.254 19.238 -0.848 205 H4' DC 142 H4' C 142 3.978 18.005 0.882 206 H3' DC 142 H3' C 142 3.143 16.559 -1.318 207 H2' DC 142 H2' C 142 1.104 15.910 -0.535 208 H2'' DC 142 H2" C 142 1.939 14.589 0.177 209 H1' DC 142 H1' C 142 1.968 15.525 2.348 210 H41 DC 142 1H4 C 142 -4.146 16.791 3.617 211 H42 DC 142 2H4 C 142 -4.353 17.615 2.086 212 H8 DG 143 8H G 143 1.547 12.994 1.326 213 H1 DG 143 1H G 143 -3.734 12.465 4.885 214 H5' DG 143 H5' G 143 4.357 15.379 3.352 215 H5'' DG 143 H5" G 143 5.771 14.421 2.898 216 H4' DG 143 H4' G 143 4.966 13.529 4.977 217 H3' DG 143 H3' G 143 5.293 11.924 2.727 218 H2' DG 143 H2' G 143 3.093 11.822 2.086 219 H2'' DG 143 H2" G 143 3.020 10.439 3.139 220 H1' DG 143 H1' G 143 2.053 11.655 4.917 221 H21 DG 143 1H2 G 143 -3.244 11.756 6.881 222 H22 DG 143 2H2 G 143 -1.582 11.430 7.356 223 H5 DC 144 5H C 144 0.798 9.522 1.956 224 H6 DC 144 6H C 144 1.805 8.799 4.061 225 H5' DC 144 H5' C 144 3.085 10.938 6.452 226 H5'' DC 144 H5" C 144 4.334 9.931 7.159 227 H4' DC 144 H4' C 144 2.468 9.448 8.408 228 H3' DC 144 H3' C 144 3.659 7.406 6.970 229 H2' DC 144 H2' C 144 2.135 7.111 5.292 230 H2'' DC 144 H2" C 144 1.269 6.144 6.483 231 H1' DC 144 H1' C 144 -0.229 7.820 7.028 232 H41 DC 144 1H4 C 144 -2.855 9.835 1.646 233 H42 DC 144 2H4 C 144 -1.292 10.234 0.958 234 H8 DA 145 8H A 145 -0.301 4.915 6.009 235 H2 DA 145 2H A 145 -6.342 6.117 4.360 236 H5' DA 145 H5' A 145 0.055 7.279 9.574 237 H5'' DA 145 H5" A 145 0.191 6.022 10.818 238 H4' DA 145 H4' A 145 -2.118 6.348 10.375 239 H3' DA 145 H3' A 145 -0.963 3.814 10.105 240 H2' DA 145 H2' A 145 -1.014 3.792 7.776 241 H2'' DA 145 H2" A 145 -2.639 3.141 8.030 242 H1' DA 145 H1' A 145 -3.688 5.268 7.856 243 H61 DA 145 2H6 A 145 -1.926 6.052 1.606 244 H62 DA 145 1H6 A 145 -3.524 6.396 0.967 245 H8 DG 146 8H G 146 -3.815 1.620 7.165 246 H1 DG 146 1H G 146 -5.764 3.340 1.322 247 H5' DG 146 H5' G 146 -5.289 4.669 9.964 248 H5'' DG 146 H5" G 146 -6.462 4.388 11.232 249 H4' DG 146 H4' G 146 -7.871 3.989 9.530 250 H3' DG 146 H3' G 146 -6.827 1.470 10.408 251 H2' DG 146 H2' G 146 -5.557 1.090 8.509 252 H2'' DG 146 H2" G 146 -7.102 0.482 7.861 253 H1' DG 146 H1' G 146 -7.624 2.569 6.834 254 H21 DG 146 1H2 G 146 -7.888 3.563 1.264 255 H22 DG 146 2H2 G 146 -8.865 3.511 2.709 256 H8 DA 147 8H A 147 -6.805 -1.201 6.445 257 H2 DA 147 2H A 147 -6.517 0.296 0.229 258 H5' DA 147 H5' A 147 -10.193 1.881 7.457 259 H5'' DA 147 H5" A 147 -11.531 0.753 7.752 260 H4' DA 147 H4' A 147 -11.221 1.069 5.339 261 H3' DA 147 H3' A 147 -11.169 -1.478 6.663 262 H2' DA 147 H2' A 147 -8.977 -1.968 6.137 263 H2'' DA 147 H2" A 147 -9.673 -2.468 4.560 264 H1' DA 147 H1' A 147 -9.332 -0.300 3.615 265 H61 DA 147 2H6 A 147 -2.768 -0.562 3.769 266 H62 DA 147 1H6 A 147 -2.514 -0.342 2.042 267 H5 DC 148 5H C 148 -7.073 -3.480 3.265 268 H6 DC 148 6H C 148 -9.377 -3.367 2.450 269 H5' DC 148 H5' C 148 -12.430 -0.702 1.916 270 H5'' DC 148 H5" C 148 -13.833 -1.791 1.782 271 H4' DC 148 H4' C 148 -12.786 -1.675 -0.393 272 H3' DC 148 H3' C 148 -13.182 -4.127 0.916 273 H2' DC 148 H2' C 148 -10.955 -4.420 1.539 274 H2'' DC 148 H2" C 148 -10.869 -5.246 -0.025 275 H1' DC 148 H1' C 148 -10.198 -3.246 -1.184 276 H41 DC 148 1H4 C 148 -4.235 -3.099 0.978 277 H42 DC 148 2H4 C 148 -4.774 -3.375 2.622 278 H8 DG 149 8H G 149 -9.159 -6.953 -0.932 279 H1 DG 149 1H G 149 -2.834 -5.746 -1.095 280 H5' DG 149 H5' G 149 -10.917 -3.573 -3.107 281 H5'' DG 149 H5" G 149 -12.112 -4.358 -4.121 282 H4' DG 149 H4' G 149 -10.128 -4.451 -5.358 283 H3' DG 149 H3' G 149 -11.484 -6.760 -4.535 284 H2' DG 149 H2' G 149 -10.034 -7.384 -2.885 285 H2'' DG 149 H2" G 149 -9.224 -8.252 -4.178 286 H1' DG 149 H1' G 149 -7.623 -6.459 -4.497 287 H21 DG 149 1H2 G 149 -2.174 -5.470 -3.140 288 H22 DG 149 2H2 G 149 -3.304 -5.488 -4.481 289 H5 DC 150 5H C 150 -6.974 -9.500 -1.674 290 H6 DC 150 6H C 150 -7.141 -9.803 -4.091 291 H5' DC 150 H5' C 150 -8.212 -9.078 -5.752 292 H5'' DC 150 H5" C 150 -7.988 -7.407 -6.330 293 H4' DC 150 H4' C 150 -6.679 -8.262 -8.220 294 H3' DC 150 H3' C 150 -7.742 -10.745 -7.697 295 H2' DC 150 H2' C 150 -6.747 -11.160 -5.678 296 H2'' DC 150 H2" C 150 -5.436 -11.702 -6.690 297 H1' DC 150 H1' C 150 -4.130 -9.761 -6.323 298 H41 DC 150 1H4 C 150 -3.695 -9.259 -0.023 299 H42 DC 150 2H4 C 150 -5.437 -9.186 0.178 300 H5 DC 151 5H C 151 -5.141 -12.784 -4.393 301 H6 DC 151 6H C 151 -3.938 -12.885 -6.515 302 H5' DC 151 H5' C 151 -3.547 -10.184 -8.995 303 H5'' DC 151 H5" C 151 -3.287 -11.075 -10.500 304 H4' DC 151 H4' C 151 -1.180 -10.842 -9.452 305 H3' DC 151 H3' C 151 -2.108 -13.375 -10.074 306 H2' DC 151 H2' C 151 -2.779 -13.931 -7.901 307 H2'' DC 151 H2" C 151 -1.136 -14.562 -7.809 308 H1' DC 151 H1' C 151 -0.264 -12.565 -6.765 309 H41 DC 151 1H4 C 151 -3.302 -12.902 -1.222 310 H42 DC 151 2H4 C 151 -4.865 -12.794 -1.998 311 H5 DC 152 5H C 152 -3.097 -15.828 -5.044 312 H6 DC 152 6H C 152 -0.882 -15.895 -6.094 313 H5' DC 152 H5' C 152 1.592 -13.259 -7.452 314 H5'' DC 152 H5" C 152 2.928 -13.935 -8.386 315 H4' DC 152 H4' C 152 3.507 -14.587 -6.212 316 H3' DC 152 H3' C 152 2.469 -16.701 -7.922 317 H2' DC 152 H2' C 152 0.777 -17.262 -6.543 318 H2'' DC 152 H2" C 152 1.979 -18.087 -5.547 319 H1' DC 152 H1' C 152 2.261 -16.227 -4.094 320 H41 DC 152 1H4 C 152 -3.457 -16.188 -1.394 321 H42 DC 152 2H4 C 152 -4.265 -15.990 -2.938 322 H5 DC 153 5H C 153 -1.373 -19.473 -4.652 323 H6 DC 153 6H C 153 0.990 -20.086 -4.453 324 H5' DC 153 H5' C 153 4.538 -17.590 -4.101 325 H5'' DC 153 H5" C 153 5.897 -18.656 -4.470 326 H4' DC 153 H4' C 153 5.224 -19.246 -2.289 327 H3' DC 153 H3' C 153 4.904 -21.232 -4.333 328 H2' DC 153 H2' C 153 2.613 -21.315 -4.170 329 H2'' DC 153 H2" C 153 2.923 -22.401 -2.815 330 H1' DC 153 H1' C 153 2.724 -20.564 -1.159 331 H41 DC 153 1H4 C 153 -3.504 -19.199 -1.677 332 H42 DC 153 2H4 C 153 -3.440 -19.396 -3.425 333 H5 DC 154 5H C 154 -0.195 -22.764 -3.120 334 H6 DC 154 6H C 154 1.659 -23.420 -1.637 335 H5' DC 154 H5' C 154 4.737 -21.832 0.051 336 H5'' DC 154 H5" C 154 5.825 -23.168 0.475 337 H4' DC 154 H4' C 154 4.139 -23.050 2.158 338 H3' DC 154 H3' C 154 4.504 -25.376 0.544 339 H2' DC 154 H2' C 154 2.412 -25.367 -0.417 340 H2'' DC 154 H2" C 154 1.928 -26.116 1.131 341 H1' DC 154 H1' C 154 1.181 -24.059 2.040 342 H41 DC 154 1H4 C 154 -3.670 -22.748 -1.839 343 H42 DC 154 2H4 C 154 -2.614 -22.463 -3.211 344 H8 DG 155 8H G 155 0.516 -27.666 0.954 345 H1 DG 155 1H G 155 -5.506 -25.857 -0.312 346 H5' DG 155 H5' G 155 2.315 -25.529 4.585 347 H5'' DG 155 H5" G 155 2.804 -26.947 5.549 348 H4' DG 155 H4' G 155 0.418 -26.483 5.863 349 H3' DG 155 H3' G 155 1.456 -28.983 4.991 350 H2' DG 155 H2' G 155 0.459 -28.923 2.905 351 H2'' DG 155 H2" G 155 -0.963 -29.504 3.818 352 H1' DG 155 H1' G 155 -1.856 -27.279 4.057 353 H21 DG 155 1H2 G 155 -6.698 -25.832 1.503 354 H22 DG 155 2H2 G 155 -6.007 -26.208 3.075 355 H5 DC 156 5H C 156 -1.586 -30.502 1.093 356 H6 DC 156 6H C 156 -2.430 -30.871 3.368 357 H5' DC 156 H5' C 156 -2.632 -28.760 7.016 358 H5'' DC 156 H5" C 156 -2.944 -30.097 8.143 359 H4' DC 156 H4' C 156 -5.001 -29.432 7.018 360 H3' DC 156 H3' C 156 -3.953 -32.088 6.942 361 H2' DC 156 H2' C 156 -3.722 -32.219 4.643 362 H2'' DC 156 H2" C 156 -5.503 -32.431 4.718 363 H1' DC 156 H1' C 156 -5.986 -30.188 4.330 364 H41 DC 156 1H4 C 156 -3.856 -29.331 -1.570 365 H42 DC 156 2H4 C 156 -2.203 -29.698 -1.116 366 H8 DG 157 8H G 157 -6.407 -34.775 4.699 367 H1 DG 157 1H G 157 -6.927 -32.279 -1.181 368 H5' DG 157 H5' G 157 -8.658 -31.484 7.221 369 H5'' DG 157 H5" G 157 -9.483 -32.621 8.311 370 H4' DG 157 H4' G 157 -10.767 -32.330 6.244 371 H3' DG 157 H3' G 157 -10.153 -34.887 7.160 372 H2' DG 157 H2' G 157 -8.336 -35.230 5.673 373 H2'' DG 157 H2" G 157 -9.657 -35.882 4.651 374 H1' DG 157 H1' G 157 -9.989 -33.790 3.557 375 H21 DG 157 1H2 G 157 -9.007 -31.842 -1.603 376 H22 DG 157 2H2 G 157 -10.249 -31.999 -0.376 377 HA ALA 1 HA ALA 1 0.353 29.095 -1.330 378 H1 ALA 1 HN ALA 1 -0.279 26.775 -1.882 379 HB1 ALA 1 1HB ALA 1 0.732 29.692 1.040 380 HB2 ALA 1 2HB ALA 1 -0.939 29.153 0.775 381 HB3 ALA 1 3HB ALA 1 0.236 28.059 1.541 382 H SER 2 HN SER 2 1.474 25.916 -0.479 383 HA SER 2 HA SER 2 4.233 26.638 0.143 384 HG SER 2 HG SER 2 5.395 24.414 -0.762 385 HB2 SER 2 2HB SER 2 3.169 24.548 0.981 386 HB3 SER 2 3HB SER 2 3.032 23.960 -0.693 387 H GLU 3 HN GLU 3 2.537 26.838 -2.726 388 HA GLU 3 HA GLU 3 4.454 25.666 -4.571 389 HB2 GLU 3 2HB GLU 3 2.136 27.625 -4.964 390 HB3 GLU 3 3HB GLU 3 3.088 26.936 -6.281 391 HG2 GLU 3 2HG GLU 3 0.996 25.743 -6.060 392 HG3 GLU 3 3HG GLU 3 2.364 24.688 -5.738 393 H LYS 4 HN LYS 4 6.243 26.921 -3.230 394 HA LYS 4 HA LYS 4 6.825 29.485 -4.700 395 HB2 LYS 4 2HB LYS 4 7.460 28.843 -1.789 396 HB3 LYS 4 3HB LYS 4 7.848 30.347 -2.621 397 HG2 LYS 4 2HG LYS 4 5.040 29.310 -2.072 398 HG3 LYS 4 3HG LYS 4 5.875 30.514 -1.107 399 HD2 LYS 4 2HD LYS 4 5.870 32.137 -2.861 400 HD3 LYS 4 3HD LYS 4 5.360 30.969 -4.077 401 HE2 LYS 4 2HE LYS 4 3.657 31.852 -1.719 402 HE3 LYS 4 3HE LYS 4 3.526 32.455 -3.383 403 HZ1 LYS 4 3HZ LYS 4 1.938 30.767 -3.125 404 HZ2 LYS 4 1HZ LYS 4 3.017 29.728 -2.427 405 HZ3 LYS 4 2HZ LYS 4 3.154 30.097 -4.031 406 H ARG 5 HN ARG 5 7.846 26.312 -3.983 407 HA ARG 5 HA ARG 5 10.449 26.776 -5.242 408 HE ARG 5 HE ARG 5 9.973 24.121 0.237 409 HB2 ARG 5 2HB ARG 5 11.783 25.806 -3.373 410 HB3 ARG 5 3HB ARG 5 11.013 27.299 -2.947 411 HG2 ARG 5 2HG ARG 5 10.861 25.990 -1.051 412 HG3 ARG 5 3HG ARG 5 9.223 25.952 -1.702 413 HD2 ARG 5 2HD ARG 5 9.476 23.690 -2.435 414 HD3 ARG 5 3HD ARG 5 11.250 23.795 -2.348 415 HH11 ARG 5 1HH2 ARG 5 11.038 21.651 -2.056 416 HH12 ARG 5 2HH2 ARG 5 11.470 20.537 -0.757 417 HH21 ARG 5 1HH1 ARG 5 10.438 22.575 1.801 418 HH22 ARG 5 2HH1 ARG 5 11.065 21.018 1.307 419 HA PRO 6 HA PRO 6 9.927 22.699 -6.868 420 HB2 PRO 6 2HB PRO 6 12.631 22.025 -5.665 421 HB3 PRO 6 3HB PRO 6 12.032 21.712 -7.323 422 HG2 PRO 6 2HG PRO 6 13.703 23.781 -6.883 423 HG3 PRO 6 3HG PRO 6 12.252 24.033 -7.909 424 HD2 PRO 6 2HD PRO 6 12.650 24.737 -5.000 425 HD3 PRO 6 3HD PRO 6 11.924 25.725 -6.313 426 H PHE 7 HN PHE 7 8.962 20.820 -6.234 427 HA PHE 7 HA PHE 7 8.499 20.420 -3.364 428 HD1 PHE 7 1HD PHE 7 5.493 20.015 -3.121 429 HD2 PHE 7 2HD PHE 7 6.900 20.567 -7.163 430 HE1 PHE 7 1HE PHE 7 3.680 21.665 -3.534 431 HE2 PHE 7 2HE PHE 7 5.108 22.234 -7.550 432 HZ PHE 7 HZ PHE 7 3.513 22.795 -5.733 433 HB2 PHE 7 2HB PHE 7 7.737 18.717 -5.778 434 HB3 PHE 7 3HB PHE 7 7.157 18.472 -4.133 435 H MET 8 HN MET 8 9.033 18.448 -2.188 436 HA MET 8 HA MET 8 10.989 16.691 -3.537 437 HB2 MET 8 2HB MET 8 12.476 16.579 -1.607 438 HB3 MET 8 3HB MET 8 12.369 18.226 -2.231 439 HG2 MET 8 2HG MET 8 10.633 18.712 -0.447 440 HG3 MET 8 3HG MET 8 10.984 17.136 0.248 441 HE1 MET 8 3HE MET 8 14.002 16.686 0.151 442 HE2 MET 8 1HE MET 8 14.528 17.447 1.667 443 HE3 MET 8 2HE MET 8 13.009 16.520 1.615 444 H CYS 9 HN CYS 9 11.174 14.586 -2.709 445 HA CYS 9 HA CYS 9 8.781 13.487 -1.462 446 HB2 CYS 9 2HB CYS 9 10.231 12.155 -2.979 447 HB3 CYS 9 3HB CYS 9 11.566 12.267 -1.825 448 H ALA 10 HN ALA 10 8.810 12.278 0.619 449 HA ALA 10 HA ALA 10 10.227 13.906 2.683 450 HB1 ALA 10 1HB ALA 10 8.384 13.168 4.185 451 HB2 ALA 10 2HB ALA 10 7.818 14.052 2.756 452 HB3 ALA 10 3HB ALA 10 7.652 12.276 2.829 453 H TYR 11 HN TYR 11 9.808 10.605 1.432 454 HA TYR 11 HA TYR 11 10.521 9.123 3.701 455 HD1 TYR 11 1HD TYR 11 9.092 7.031 3.520 456 HD2 TYR 11 2HD TYR 11 12.633 6.346 1.169 457 HE1 TYR 11 1HE TYR 11 9.241 4.699 4.405 458 HE2 TYR 11 2HE TYR 11 12.789 4.033 2.073 459 HH TYR 11 HH TYR 11 10.308 2.605 4.109 460 HB2 TYR 11 2HB TYR 11 9.762 8.389 1.346 461 HB3 TYR 11 3HB TYR 11 11.461 8.407 0.909 462 HA PRO 12 HA PRO 12 14.590 10.614 4.462 463 HB2 PRO 12 2HB PRO 12 15.338 8.980 6.561 464 HB3 PRO 12 3HB PRO 12 14.006 10.147 6.662 465 HG2 PRO 12 2HG PRO 12 13.776 7.191 6.005 466 HG3 PRO 12 3HG PRO 12 12.914 8.106 7.288 467 HD2 PRO 12 2HD PRO 12 11.771 7.658 4.876 468 HD3 PRO 12 3HD PRO 12 11.567 9.241 5.700 469 H GLY 13 HN GLY 13 14.734 9.296 2.099 470 HA2 GLY 13 2HA GLY 13 17.442 8.326 2.099 471 HA3 GLY 13 3HA GLY 13 16.302 6.984 1.877 472 H CYS 14 HN CYS 14 14.304 8.733 0.523 473 HA CYS 14 HA CYS 14 15.469 8.821 -2.176 474 HB2 CYS 14 2HB CYS 14 13.249 7.940 -2.090 475 HB3 CYS 14 3HB CYS 14 12.683 9.229 -1.021 476 H ASN 15 HN ASN 15 13.387 11.121 -0.338 477 HA ASN 15 HA ASN 15 13.226 13.423 -0.484 478 HB2 ASN 15 2HB ASN 15 15.212 14.621 0.325 479 HB3 ASN 15 3HB ASN 15 14.910 13.166 1.242 480 HD21 ASN 15 1HD2 ASN 15 16.889 14.167 -1.583 481 HD22 ASN 15 2HD2 ASN 15 18.328 13.279 -0.996 482 H LYS 16 HN LYS 16 13.312 12.268 -3.076 483 HA LYS 16 HA LYS 16 15.126 13.878 -4.760 484 HB2 LYS 16 2HB LYS 16 12.787 12.026 -5.354 485 HB3 LYS 16 3HB LYS 16 13.658 12.894 -6.622 486 HG2 LYS 16 2HG LYS 16 15.730 11.765 -6.144 487 HG3 LYS 16 3HG LYS 16 15.082 11.081 -4.653 488 HD2 LYS 16 2HD LYS 16 13.315 9.894 -6.126 489 HD3 LYS 16 3HD LYS 16 14.290 10.390 -7.514 490 HE2 LYS 16 2HE LYS 16 14.826 8.104 -6.854 491 HE3 LYS 16 3HE LYS 16 16.233 9.145 -6.561 492 HZ1 LYS 16 3HZ LYS 16 14.265 8.472 -4.473 493 HZ2 LYS 16 1HZ LYS 16 15.704 9.183 -4.264 494 HZ3 LYS 16 2HZ LYS 16 15.656 7.593 -4.713 495 H ARG 17 HN ARG 17 14.369 15.426 -6.331 496 HA ARG 17 HA ARG 17 12.211 17.059 -5.108 497 HE ARG 17 HE ARG 17 15.096 19.667 -2.724 498 HB2 ARG 17 2HB ARG 17 14.715 17.660 -6.699 499 HB3 ARG 17 3HB ARG 17 13.356 18.769 -6.832 500 HG2 ARG 17 2HG ARG 17 14.892 19.544 -5.145 501 HG3 ARG 17 3HG ARG 17 13.318 19.185 -4.449 502 HD2 ARG 17 2HD ARG 17 14.185 17.094 -3.477 503 HD3 ARG 17 3HD ARG 17 15.757 17.369 -4.256 504 HH11 ARG 17 1HH2 ARG 17 15.934 16.309 -1.963 505 HH12 ARG 17 2HH2 ARG 17 16.868 16.813 -0.568 506 HH21 ARG 17 1HH1 ARG 17 16.148 20.155 -0.856 507 HH22 ARG 17 2HH1 ARG 17 16.907 18.890 0.078 508 H TYR 18 HN TYR 18 10.369 17.462 -6.082 509 HA TYR 18 HA TYR 18 9.988 16.532 -8.887 510 HD1 TYR 18 2HD TYR 18 9.796 15.079 -5.299 511 HD2 TYR 18 1HD TYR 18 7.750 14.088 -8.969 512 HE1 TYR 18 2HE TYR 18 10.476 12.714 -5.068 513 HE2 TYR 18 1HE TYR 18 8.535 11.764 -8.774 514 HH TYR 18 HH TYR 18 10.293 10.556 -6.011 515 HB2 TYR 18 2HB TYR 18 8.199 16.687 -6.456 516 HB3 TYR 18 3HB TYR 18 7.580 16.323 -8.052 517 H PHE 19 HN PHE 19 8.023 17.575 -9.979 518 HA PHE 19 HA PHE 19 8.160 20.545 -9.540 519 HD1 PHE 19 2HD PHE 19 8.776 22.434 -11.144 520 HD2 PHE 19 1HD PHE 19 6.332 19.874 -13.605 521 HE1 PHE 19 2HE PHE 19 7.870 24.423 -12.320 522 HE2 PHE 19 1HE PHE 19 5.425 21.871 -14.774 523 HZ PHE 19 HZ PHE 19 6.194 24.145 -14.132 524 HB2 PHE 19 2HB PHE 19 9.247 19.838 -11.605 525 HB3 PHE 19 3HB PHE 19 7.844 18.897 -12.090 526 H LYS 20 HN LYS 20 6.023 17.919 -10.849 527 HA LYS 20 HA LYS 20 3.635 19.612 -10.576 528 HB2 LYS 20 2HB LYS 20 4.233 16.837 -11.571 529 HB3 LYS 20 3HB LYS 20 2.563 17.210 -11.059 530 HG2 LYS 20 2HG LYS 20 2.533 19.117 -12.615 531 HG3 LYS 20 3HG LYS 20 4.205 18.771 -13.096 532 HD2 LYS 20 2HD LYS 20 3.505 16.560 -13.981 533 HD3 LYS 20 3HD LYS 20 1.847 16.861 -13.434 534 HE2 LYS 20 2HE LYS 20 1.930 17.310 -15.793 535 HE3 LYS 20 3HE LYS 20 1.727 18.849 -14.945 536 HZ1 LYS 20 3HZ LYS 20 4.268 17.793 -16.009 537 HZ2 LYS 20 1HZ LYS 20 4.089 19.230 -15.218 538 HZ3 LYS 20 2HZ LYS 20 3.370 18.996 -16.681 539 H LEU 21 HN LEU 21 2.755 20.000 -8.666 540 HA LEU 21 HA LEU 21 3.497 18.896 -6.230 541 HG LEU 21 HG LEU 21 -0.369 19.295 -6.591 542 HB2 LEU 21 2HB LEU 21 1.624 19.976 -5.299 543 HB3 LEU 21 3HB LEU 21 2.171 20.958 -6.610 544 HD11 LEU 21 1HD1 LEU 21 -0.335 21.189 -5.011 545 HD12 LEU 21 2HD1 LEU 21 -1.422 21.515 -6.367 546 HD13 LEU 21 3HD1 LEU 21 0.178 22.286 -6.310 547 HD21 LEU 21 3HD2 LEU 21 -0.972 20.639 -8.593 548 HD22 LEU 21 1HD2 LEU 21 0.413 19.609 -8.938 549 HD23 LEU 21 2HD2 LEU 21 0.655 21.343 -8.619 550 H SER 22 HN SER 22 0.705 17.868 -8.267 551 HA SER 22 HA SER 22 -0.183 15.766 -6.511 552 HG SER 22 HG SER 22 -1.324 16.464 -10.346 553 HB2 SER 22 2HB SER 22 -1.435 15.009 -8.581 554 HB3 SER 22 3HB SER 22 -1.728 16.683 -8.073 555 H HIS 23 HN HIS 23 2.296 15.903 -9.023 556 HA HIS 23 HA HIS 23 2.316 12.985 -9.491 557 HD1 HIS 23 1HD HIS 23 5.594 13.896 -12.628 558 HD2 HIS 23 2HD HIS 23 5.705 15.915 -8.960 559 HE1 HIS 23 1HE HIS 23 7.755 15.255 -12.595 560 HB2 HIS 23 2HB HIS 23 3.649 13.369 -11.155 561 HB3 HIS 23 3HB HIS 23 3.097 14.978 -11.091 562 H LEU 24 HN LEU 24 4.086 15.441 -7.622 563 HA LEU 24 HA LEU 24 5.818 13.579 -6.294 564 HG LEU 24 HG LEU 24 7.277 16.171 -4.414 565 HB2 LEU 24 2HB LEU 24 6.131 16.018 -6.344 566 HB3 LEU 24 3HB LEU 24 4.749 16.262 -5.350 567 HD11 LEU 24 1HD1 LEU 24 5.330 16.947 -3.170 568 HD12 LEU 24 2HD1 LEU 24 6.351 15.907 -2.165 569 HD13 LEU 24 3HD1 LEU 24 4.841 15.270 -2.846 570 HD21 LEU 24 3HD2 LEU 24 6.471 13.502 -3.309 571 HD22 LEU 24 1HD2 LEU 24 8.029 14.277 -3.425 572 HD23 LEU 24 2HD2 LEU 24 7.338 13.546 -4.860 573 H GLN 25 HN GLN 25 2.580 14.907 -5.376 574 HA GLN 25 HA GLN 25 2.320 13.552 -2.887 575 HB2 GLN 25 2HB GLN 25 0.801 15.343 -3.870 576 HB3 GLN 25 3HB GLN 25 0.053 14.093 -4.880 577 HG2 GLN 25 2HG GLN 25 -0.731 12.898 -2.903 578 HG3 GLN 25 3HG GLN 25 0.243 13.916 -1.837 579 HE21 GLN 25 1HE2 GLN 25 -2.801 13.773 -3.699 580 HE22 GLN 25 2HE2 GLN 25 -3.353 15.315 -3.020 581 H MET 26 HN MET 26 1.649 12.449 -6.242 582 HA MET 26 HA MET 26 0.682 9.831 -5.512 583 HB2 MET 26 2HB MET 26 0.578 11.125 -7.786 584 HB3 MET 26 3HB MET 26 2.173 10.438 -8.099 585 HG2 MET 26 2HG MET 26 -0.335 8.865 -7.362 586 HG3 MET 26 3HG MET 26 0.174 9.182 -9.015 587 HE1 MET 26 3HE MET 26 -0.322 6.494 -9.183 588 HE2 MET 26 1HE MET 26 0.626 5.286 -8.287 589 HE3 MET 26 2HE MET 26 -0.510 6.349 -7.419 590 H HIS 27 HN HIS 27 3.962 11.147 -6.293 591 HA HIS 27 HA HIS 27 5.370 8.708 -6.336 592 HD1 HIS 27 1HD HIS 27 8.015 8.284 -6.781 593 HD2 HIS 27 2HD HIS 27 8.158 11.153 -3.690 594 HE1 HIS 27 1HE HIS 27 9.995 7.659 -5.247 595 HB2 HIS 27 2HB HIS 27 6.487 10.757 -7.030 596 HB3 HIS 27 3HB HIS 27 6.287 11.495 -5.436 597 H SER 28 HN SER 28 4.510 10.786 -3.534 598 HA SER 28 HA SER 28 5.942 9.429 -1.549 599 HG SER 28 HG SER 28 4.836 9.755 0.631 600 HB2 SER 28 2HB SER 28 4.923 11.467 -1.040 601 HB3 SER 28 3HB SER 28 3.291 10.940 -1.473 602 H ARG 29 HN ARG 29 2.848 8.516 -3.099 603 HA ARG 29 HA ARG 29 1.923 6.606 -1.188 604 HE ARG 29 HE ARG 29 -1.981 6.366 -2.398 605 HB2 ARG 29 2HB ARG 29 0.587 7.400 -3.119 606 HB3 ARG 29 3HB ARG 29 1.705 6.598 -4.210 607 HG2 ARG 29 2HG ARG 29 -0.264 5.320 -4.132 608 HG3 ARG 29 3HG ARG 29 1.067 4.392 -3.467 609 HD2 ARG 29 2HD ARG 29 -1.057 4.080 -2.243 610 HD3 ARG 29 3HD ARG 29 0.226 4.700 -1.211 611 HH11 ARG 29 1HH2 ARG 29 0.270 5.870 0.329 612 HH12 ARG 29 2HH2 ARG 29 -0.250 7.396 1.025 613 HH21 ARG 29 1HH1 ARG 29 -2.697 8.049 -1.223 614 HH22 ARG 29 2HH1 ARG 29 -1.887 8.511 0.238 615 H LYS 30 HN LYS 30 4.378 6.385 -3.777 616 HA LYS 30 HA LYS 30 4.745 3.536 -3.770 617 HB2 LYS 30 2HB LYS 30 5.656 5.259 -5.392 618 HB3 LYS 30 3HB LYS 30 6.880 5.679 -4.212 619 HG2 LYS 30 2HG LYS 30 6.516 2.857 -5.312 620 HG3 LYS 30 3HG LYS 30 7.459 4.084 -6.140 621 HD2 LYS 30 2HD LYS 30 8.126 2.835 -3.455 622 HD3 LYS 30 3HD LYS 30 8.954 2.646 -4.988 623 HE2 LYS 30 2HE LYS 30 9.418 5.162 -4.939 624 HE3 LYS 30 3HE LYS 30 8.823 5.154 -3.269 625 HZ1 LYS 30 3HZ LYS 30 11.105 3.619 -4.327 626 HZ2 LYS 30 1HZ LYS 30 10.509 3.450 -2.805 627 HZ3 LYS 30 2HZ LYS 30 11.164 4.893 -3.280 628 H HIS 31 HN HIS 31 6.027 6.147 -1.674 629 HA HIS 31 HA HIS 31 7.856 4.322 -0.280 630 HD1 HIS 31 1HD HIS 31 10.206 4.827 -0.151 631 HD2 HIS 31 2HD HIS 31 8.714 8.539 -1.507 632 HE1 HIS 31 1HE HIS 31 12.091 5.948 -1.407 633 HB2 HIS 31 2HB HIS 31 7.092 7.241 0.051 634 HB3 HIS 31 3HB HIS 31 8.042 6.381 1.260 635 H THR 32 HN THR 32 4.679 5.926 0.489 636 HA THR 32 HA THR 32 4.290 4.998 3.000 637 HB THR 32 HB THR 32 1.919 4.920 2.645 638 HG1 THR 32 1HG THR 32 2.523 4.579 -0.105 639 HG21 THR 32 3HG2 THR 32 1.539 7.080 2.000 640 HG22 THR 32 1HG2 THR 32 2.781 7.096 0.746 641 HG23 THR 32 2HG2 THR 32 3.233 7.130 2.461 642 H GLY 33 HN GLY 33 4.557 2.901 0.208 643 HA2 GLY 33 2HA GLY 33 3.495 0.535 1.650 644 HA3 GLY 33 3HA GLY 33 4.162 0.568 0.007 645 H GLU 34 HN GLU 34 6.267 2.296 1.981 646 HA GLU 34 HA GLU 34 8.035 -0.099 2.378 647 HB2 GLU 34 2HB GLU 34 8.830 2.814 1.818 648 HB3 GLU 34 3HB GLU 34 9.933 1.446 2.039 649 HG2 GLU 34 2HG GLU 34 9.015 0.320 0.063 650 HG3 GLU 34 3HG GLU 34 7.898 1.662 -0.207 651 H LYS 35 HN LYS 35 6.251 0.363 4.421 652 HA LYS 35 HA LYS 35 7.787 1.909 6.477 653 HB2 LYS 35 2HB LYS 35 4.879 1.022 6.330 654 HB3 LYS 35 3HB LYS 35 5.606 1.739 7.771 655 HG2 LYS 35 2HG LYS 35 5.616 3.146 5.062 656 HG3 LYS 35 3HG LYS 35 4.313 3.311 6.238 657 HD2 LYS 35 2HD LYS 35 5.922 4.124 7.944 658 HD3 LYS 35 3HD LYS 35 7.247 3.991 6.766 659 HE2 LYS 35 2HE LYS 35 6.150 5.625 5.303 660 HE3 LYS 35 3HE LYS 35 4.781 5.729 6.427 661 HZ1 LYS 35 3HZ LYS 35 6.398 7.510 6.750 662 HZ2 LYS 35 1HZ LYS 35 7.570 6.412 7.102 663 HZ3 LYS 35 2HZ LYS 35 6.268 6.566 8.098 664 HA PRO 36 HA PRO 36 8.747 -2.427 7.494 665 HB2 PRO 36 2HB PRO 36 11.167 -1.992 8.738 666 HB3 PRO 36 3HB PRO 36 10.948 -1.952 6.971 667 HG2 PRO 36 2HG PRO 36 10.983 0.414 8.872 668 HG3 PRO 36 3HG PRO 36 11.908 0.198 7.351 669 HD2 PRO 36 2HD PRO 36 9.586 1.583 7.415 670 HD3 PRO 36 3HD PRO 36 9.994 0.515 6.028 671 H TYR 37 HN TYR 37 7.114 -2.844 8.985 672 HA TYR 37 HA TYR 37 7.718 -2.102 11.849 673 HD1 TYR 37 1HD TYR 37 5.468 -0.399 12.970 674 HD2 TYR 37 2HD TYR 37 4.621 -1.732 8.960 675 HE1 TYR 37 1HE TYR 37 4.410 1.792 12.477 676 HE2 TYR 37 2HE TYR 37 3.600 0.494 8.455 677 HH TYR 37 HH TYR 37 3.408 3.118 10.812 678 HB2 TYR 37 2HB TYR 37 5.156 -3.339 10.747 679 HB3 TYR 37 3HB TYR 37 5.490 -2.734 12.378 680 H GLN 38 HN GLN 38 7.035 -3.985 13.405 681 HA GLN 38 HA GLN 38 7.674 -6.665 12.263 682 HB2 GLN 38 2HB GLN 38 9.727 -5.625 13.396 683 HB3 GLN 38 3HB GLN 38 8.810 -5.655 14.894 684 HG2 GLN 38 2HG GLN 38 8.631 -8.323 13.959 685 HG3 GLN 38 3HG GLN 38 10.229 -7.819 13.470 686 HE21 GLN 38 1HE2 GLN 38 8.034 -7.959 16.476 687 HE22 GLN 38 2HE2 GLN 38 9.471 -8.180 17.457 688 H CYS 39 HN CYS 39 6.651 -8.392 13.324 689 HA CYS 39 HA CYS 39 4.146 -8.078 14.411 690 HB2 CYS 39 2HB CYS 39 5.130 -10.262 13.741 691 HB3 CYS 39 3HB CYS 39 6.119 -10.256 15.222 692 H ASP 40 HN ASP 40 3.178 -7.667 16.355 693 HA ASP 40 HA ASP 40 4.871 -6.477 18.455 694 HB2 ASP 40 2HB ASP 40 1.842 -6.787 18.355 695 HB3 ASP 40 3HB ASP 40 2.760 -5.714 19.407 696 H PHE 41 HN PHE 41 3.922 -9.617 17.754 697 HA PHE 41 HA PHE 41 2.908 -10.507 20.301 698 HD1 PHE 41 1HD PHE 41 1.246 -12.351 20.301 699 HD2 PHE 41 2HD PHE 41 4.733 -14.292 18.677 700 HE1 PHE 41 1HE PHE 41 0.517 -14.508 21.294 701 HE2 PHE 41 2HE PHE 41 3.997 -16.442 19.650 702 HZ PHE 41 HZ PHE 41 1.898 -16.553 20.978 703 HB2 PHE 41 2HB PHE 41 2.623 -11.637 18.089 704 HB3 PHE 41 3HB PHE 41 4.320 -12.078 18.127 705 H LYS 42 HN LYS 42 3.952 -11.834 21.892 706 HA LYS 42 HA LYS 42 6.513 -10.752 22.666 707 HB2 LYS 42 2HB LYS 42 4.499 -11.570 24.131 708 HB3 LYS 42 3HB LYS 42 5.187 -13.171 23.923 709 HG2 LYS 42 2HG LYS 42 7.422 -11.717 24.744 710 HG3 LYS 42 3HG LYS 42 6.139 -10.800 25.494 711 HD2 LYS 42 2HD LYS 42 6.984 -12.444 27.065 712 HD3 LYS 42 3HD LYS 42 5.320 -12.849 26.640 713 HE2 LYS 42 2HE LYS 42 6.732 -14.867 26.735 714 HE3 LYS 42 3HE LYS 42 6.107 -14.609 25.106 715 HZ1 LYS 42 3HZ LYS 42 8.382 -15.178 24.996 716 HZ2 LYS 42 1HZ LYS 42 8.831 -13.957 26.025 717 HZ3 LYS 42 2HZ LYS 42 8.229 -13.624 24.518 718 H ASP 43 HN ASP 43 5.711 -13.407 20.634 719 HA ASP 43 HA ASP 43 8.479 -14.508 20.896 720 HB2 ASP 43 2HB ASP 43 5.945 -16.201 20.700 721 HB3 ASP 43 3HB ASP 43 7.598 -16.799 20.783 722 H CYS 44 HN CYS 44 7.525 -12.657 18.920 723 HA CYS 44 HA CYS 44 7.910 -14.354 16.508 724 HB2 CYS 44 2HB CYS 44 5.459 -13.808 16.703 725 HB3 CYS 44 3HB CYS 44 5.882 -12.085 16.668 726 H GLU 45 HN GLU 45 8.544 -12.993 14.594 727 HA GLU 45 HA GLU 45 9.711 -10.369 15.206 728 HB2 GLU 45 2HB GLU 45 11.973 -10.945 14.482 729 HB3 GLU 45 3HB GLU 45 11.528 -11.879 15.899 730 HG2 GLU 45 2HG GLU 45 11.161 -13.885 14.535 731 HG3 GLU 45 3HG GLU 45 11.447 -12.977 13.050 732 H ARG 46 HN ARG 46 7.627 -11.724 13.403 733 HA ARG 46 HA ARG 46 8.714 -11.658 10.692 734 HE ARG 46 HE ARG 46 5.331 -13.917 12.796 735 HB2 ARG 46 2HB ARG 46 5.944 -11.929 11.909 736 HB3 ARG 46 3HB ARG 46 6.131 -11.615 10.181 737 HG2 ARG 46 2HG ARG 46 7.418 -13.571 9.796 738 HG3 ARG 46 3HG ARG 46 7.626 -13.898 11.519 739 HD2 ARG 46 2HD ARG 46 4.883 -13.889 10.209 740 HD3 ARG 46 3HD ARG 46 5.927 -15.324 10.237 741 HH11 ARG 46 1HH1 ARG 46 4.898 -16.927 11.032 742 HH12 ARG 46 2HH1 ARG 46 4.693 -17.817 12.532 743 HH21 ARG 46 1HH2 ARG 46 5.083 -15.004 14.492 744 HH22 ARG 46 2HH2 ARG 46 4.813 -16.759 14.505 745 H ARG 47 HN ARG 47 9.037 -9.933 9.454 746 HA ARG 47 HA ARG 47 8.080 -7.319 10.449 747 HE ARG 47 HE ARG 47 11.267 -9.219 11.248 748 HB2 ARG 47 2HB ARG 47 10.288 -8.249 8.613 749 HB3 ARG 47 3HB ARG 47 9.674 -6.611 8.424 750 HG2 ARG 47 2HG ARG 47 10.680 -5.833 10.249 751 HG3 ARG 47 3HG ARG 47 10.166 -7.172 11.261 752 HD2 ARG 47 2HD ARG 47 12.477 -7.436 9.302 753 HD3 ARG 47 3HD ARG 47 12.678 -6.822 10.953 754 HH11 ARG 47 1HH1 ARG 47 14.529 -8.377 10.179 755 HH12 ARG 47 2HH1 ARG 47 15.148 -9.898 10.808 756 HH21 ARG 47 1HH2 ARG 47 12.077 -10.938 11.966 757 HH22 ARG 47 2HH2 ARG 47 13.776 -11.370 11.891 758 H PHE 48 HN PHE 48 7.073 -5.789 9.119 759 HA PHE 48 HA PHE 48 5.850 -6.811 6.588 760 HD1 PHE 48 1HD PHE 48 3.360 -8.160 6.584 761 HD2 PHE 48 2HD PHE 48 4.727 -7.128 10.548 762 HE1 PHE 48 1HE PHE 48 3.091 -10.509 7.299 763 HE2 PHE 48 2HE PHE 48 4.503 -9.495 11.236 764 HZ PHE 48 HZ PHE 48 3.763 -11.195 9.589 765 HB2 PHE 48 2HB PHE 48 4.363 -5.386 8.844 766 HB3 PHE 48 3HB PHE 48 3.692 -5.792 7.267 767 H SER 49 HN SER 49 4.895 -4.975 5.283 768 HA SER 49 HA SER 49 6.768 -2.649 5.550 769 HG SER 49 HG SER 49 6.573 -1.761 2.486 770 HB2 SER 49 2HB SER 49 6.709 -4.308 3.511 771 HB3 SER 49 3HB SER 49 5.289 -3.375 3.002 772 H ARG 50 HN ARG 50 3.663 -3.298 6.391 773 HA ARG 50 HA ARG 50 2.997 -0.440 6.302 774 HE ARG 50 HE ARG 50 -0.711 -2.062 3.197 775 HB2 ARG 50 2HB ARG 50 1.285 -2.512 4.871 776 HB3 ARG 50 3HB ARG 50 0.601 -1.064 5.582 777 HG2 ARG 50 2HG ARG 50 2.268 0.298 4.209 778 HG3 ARG 50 3HG ARG 50 2.531 -1.181 3.266 779 HD2 ARG 50 2HD ARG 50 -0.164 0.178 3.757 780 HD3 ARG 50 3HD ARG 50 0.788 0.350 2.295 781 HH11 ARG 50 1HH1 ARG 50 1.277 -0.619 0.690 782 HH12 ARG 50 2HH1 ARG 50 0.822 -1.876 -0.449 783 HH21 ARG 50 2HH2 ARG 50 -1.202 -3.556 1.646 784 HH22 ARG 50 1HH2 ARG 50 -0.458 -3.431 0.089 785 H SER 51 HN SER 51 1.282 0.137 7.776 786 HA SER 51 HA SER 51 1.266 -1.299 10.238 787 HG SER 51 HG SER 51 1.590 1.488 10.155 788 HB2 SER 51 2HB SER 51 -0.399 0.944 9.057 789 HB3 SER 51 3HB SER 51 -0.907 0.167 10.557 790 H ASP 52 HN ASP 52 -1.070 -1.205 7.512 791 HA ASP 52 HA ASP 52 -3.043 -2.851 8.759 792 HB2 ASP 52 2HB ASP 52 -3.844 -3.189 6.378 793 HB3 ASP 52 3HB ASP 52 -3.684 -1.527 6.952 794 H GLN 53 HN GLN 53 -0.172 -3.657 6.770 795 HA GLN 53 HA GLN 53 -0.774 -6.454 6.414 796 HB2 GLN 53 2HB GLN 53 1.824 -4.886 6.457 797 HB3 GLN 53 3HB GLN 53 1.749 -6.617 6.113 798 HG2 GLN 53 2HG GLN 53 0.572 -6.285 4.076 799 HG3 GLN 53 3HG GLN 53 0.210 -4.597 4.463 800 HE21 GLN 53 1HE2 GLN 53 1.247 -3.979 2.338 801 HE22 GLN 53 2HE2 GLN 53 3.009 -3.938 2.341 802 H LEU 54 HN LEU 54 1.105 -4.615 8.875 803 HA LEU 54 HA LEU 54 1.803 -6.901 10.487 804 HG LEU 54 HG LEU 54 1.242 -4.848 13.219 805 HB2 LEU 54 2HB LEU 54 3.026 -4.869 10.751 806 HB3 LEU 54 3HB LEU 54 1.573 -3.917 10.999 807 HD11 LEU 54 1HD1 LEU 54 2.186 -7.136 12.868 808 HD12 LEU 54 2HD1 LEU 54 2.935 -6.301 14.242 809 HD13 LEU 54 3HD1 LEU 54 3.800 -6.437 12.695 810 HD21 LEU 54 3HD2 LEU 54 4.175 -4.184 13.021 811 HD22 LEU 54 1HD2 LEU 54 3.049 -3.769 14.303 812 HD23 LEU 54 2HD2 LEU 54 2.927 -2.925 12.745 813 H LYS 55 HN LYS 55 -0.926 -4.528 10.661 814 HA LYS 55 HA LYS 55 -2.160 -5.583 13.012 815 HB2 LYS 55 2HB LYS 55 -2.699 -3.374 11.987 816 HB3 LYS 55 3HB LYS 55 -3.408 -4.203 10.611 817 HG2 LYS 55 2HG LYS 55 -5.229 -3.523 11.832 818 HG3 LYS 55 3HG LYS 55 -5.124 -5.218 12.241 819 HD2 LYS 55 2HD LYS 55 -4.122 -2.883 13.946 820 HD3 LYS 55 3HD LYS 55 -5.675 -3.680 14.143 821 HE2 LYS 55 2HE LYS 55 -2.947 -4.925 14.640 822 HE3 LYS 55 3HE LYS 55 -4.124 -4.420 15.847 823 HZ1 LYS 55 3HZ LYS 55 -4.269 -6.758 15.503 824 HZ2 LYS 55 1HZ LYS 55 -4.502 -6.585 13.883 825 HZ3 LYS 55 2HZ LYS 55 -5.655 -6.065 14.946 826 H ARG 56 HN ARG 56 -2.544 -6.409 9.547 827 HA ARG 56 HA ARG 56 -4.565 -8.417 9.862 828 HE ARG 56 HE ARG 56 -1.243 -9.501 6.550 829 HB2 ARG 56 2HB ARG 56 -3.937 -7.522 7.681 830 HB3 ARG 56 3HB ARG 56 -2.291 -8.088 7.872 831 HG2 ARG 56 2HG ARG 56 -3.190 -10.483 7.816 832 HG3 ARG 56 3HG ARG 56 -4.770 -9.778 7.431 833 HD2 ARG 56 2HD ARG 56 -3.694 -10.402 5.354 834 HD3 ARG 56 3HD ARG 56 -3.690 -8.634 5.445 835 HH11 ARG 56 1HH1 ARG 56 -2.754 -9.636 3.346 836 HH12 ARG 56 2HH1 ARG 56 -1.198 -9.734 2.555 837 HH21 ARG 56 1HH2 ARG 56 0.688 -9.698 5.410 838 HH22 ARG 56 2HH2 ARG 56 0.586 -9.749 3.640 839 H HIS 57 HN HIS 57 -0.962 -8.598 9.888 840 HA HIS 57 HA HIS 57 -0.762 -11.396 10.245 841 HD1 HIS 57 1HD HIS 57 1.257 -12.943 10.320 842 HD2 HIS 57 2HD HIS 57 2.675 -10.067 13.035 843 HE1 HIS 57 1HE HIS 57 2.679 -14.186 12.066 844 HB2 HIS 57 2HB HIS 57 1.150 -10.053 9.634 845 HB3 HIS 57 3HB HIS 57 1.104 -9.149 11.151 846 H GLN 58 HN GLN 58 -1.117 -8.779 12.679 847 HA GLN 58 HA GLN 58 -0.737 -10.270 15.028 848 HB2 GLN 58 2HB GLN 58 -2.623 -7.947 14.445 849 HB3 GLN 58 3HB GLN 58 -2.449 -8.668 16.036 850 HG2 GLN 58 2HG GLN 58 -0.351 -7.136 14.488 851 HG3 GLN 58 3HG GLN 58 -1.005 -6.807 16.082 852 HE21 GLN 58 1HE2 GLN 58 1.531 -8.337 14.347 853 HE22 GLN 58 2HE2 GLN 58 2.221 -9.296 15.651 854 H ARG 59 HN ARG 59 -3.583 -10.203 12.852 855 HA ARG 59 HA ARG 59 -5.484 -11.452 14.583 856 HE ARG 59 HE ARG 59 -7.050 -7.696 11.733 857 HB2 ARG 59 2HB ARG 59 -5.248 -11.793 11.566 858 HB3 ARG 59 3HB ARG 59 -6.669 -12.078 12.566 859 HG2 ARG 59 2HG ARG 59 -6.729 -9.689 13.239 860 HG3 ARG 59 3HG ARG 59 -5.307 -9.377 12.248 861 HD2 ARG 59 2HD ARG 59 -6.574 -10.159 10.246 862 HD3 ARG 59 3HD ARG 59 -8.041 -10.203 11.254 863 HH11 ARG 59 1HH1 ARG 59 -7.856 -9.295 8.704 864 HH12 ARG 59 2HH1 ARG 59 -7.847 -7.769 7.819 865 HH21 ARG 59 1HH2 ARG 59 -7.164 -5.817 10.572 866 HH22 ARG 59 2HH2 ARG 59 -7.552 -5.878 8.869 867 H ARG 60 HN ARG 60 -2.785 -12.804 12.687 868 HA ARG 60 HA ARG 60 -3.514 -15.595 12.836 869 HE ARG 60 HE ARG 60 0.782 -18.364 12.078 870 HB2 ARG 60 2HB ARG 60 -1.730 -14.694 11.345 871 HB3 ARG 60 3HB ARG 60 -0.752 -14.301 12.770 872 HG2 ARG 60 2HG ARG 60 -0.583 -16.687 13.366 873 HG3 ARG 60 3HG ARG 60 -1.515 -17.103 11.922 874 HD2 ARG 60 2HD ARG 60 0.285 -15.920 10.557 875 HD3 ARG 60 3HD ARG 60 1.169 -15.666 12.064 876 HH11 ARG 60 1HH2 ARG 60 2.239 -16.280 9.606 877 HH12 ARG 60 2HH2 ARG 60 3.320 -17.559 9.098 878 HH21 ARG 60 1HH1 ARG 60 2.188 -19.889 11.349 879 HH22 ARG 60 2HH1 ARG 60 3.313 -19.519 10.065 880 H HIS 61 HN HIS 61 -1.870 -13.381 15.122 881 HA HIS 61 HA HIS 61 -1.165 -15.623 16.929 882 HD1 HIS 61 1HD HIS 61 1.265 -15.967 17.551 883 HD2 HIS 61 2HD HIS 61 1.594 -12.262 15.580 884 HE1 HIS 61 1HE HIS 61 3.564 -15.927 16.432 885 HB2 HIS 61 2HB HIS 61 -0.635 -12.624 16.944 886 HB3 HIS 61 3HB HIS 61 -0.292 -13.640 18.340 887 H THR 62 HN THR 62 -3.539 -13.012 16.653 888 HA THR 62 HA THR 62 -4.473 -13.375 19.437 889 HB THR 62 HB THR 62 -6.133 -11.581 18.791 890 HG1 THR 62 1HG THR 62 -4.541 -11.346 16.487 891 HG21 THR 62 3HG2 THR 62 -3.216 -10.918 18.128 892 HG22 THR 62 1HG2 THR 62 -3.951 -10.913 19.740 893 HG23 THR 62 2HG2 THR 62 -4.501 -9.755 18.519 894 H GLY 63 HN GLY 63 -5.246 -14.591 16.253 895 HA2 GLY 63 2HA GLY 63 -6.657 -16.369 15.747 896 HA3 GLY 63 3HA GLY 63 -7.214 -16.387 17.430 897 H VAL 64 HN VAL 64 -7.573 -13.231 16.292 898 HA VAL 64 HA VAL 64 -10.451 -13.448 16.346 899 HB VAL 64 HB VAL 64 -10.454 -11.067 15.864 900 HG11 VAL 64 1HG1 VAL 64 -9.956 -11.836 18.158 901 HG12 VAL 64 2HG1 VAL 64 -8.219 -11.718 17.817 902 HG13 VAL 64 3HG1 VAL 64 -9.231 -10.261 17.796 903 HG21 VAL 64 3HG2 VAL 64 -8.361 -9.758 15.579 904 HG22 VAL 64 1HG2 VAL 64 -7.482 -11.278 15.333 905 HG23 VAL 64 2HG2 VAL 64 -8.738 -10.779 14.184 906 H LYS 65 HN LYS 65 -11.985 -13.219 14.734 907 HA LYS 65 HA LYS 65 -11.023 -13.175 11.909 908 HB2 LYS 65 2HB LYS 65 -13.042 -15.080 13.151 909 HB3 LYS 65 3HB LYS 65 -12.886 -14.786 11.408 910 HG2 LYS 65 2HG LYS 65 -10.659 -15.627 11.352 911 HG3 LYS 65 3HG LYS 65 -10.598 -15.824 13.119 912 HD2 LYS 65 2HD LYS 65 -12.281 -17.596 12.992 913 HD3 LYS 65 3HD LYS 65 -12.509 -17.282 11.258 914 HE2 LYS 65 2HE LYS 65 -10.057 -17.803 10.911 915 HE3 LYS 65 3HE LYS 65 -9.994 -18.341 12.597 916 HZ1 LYS 65 3HZ LYS 65 -11.686 -19.970 12.061 917 HZ2 LYS 65 1HZ LYS 65 -10.389 -20.163 11.065 918 HZ3 LYS 65 2HZ LYS 65 -11.760 -19.442 10.503 919 HA PRO 66 HA PRO 66 -14.060 -9.855 12.906 920 HB2 PRO 66 2HB PRO 66 -12.611 -8.567 10.593 921 HB3 PRO 66 3HB PRO 66 -13.048 -7.863 12.176 922 HG2 PRO 66 2HG PRO 66 -10.492 -8.578 11.669 923 HG3 PRO 66 3HG PRO 66 -11.228 -8.990 13.256 924 HD2 PRO 66 2HD PRO 66 -10.938 -10.737 10.809 925 HD3 PRO 66 3HD PRO 66 -10.510 -11.112 12.509 926 H PHE 67 HN PHE 67 -13.421 -11.541 9.868 927 HA PHE 67 HA PHE 67 -15.856 -10.322 8.605 928 HD1 PHE 67 1HD PHE 67 -11.761 -11.006 8.324 929 HD2 PHE 67 2HD PHE 67 -14.750 -8.777 6.171 930 HE1 PHE 67 1HE PHE 67 -10.251 -9.048 8.265 931 HE2 PHE 67 2HE PHE 67 -13.239 -6.810 6.120 932 HZ PHE 67 HZ PHE 67 -10.988 -6.938 7.162 933 HB2 PHE 67 2HB PHE 67 -13.759 -12.140 7.330 934 HB3 PHE 67 3HB PHE 67 -14.970 -11.160 6.514 935 H GLN 68 HN GLN 68 -17.717 -11.476 8.309 936 HA GLN 68 HA GLN 68 -17.597 -14.461 8.721 937 HB2 GLN 68 2HB GLN 68 -18.678 -13.097 10.666 938 HB3 GLN 68 3HB GLN 68 -19.981 -12.734 9.523 939 HG2 GLN 68 2HG GLN 68 -19.847 -15.435 9.163 940 HG3 GLN 68 3HG GLN 68 -19.148 -15.366 10.744 941 HE21 GLN 68 1HE2 GLN 68 -22.046 -14.663 8.755 942 HE22 GLN 68 2HE2 GLN 68 -23.155 -14.787 10.117 943 H CYS 69 HN CYS 69 -18.699 -15.699 7.275 944 HA CYS 69 HA CYS 69 -19.586 -14.585 4.796 945 HB2 CYS 69 2HB CYS 69 -18.847 -16.941 5.023 946 HB3 CYS 69 3HB CYS 69 -20.242 -17.289 6.057 947 H LYS 70 HN LYS 70 -21.701 -14.506 3.888 948 HA LYS 70 HA LYS 70 -23.778 -13.652 5.865 949 HB2 LYS 70 2HB LYS 70 -24.943 -12.760 3.762 950 HB3 LYS 70 3HB LYS 70 -23.463 -11.978 4.259 951 HG2 LYS 70 2HG LYS 70 -23.342 -12.048 1.933 952 HG3 LYS 70 3HG LYS 70 -22.203 -13.256 2.487 953 HD2 LYS 70 2HD LYS 70 -24.131 -14.966 2.045 954 HD3 LYS 70 3HD LYS 70 -24.916 -13.656 1.167 955 HE2 LYS 70 2HE LYS 70 -23.025 -13.490 -0.365 956 HE3 LYS 70 3HE LYS 70 -22.055 -14.572 0.655 957 HZ1 LYS 70 3HZ LYS 70 -24.497 -15.382 -0.773 958 HZ2 LYS 70 1HZ LYS 70 -23.552 -16.336 0.191 959 HZ3 LYS 70 2HZ LYS 70 -22.946 -15.742 -1.222 960 H THR 71 HN THR 71 -22.765 -16.434 4.440 961 HA THR 71 HA THR 71 -25.539 -17.447 3.903 962 HB THR 71 HB THR 71 -23.409 -19.103 2.720 963 HG1 THR 71 1HG THR 71 -22.249 -17.216 2.545 964 HG21 THR 71 3HG2 THR 71 -25.755 -19.151 2.013 965 HG22 THR 71 1HG2 THR 71 -24.643 -18.774 0.682 966 HG23 THR 71 2HG2 THR 71 -25.603 -17.476 1.429 967 H CYS 72 HN CYS 72 -22.343 -19.053 4.432 968 HA CYS 72 HA CYS 72 -23.683 -21.008 6.201 969 HB2 CYS 72 2HB CYS 72 -21.523 -22.203 6.039 970 HB3 CYS 72 3HB CYS 72 -22.157 -21.793 4.428 971 H GLN 73 HN GLN 73 -22.497 -17.991 6.747 972 HA GLN 73 HA GLN 73 -21.750 -16.862 8.587 973 HB2 GLN 73 2HB GLN 73 -22.282 -19.334 10.277 974 HB3 GLN 73 3HB GLN 73 -22.383 -17.647 10.729 975 HG2 GLN 73 2HG GLN 73 -24.338 -19.183 8.970 976 HG3 GLN 73 3HG GLN 73 -24.602 -18.558 10.587 977 HE21 GLN 73 1HE2 GLN 73 -25.204 -17.879 7.264 978 HE22 GLN 73 2HE2 GLN 73 -25.503 -16.157 7.549 979 H ARG 74 HN ARG 74 -19.881 -18.888 7.095 980 HA ARG 74 HA ARG 74 -17.887 -19.751 8.954 981 HE ARG 74 HE ARG 74 -15.275 -20.036 7.992 982 HB2 ARG 74 2HB ARG 74 -18.083 -19.354 5.988 983 HB3 ARG 74 3HB ARG 74 -16.498 -19.320 6.619 984 HG2 ARG 74 2HG ARG 74 -18.392 -21.660 7.034 985 HG3 ARG 74 3HG ARG 74 -17.129 -21.544 5.809 986 HD2 ARG 74 2HD ARG 74 -16.824 -21.866 8.793 987 HD3 ARG 74 3HD ARG 74 -16.154 -22.856 7.494 988 HH11 ARG 74 2HH2 ARG 74 -14.141 -23.341 7.524 989 HH12 ARG 74 1HH2 ARG 74 -12.472 -22.807 7.602 990 HH21 ARG 74 2HH1 ARG 74 -13.299 -19.470 8.117 991 HH22 ARG 74 1HH1 ARG 74 -12.003 -20.592 7.812 992 H LYS 75 HN LYS 75 -16.546 -18.557 10.181 993 HA LYS 75 HA LYS 75 -16.127 -15.759 9.553 994 HB2 LYS 75 2HB LYS 75 -15.120 -17.604 11.783 995 HB3 LYS 75 3HB LYS 75 -14.635 -15.935 11.611 996 HG2 LYS 75 2HG LYS 75 -16.237 -15.695 13.170 997 HG3 LYS 75 3HG LYS 75 -17.099 -15.288 11.691 998 HD2 LYS 75 2HD LYS 75 -17.925 -17.705 11.672 999 HD3 LYS 75 3HD LYS 75 -17.201 -17.916 13.263 1000 HE2 LYS 75 2HE LYS 75 -18.703 -16.369 14.280 1001 HE3 LYS 75 3HE LYS 75 -19.137 -15.640 12.732 1002 HZ1 LYS 75 3HZ LYS 75 -20.155 -17.744 12.111 1003 HZ2 LYS 75 1HZ LYS 75 -20.895 -17.009 13.383 1004 HZ3 LYS 75 2HZ LYS 75 -19.919 -18.322 13.641 1005 H PHE 76 HN PHE 76 -14.205 -14.704 9.103 1006 HA PHE 76 HA PHE 76 -11.739 -16.293 8.599 1007 HD1 PHE 76 1HD PHE 76 -11.362 -17.676 6.028 1008 HD2 PHE 76 2HD PHE 76 -15.049 -15.426 6.042 1009 HE1 PHE 76 1HE PHE 76 -12.535 -19.560 4.930 1010 HE2 PHE 76 2HE PHE 76 -16.212 -17.319 4.971 1011 HZ PHE 76 HZ PHE 76 -14.959 -19.405 4.425 1012 HB2 PHE 76 2HB PHE 76 -12.932 -14.346 6.577 1013 HB3 PHE 76 3HB PHE 76 -11.405 -15.191 6.415 1014 H SER 77 HN SER 77 -9.797 -14.967 8.589 1015 HA SER 77 HA SER 77 -10.121 -12.506 10.213 1016 HG SER 77 HG SER 77 -8.715 -13.954 12.064 1017 HB2 SER 77 2HB SER 77 -7.626 -14.075 9.436 1018 HB3 SER 77 3HB SER 77 -7.670 -12.720 10.567 1019 H ARG 78 HN ARG 78 -10.005 -13.157 6.948 1020 HA ARG 78 HA ARG 78 -8.713 -10.529 6.349 1021 HE ARG 78 HE ARG 78 -5.957 -12.630 3.324 1022 HB2 ARG 78 2HB ARG 78 -8.073 -13.260 5.237 1023 HB3 ARG 78 3HB ARG 78 -7.923 -11.864 4.176 1024 HG2 ARG 78 2HG ARG 78 -6.295 -10.811 5.576 1025 HG3 ARG 78 3HG ARG 78 -6.621 -11.909 6.920 1026 HD2 ARG 78 2HD ARG 78 -4.520 -12.480 5.938 1027 HD3 ARG 78 3HD ARG 78 -5.666 -13.791 5.689 1028 HH11 ARG 78 2HH1 ARG 78 -2.891 -13.070 5.002 1029 HH12 ARG 78 1HH1 ARG 78 -2.041 -13.258 3.464 1030 HH21 ARG 78 2HH2 ARG 78 -4.864 -12.924 1.536 1031 HH22 ARG 78 1HH2 ARG 78 -3.124 -13.214 1.516 1032 H SER 79 HN SER 79 -9.726 -9.300 4.866 1033 HA SER 79 HA SER 79 -12.416 -9.896 4.064 1034 HG SER 79 HG SER 79 -10.080 -6.756 2.908 1035 HB2 SER 79 2HB SER 79 -12.078 -7.867 2.567 1036 HB3 SER 79 3HB SER 79 -11.741 -7.592 4.283 1037 H ASP 80 HN ASP 80 -9.270 -9.961 2.324 1038 HA ASP 80 HA ASP 80 -10.293 -10.663 -0.212 1039 HB2 ASP 80 2HB ASP 80 -7.979 -11.473 -0.678 1040 HB3 ASP 80 3HB ASP 80 -8.071 -9.873 0.073 1041 H HIS 81 HN HIS 81 -9.475 -12.776 2.588 1042 HA HIS 81 HA HIS 81 -9.869 -15.309 1.185 1043 HD1 HIS 81 1HD HIS 81 -7.447 -15.268 1.504 1044 HD2 HIS 81 2HD HIS 81 -8.105 -15.934 5.604 1045 HE1 HIS 81 1HE HIS 81 -5.247 -15.742 2.463 1046 HB2 HIS 81 2HB HIS 81 -10.001 -14.531 4.142 1047 HB3 HIS 81 3HB HIS 81 -10.252 -16.161 3.557 1048 H LEU 82 HN LEU 82 -11.962 -13.158 3.223 1049 HA LEU 82 HA LEU 82 -14.261 -14.859 3.130 1050 HG LEU 82 HG LEU 82 -16.315 -13.812 3.446 1051 HB2 LEU 82 2HB LEU 82 -13.993 -13.020 4.733 1052 HB3 LEU 82 3HB LEU 82 -14.097 -11.814 3.451 1053 HD11 LEU 82 1HD1 LEU 82 -17.459 -13.317 5.250 1054 HD12 LEU 82 2HD1 LEU 82 -16.712 -11.770 5.568 1055 HD13 LEU 82 3HD1 LEU 82 -15.851 -13.305 5.966 1056 HD21 LEU 82 3HD2 LEU 82 -16.349 -10.764 3.410 1057 HD22 LEU 82 1HD2 LEU 82 -17.738 -11.835 3.122 1058 HD23 LEU 82 2HD2 LEU 82 -16.399 -11.808 1.978 1059 H LYS 83 HN LYS 83 -13.317 -12.045 1.072 1060 HA LYS 83 HA LYS 83 -15.587 -12.130 -0.694 1061 HB2 LYS 83 2HB LYS 83 -13.910 -10.260 -0.496 1062 HB3 LYS 83 3HB LYS 83 -12.709 -11.273 -1.298 1063 HG2 LYS 83 2HG LYS 83 -14.212 -11.352 -3.330 1064 HG3 LYS 83 3HG LYS 83 -15.335 -10.267 -2.486 1065 HD2 LYS 83 2HD LYS 83 -13.469 -8.578 -2.309 1066 HD3 LYS 83 3HD LYS 83 -12.422 -9.685 -3.203 1067 HE2 LYS 83 2HE LYS 83 -13.209 -8.113 -4.798 1068 HE3 LYS 83 3HE LYS 83 -14.094 -9.611 -5.109 1069 HZ1 LYS 83 3HZ LYS 83 -15.938 -8.661 -3.841 1070 HZ2 LYS 83 1HZ LYS 83 -15.551 -7.719 -5.136 1071 HZ3 LYS 83 2HZ LYS 83 -15.092 -7.260 -3.625 1072 H THR 84 HN THR 84 -12.481 -13.903 -0.642 1073 HA THR 84 HA THR 84 -12.808 -15.169 -3.215 1074 HB THR 84 HB THR 84 -11.227 -15.833 -0.719 1075 HG1 THR 84 1HG THR 84 -10.433 -14.146 -1.615 1076 HG21 THR 84 3HG2 THR 84 -9.809 -17.298 -1.920 1077 HG22 THR 84 1HG2 THR 84 -10.947 -17.287 -3.322 1078 HG23 THR 84 2HG2 THR 84 -11.428 -17.978 -1.743 1079 H HIS 85 HN HIS 85 -13.427 -16.287 0.162 1080 HA HIS 85 HA HIS 85 -14.567 -18.815 -0.501 1081 HD1 HIS 85 1HD HIS 85 -15.792 -20.697 1.760 1082 HD2 HIS 85 2HD HIS 85 -17.221 -16.808 2.586 1083 HE1 HIS 85 1HE HIS 85 -18.255 -20.920 2.483 1084 HB2 HIS 85 2HB HIS 85 -13.935 -18.497 1.767 1085 HB3 HIS 85 3HB HIS 85 -14.743 -16.941 1.871 1086 H THR 86 HN THR 86 -15.937 -15.557 -0.296 1087 HA THR 86 HA THR 86 -18.675 -16.116 -0.312 1088 HB THR 86 HB THR 86 -17.133 -13.914 -1.729 1089 HG1 THR 86 1HG THR 86 -16.915 -14.000 0.525 1090 HG21 THR 86 3HG2 THR 86 -19.346 -13.853 -2.708 1091 HG22 THR 86 1HG2 THR 86 -19.040 -12.504 -1.601 1092 HG23 THR 86 2HG2 THR 86 -20.075 -13.865 -1.070 1093 H ARG 87 HN ARG 87 -16.328 -16.158 -3.040 1094 HA ARG 87 HA ARG 87 -18.280 -16.281 -5.132 1095 HE ARG 87 HE ARG 87 -14.192 -13.325 -5.123 1096 HB2 ARG 87 2HB ARG 87 -15.472 -17.354 -5.094 1097 HB3 ARG 87 3HB ARG 87 -16.434 -17.064 -6.540 1098 HG2 ARG 87 2HG ARG 87 -16.338 -14.680 -6.275 1099 HG3 ARG 87 3HG ARG 87 -15.773 -14.820 -4.617 1100 HD2 ARG 87 2HD ARG 87 -13.713 -16.068 -5.630 1101 HD3 ARG 87 3HD ARG 87 -14.211 -15.304 -7.153 1102 HH11 ARG 87 2HH2 ARG 87 -11.728 -15.360 -6.669 1103 HH12 ARG 87 1HH2 ARG 87 -10.452 -14.259 -6.181 1104 HH21 ARG 87 1HH1 ARG 87 -12.505 -11.988 -4.630 1105 HH22 ARG 87 2HH1 ARG 87 -10.873 -12.424 -5.090 1106 H THR 88 HN THR 88 -17.141 -18.695 -2.891 1107 HA THR 88 HA THR 88 -17.739 -21.072 -4.437 1108 HB THR 88 HB THR 88 -17.788 -22.258 -2.350 1109 HG1 THR 88 1HG THR 88 -17.674 -19.792 -0.955 1110 HG21 THR 88 3HG2 THR 88 -15.545 -21.657 -3.073 1111 HG22 THR 88 1HG2 THR 88 -15.655 -21.692 -1.304 1112 HG23 THR 88 2HG2 THR 88 -15.611 -20.139 -2.163 1113 H HIS 89 HN HIS 89 -19.713 -18.731 -2.675 1114 HA HIS 89 HA HIS 89 -22.124 -20.450 -2.916 1115 HD1 HIS 89 1HD HIS 89 -22.738 -21.350 -0.668 1116 HD2 HIS 89 2HD HIS 89 -20.689 -17.956 0.759 1117 HE1 HIS 89 1HE HIS 89 -21.947 -21.889 1.720 1118 HB2 HIS 89 2HB HIS 89 -21.670 -17.715 -1.648 1119 HB3 HIS 89 3HB HIS 89 -23.220 -18.547 -1.704 1120 H THR 90 HN THR 90 -20.571 -17.620 -4.412 1121 HA THR 90 HA THR 90 -23.063 -16.836 -5.798 1122 HB THR 90 HB THR 90 -21.829 -15.000 -6.658 1123 HG1 THR 90 1HG THR 90 -19.713 -14.709 -6.482 1124 HG21 THR 90 3HG2 THR 90 -21.031 -13.817 -4.709 1125 HG22 THR 90 1HG2 THR 90 -20.984 -15.324 -3.777 1126 HG23 THR 90 2HG2 THR 90 -22.532 -14.699 -4.364 1127 H GLY 91 HN GLY 91 -20.544 -19.065 -6.409 1128 HA2 GLY 91 2HA GLY 91 -20.146 -20.386 -8.274 1129 HA3 GLY 91 3HA GLY 91 -21.567 -19.668 -9.053 1130 H GLU 92 HN GLU 92 -19.412 -17.225 -7.985 1131 HA GLU 92 HA GLU 92 -18.825 -16.398 -10.683 1132 HB2 GLU 92 2HB GLU 92 -17.915 -15.469 -7.940 1133 HB3 GLU 92 3HB GLU 92 -17.253 -14.760 -9.414 1134 HG2 GLU 92 2HG GLU 92 -19.408 -14.024 -10.183 1135 HG3 GLU 92 3HG GLU 92 -20.238 -14.849 -8.861 1136 H LYS 93 HN LYS 93 -17.686 -18.012 -11.769 1137 HA LYS 93 HA LYS 93 -14.873 -18.426 -10.833 1138 HB2 LYS 93 2HB LYS 93 -16.693 -20.224 -12.491 1139 HB3 LYS 93 3HB LYS 93 -14.966 -20.518 -12.245 1140 HG2 LYS 93 2HG LYS 93 -15.261 -20.747 -9.852 1141 HG3 LYS 93 3HG LYS 93 -16.973 -20.303 -9.960 1142 HD2 LYS 93 2HD LYS 93 -17.434 -22.321 -11.295 1143 HD3 LYS 93 3HD LYS 93 -15.715 -22.764 -11.237 1144 HE2 LYS 93 2HE LYS 93 -15.832 -22.850 -8.752 1145 HE3 LYS 93 3HE LYS 93 -17.559 -22.456 -8.829 1146 HZ1 LYS 93 3HZ LYS 93 -17.185 -24.822 -8.632 1147 HZ2 LYS 93 1HZ LYS 93 -16.291 -24.842 -10.016 1148 HZ3 LYS 93 2HZ LYS 93 -17.898 -24.483 -10.077 1149 HA PRO 94 HA PRO 94 -14.817 -15.990 -14.772 1150 HB2 PRO 94 2HB PRO 94 -13.094 -14.002 -14.027 1151 HB3 PRO 94 3HB PRO 94 -14.810 -14.016 -13.527 1152 HG2 PRO 94 2HG PRO 94 -12.407 -14.977 -11.937 1153 HG3 PRO 94 3HG PRO 94 -13.709 -13.869 -11.405 1154 HD2 PRO 94 2HD PRO 94 -13.761 -16.532 -10.847 1155 HD3 PRO 94 3HD PRO 94 -15.257 -15.615 -11.211 1156 H PHE 95 HN PHE 95 -12.297 -17.486 -12.797 1157 HA PHE 95 HA PHE 95 -10.176 -17.052 -14.805 1158 HD1 PHE 95 2HD PHE 95 -7.986 -16.062 -13.443 1159 HD2 PHE 95 1HD PHE 95 -10.989 -17.355 -10.653 1160 HE1 PHE 95 2HE PHE 95 -7.586 -14.025 -12.074 1161 HE2 PHE 95 1HE PHE 95 -10.591 -15.316 -9.278 1162 HZ PHE 95 HZ PHE 95 -8.891 -13.656 -9.991 1163 HB2 PHE 95 2HB PHE 95 -10.209 -18.858 -12.343 1164 HB3 PHE 95 3HB PHE 95 -8.821 -18.419 -13.328 1165 H SER 96 HN SER 96 -11.513 -17.976 -16.586 1166 HA SER 96 HA SER 96 -11.876 -20.892 -16.673 1167 HG SER 96 HG SER 96 -13.501 -18.465 -17.174 1168 HB2 SER 96 2HB SER 96 -11.983 -18.837 -18.923 1169 HB3 SER 96 3HB SER 96 -12.613 -20.494 -18.968 1170 H CYS 97 HN CYS 97 -10.660 -22.379 -17.819 1171 HA CYS 97 HA CYS 97 -7.873 -21.777 -18.206 1172 HB2 CYS 97 2HB CYS 97 -8.996 -24.031 -17.583 1173 HB3 CYS 97 3HB CYS 97 -9.308 -24.198 -19.313 1174 H ARG 98 HN ARG 98 -6.953 -20.783 -19.864 1175 HA ARG 98 HA ARG 98 -8.507 -20.281 -22.305 1176 HE ARG 98 HE ARG 98 -9.263 -16.038 -21.101 1177 HB2 ARG 98 2HB ARG 98 -6.004 -19.180 -21.023 1178 HB3 ARG 98 3HB ARG 98 -6.158 -18.999 -22.759 1179 HG2 ARG 98 2HG ARG 98 -6.988 -17.023 -21.706 1180 HG3 ARG 98 3HG ARG 98 -8.301 -17.855 -22.543 1181 HD2 ARG 98 2HD ARG 98 -9.157 -18.713 -20.410 1182 HD3 ARG 98 3HD ARG 98 -7.787 -17.980 -19.543 1183 HH11 ARG 98 1HH1 ARG 98 -9.482 -17.743 -18.011 1184 HH12 ARG 98 2HH1 ARG 98 -10.364 -16.387 -17.280 1185 HH21 ARG 98 2HH2 ARG 98 -10.487 -14.472 -20.100 1186 HH22 ARG 98 1HH2 ARG 98 -10.984 -14.700 -18.438 1187 H TRP 99 HN TRP 99 -6.830 -22.943 -21.464 1188 HA TRP 99 HA TRP 99 -4.905 -23.301 -23.559 1189 HD1 TRP 99 1HD TRP 99 -4.868 -23.460 -20.103 1190 HE1 TRP 99 1HE TRP 99 -2.478 -23.768 -19.233 1191 HE3 TRP 99 3HE TRP 99 -3.220 -26.823 -23.569 1192 HZ2 TRP 99 2HZ TRP 99 -0.122 -25.272 -19.987 1193 HZ3 TRP 99 3HZ TRP 99 -0.875 -27.648 -23.502 1194 HH2 TRP 99 2HH TRP 99 0.672 -26.890 -21.719 1195 HB2 TRP 99 2HB TRP 99 -6.412 -25.145 -21.690 1196 HB3 TRP 99 3HB TRP 99 -5.513 -25.826 -23.035 1197 HA PRO 100 HA PRO 100 -7.560 -23.961 -27.037 1198 HB2 PRO 100 2HB PRO 100 -5.830 -25.182 -28.798 1199 HB3 PRO 100 3HB PRO 100 -5.601 -23.514 -28.224 1200 HG2 PRO 100 2HG PRO 100 -4.322 -26.029 -27.096 1201 HG3 PRO 100 3HG PRO 100 -3.504 -24.528 -27.643 1202 HD2 PRO 100 2HD PRO 100 -4.116 -24.946 -25.023 1203 HD3 PRO 100 3HD PRO 100 -4.267 -23.316 -25.759 1204 H SER 101 HN SER 101 -7.652 -26.021 -24.830 1205 HA SER 101 HA SER 101 -9.098 -28.077 -26.280 1206 HG SER 101 HG SER 101 -7.044 -28.236 -27.420 1207 HB2 SER 101 2HB SER 101 -6.441 -28.805 -24.967 1208 HB3 SER 101 3HB SER 101 -7.686 -29.999 -25.380 1209 H CYS 102 HN CYS 102 -9.240 -26.036 -23.973 1210 HA CYS 102 HA CYS 102 -10.493 -27.882 -22.013 1211 HB2 CYS 102 2HB CYS 102 -8.136 -27.331 -21.248 1212 HB3 CYS 102 3HB CYS 102 -8.613 -25.626 -21.172 1213 H GLN 103 HN GLN 103 -11.655 -26.507 -20.279 1214 HA GLN 103 HA GLN 103 -12.474 -23.845 -20.928 1215 HB2 GLN 103 2HB GLN 103 -13.789 -25.457 -22.623 1216 HB3 GLN 103 3HB GLN 103 -14.783 -25.789 -21.227 1217 HG2 GLN 103 2HG GLN 103 -15.727 -24.035 -22.659 1218 HG3 GLN 103 3HG GLN 103 -15.370 -23.406 -21.063 1219 HE21 GLN 103 1HE2 GLN 103 -12.452 -23.686 -23.195 1220 HE22 GLN 103 2HE2 GLN 103 -12.536 -21.957 -23.537 1221 H LYS 104 HN LYS 104 -11.514 -25.633 -18.688 1222 HA LYS 104 HA LYS 104 -13.765 -25.810 -16.783 1223 HB2 LYS 104 2HB LYS 104 -10.783 -26.433 -16.683 1224 HB3 LYS 104 3HB LYS 104 -11.682 -26.186 -15.196 1225 HG2 LYS 104 2HG LYS 104 -11.892 -28.448 -15.377 1226 HG3 LYS 104 3HG LYS 104 -13.397 -27.902 -16.090 1227 HD2 LYS 104 2HD LYS 104 -12.672 -29.611 -17.528 1228 HD3 LYS 104 3HD LYS 104 -12.181 -28.144 -18.388 1229 HE2 LYS 104 2HE LYS 104 -9.900 -28.379 -17.346 1230 HE3 LYS 104 3HE LYS 104 -10.431 -29.914 -16.613 1231 HZ1 LYS 104 3HZ LYS 104 -10.156 -29.233 -19.446 1232 HZ2 LYS 104 1HZ LYS 104 -10.861 -30.651 -18.943 1233 HZ3 LYS 104 2HZ LYS 104 -9.264 -30.330 -18.625 1234 H LYS 105 HN LYS 105 -13.944 -24.536 -14.883 1235 HA LYS 105 HA LYS 105 -12.620 -21.868 -15.140 1236 HB2 LYS 105 2HB LYS 105 -15.538 -22.370 -14.387 1237 HB3 LYS 105 3HB LYS 105 -14.724 -20.815 -14.634 1238 HG2 LYS 105 2HG LYS 105 -14.227 -21.599 -17.020 1239 HG3 LYS 105 3HG LYS 105 -15.347 -22.933 -16.724 1240 HD2 LYS 105 2HD LYS 105 -17.206 -21.399 -16.407 1241 HD3 LYS 105 3HD LYS 105 -16.113 -20.001 -16.427 1242 HE2 LYS 105 2HE LYS 105 -17.218 -20.207 -18.595 1243 HE3 LYS 105 3HE LYS 105 -15.476 -20.472 -18.750 1244 HZ1 LYS 105 3HZ LYS 105 -16.740 -22.085 -19.993 1245 HZ2 LYS 105 1HZ LYS 105 -17.514 -22.604 -18.634 1246 HZ3 LYS 105 2HZ LYS 105 -15.892 -22.838 -18.800 1247 H PHE 106 HN PHE 106 -12.027 -20.814 -13.321 1248 HA PHE 106 HA PHE 106 -12.648 -22.149 -10.709 1249 HD1 PHE 106 1HD PHE 106 -10.789 -24.132 -9.825 1250 HD2 PHE 106 2HD PHE 106 -9.618 -22.282 -13.536 1251 HE1 PHE 106 1HE PHE 106 -10.490 -26.371 -10.859 1252 HE2 PHE 106 2HE PHE 106 -9.355 -24.512 -14.579 1253 HZ PHE 106 HZ PHE 106 -9.821 -26.563 -13.244 1254 HB2 PHE 106 2HB PHE 106 -9.977 -20.927 -11.557 1255 HB3 PHE 106 3HB PHE 106 -10.349 -21.655 -9.996 1256 H ALA 107 HN ALA 107 -12.449 -20.758 -8.830 1257 HA ALA 107 HA ALA 107 -13.344 -17.998 -9.491 1258 HB1 ALA 107 1HB ALA 107 -14.208 -17.995 -7.171 1259 HB2 ALA 107 2HB ALA 107 -14.838 -19.377 -8.067 1260 HB3 ALA 107 3HB ALA 107 -13.522 -19.609 -6.892 1261 H ARG 108 HN ARG 108 -10.469 -19.509 -8.839 1262 HA ARG 108 HA ARG 108 -9.372 -17.013 -7.639 1263 HE ARG 108 HE ARG 108 -7.269 -19.701 -4.734 1264 HB2 ARG 108 2HB ARG 108 -8.644 -19.853 -6.842 1265 HB3 ARG 108 3HB ARG 108 -7.775 -18.380 -6.385 1266 HG2 ARG 108 2HG ARG 108 -9.397 -17.621 -4.960 1267 HG3 ARG 108 3HG ARG 108 -10.675 -18.629 -5.656 1268 HD2 ARG 108 2HD ARG 108 -9.942 -19.433 -3.446 1269 HD3 ARG 108 3HD ARG 108 -9.785 -20.630 -4.724 1270 HH11 ARG 108 2HH2 ARG 108 -9.231 -20.354 -1.918 1271 HH12 ARG 108 1HH2 ARG 108 -7.917 -21.145 -1.066 1272 HH21 ARG 108 1HH1 ARG 108 -5.621 -20.711 -3.643 1273 HH22 ARG 108 2HH1 ARG 108 -5.924 -21.364 -2.041 1274 H SER 109 HN SER 109 -7.464 -16.333 -8.476 1275 HA SER 109 HA SER 109 -6.732 -17.145 -11.082 1276 HG SER 109 HG SER 109 -5.678 -14.468 -8.512 1277 HB2 SER 109 2HB SER 109 -4.612 -15.758 -10.535 1278 HB3 SER 109 3HB SER 109 -6.165 -14.930 -10.444 1279 H ASP 110 HN ASP 110 -5.330 -17.977 -7.875 1280 HA ASP 110 HA ASP 110 -3.067 -19.421 -8.976 1281 HB2 ASP 110 2HB ASP 110 -2.641 -20.121 -6.750 1282 HB3 ASP 110 3HB ASP 110 -3.096 -18.425 -6.705 1283 H GLU 111 HN GLU 111 -6.427 -20.286 -8.052 1284 HA GLU 111 HA GLU 111 -6.125 -23.152 -8.158 1285 HB2 GLU 111 2HB GLU 111 -8.478 -21.264 -8.513 1286 HB3 GLU 111 3HB GLU 111 -8.624 -22.953 -8.939 1287 HG2 GLU 111 2HG GLU 111 -7.963 -23.650 -6.686 1288 HG3 GLU 111 3HG GLU 111 -7.905 -21.963 -6.173 1289 H LEU 112 HN LEU 112 -6.872 -20.650 -10.645 1290 HA LEU 112 HA LEU 112 -7.069 -22.519 -12.827 1291 HG LEU 112 HG LEU 112 -5.561 -20.635 -14.894 1292 HB2 LEU 112 2HB LEU 112 -7.934 -20.294 -13.008 1293 HB3 LEU 112 3HB LEU 112 -6.335 -19.559 -12.786 1294 HD11 LEU 112 1HD1 LEU 112 -8.462 -21.483 -15.322 1295 HD12 LEU 112 2HD1 LEU 112 -7.131 -22.606 -14.930 1296 HD13 LEU 112 3HD1 LEU 112 -7.084 -21.696 -16.399 1297 HD21 LEU 112 3HD2 LEU 112 -8.092 -19.053 -15.379 1298 HD22 LEU 112 1HD2 LEU 112 -6.705 -19.241 -16.458 1299 HD23 LEU 112 2HD2 LEU 112 -6.515 -18.348 -14.938 1300 H VAL 113 HN VAL 113 -4.276 -20.582 -11.536 1301 HA VAL 113 HA VAL 113 -2.305 -21.466 -13.352 1302 HB VAL 113 HB VAL 113 -2.038 -20.912 -10.359 1303 HG11 VAL 113 1HG1 VAL 113 0.142 -21.137 -12.463 1304 HG12 VAL 113 2HG1 VAL 113 0.365 -20.469 -10.833 1305 HG13 VAL 113 3HG1 VAL 113 -0.066 -22.165 -11.029 1306 HG21 VAL 113 3HG2 VAL 113 -1.349 -18.703 -10.892 1307 HG22 VAL 113 1HG2 VAL 113 -1.220 -19.077 -12.622 1308 HG23 VAL 113 2HG2 VAL 113 -2.798 -18.962 -11.878 1309 H ARG 114 HN ARG 114 -3.297 -22.982 -10.259 1310 HA ARG 114 HA ARG 114 -1.651 -25.288 -10.414 1311 HE ARG 114 HE ARG 114 -2.171 -25.799 -6.664 1312 HB2 ARG 114 2HB ARG 114 -2.945 -24.655 -8.418 1313 HB3 ARG 114 3HB ARG 114 -4.465 -25.040 -9.233 1314 HG2 ARG 114 2HG ARG 114 -3.846 -27.398 -9.430 1315 HG3 ARG 114 3HG ARG 114 -2.222 -27.074 -8.807 1316 HD2 ARG 114 2HD ARG 114 -4.798 -26.638 -7.239 1317 HD3 ARG 114 3HD ARG 114 -3.797 -28.102 -7.158 1318 HH11 ARG 114 2HH2 ARG 114 -4.634 -27.743 -5.030 1319 HH12 ARG 114 1HH2 ARG 114 -4.011 -27.346 -3.455 1320 HH21 ARG 114 1HH1 ARG 114 -1.466 -25.294 -4.574 1321 HH22 ARG 114 2HH1 ARG 114 -2.407 -25.940 -3.224 1322 H HIS 115 HN HIS 115 -5.034 -24.831 -11.623 1323 HA HIS 115 HA HIS 115 -5.341 -27.389 -12.767 1324 HD1 HIS 115 1HD HIS 115 -7.581 -28.441 -13.671 1325 HD2 HIS 115 2HD HIS 115 -6.936 -25.172 -16.242 1326 HE1 HIS 115 1HE HIS 115 -8.201 -29.211 -16.026 1327 HB2 HIS 115 2HB HIS 115 -7.192 -25.827 -12.520 1328 HB3 HIS 115 3HB HIS 115 -6.476 -24.713 -13.695 1329 H HIS 116 HN HIS 116 -3.993 -24.398 -14.251 1330 HA HIS 116 HA HIS 116 -3.479 -25.440 -16.836 1331 HD1 HIS 116 1HD HIS 116 -5.085 -23.880 -17.586 1332 HD2 HIS 116 2HD HIS 116 -2.340 -20.847 -16.450 1333 HE1 HIS 116 1HE HIS 116 -5.897 -21.781 -18.563 1334 HB2 HIS 116 2HB HIS 116 -2.094 -23.313 -15.161 1335 HB3 HIS 116 3HB HIS 116 -1.544 -23.737 -16.770 1336 H ASN 117 HN ASN 117 -1.743 -25.896 -13.745 1337 HA ASN 117 HA ASN 117 0.701 -26.950 -14.900 1338 HB2 ASN 117 2HB ASN 117 0.135 -26.087 -12.456 1339 HB3 ASN 117 3HB ASN 117 -0.326 -27.764 -12.165 1340 HD21 ASN 117 1HD2 ASN 117 1.710 -29.129 -13.697 1341 HD22 ASN 117 2HD2 ASN 117 3.240 -28.698 -12.890 1342 H MET 118 HN MET 118 -2.523 -28.238 -14.600 1343 HA MET 118 HA MET 118 -1.706 -31.079 -14.637 1344 HB2 MET 118 2HB MET 118 -4.449 -29.891 -15.242 1345 HB3 MET 118 3HB MET 118 -4.073 -31.549 -14.822 1346 HG2 MET 118 2HG MET 118 -3.439 -30.903 -12.554 1347 HG3 MET 118 3HG MET 118 -3.677 -29.195 -12.937 1348 HE1 MET 118 3HE MET 118 -6.572 -29.859 -10.430 1349 HE2 MET 118 1HE MET 118 -4.945 -30.578 -10.404 1350 HE3 MET 118 2HE MET 118 -5.154 -28.861 -10.826 1351 H HIS 119 HN HIS 119 -1.900 -28.513 -16.906 1352 HA HIS 119 HA HIS 119 -2.328 -30.364 -19.214 1353 HD1 HIS 119 1HD HIS 119 -4.526 -30.096 -20.553 1354 HD2 HIS 119 2HD HIS 119 -4.689 -26.431 -18.473 1355 HE1 HIS 119 1HE HIS 119 -7.008 -29.487 -20.280 1356 HB2 HIS 119 2HB HIS 119 -2.269 -27.322 -18.997 1357 HB3 HIS 119 3HB HIS 119 -2.291 -28.202 -20.520 Start of MODEL 7 1 H5 DC 124 5H C 124 -3.994 -31.487 -5.075 2 H6 DC 124 6H C 124 -5.920 -31.107 -6.535 3 H5' DC 124 H5' C 124 -8.805 -32.464 -9.761 4 H5'' DC 124 H5" C 124 -7.443 -32.378 -8.622 5 H4' DC 124 H4' C 124 -10.380 -32.457 -7.774 6 H3' DC 124 H3' C 124 -9.128 -30.247 -8.933 7 H2' DC 124 H2' C 124 -7.405 -29.999 -7.394 8 H2'' DC 124 H2" C 124 -8.630 -28.996 -6.575 9 H1' DC 124 H1' C 124 -9.404 -30.783 -5.211 10 H41 DC 124 1H4 C 124 -4.487 -32.275 -1.515 11 H42 DC 124 2H4 C 124 -3.342 -32.019 -2.818 12 H8 DG 125 8H G 125 -9.125 -26.924 -5.688 13 H1 DG 125 1H G 125 -6.423 -29.012 -0.232 14 H5' DG 125 H5' G 125 -12.956 -29.650 -6.385 15 H5'' DG 125 H5" G 125 -14.051 -28.312 -6.810 16 H4' DG 125 H4' G 125 -13.833 -28.571 -4.358 17 H3' DG 125 H3' G 125 -13.404 -26.103 -5.669 18 H2' DG 125 H2' G 125 -11.143 -26.017 -5.309 19 H2'' DG 125 H2" G 125 -11.626 -25.312 -3.735 20 H1' DG 125 H1' G 125 -11.532 -27.434 -2.645 21 H21 DG 125 1H2 G 125 -7.935 -29.255 1.312 22 H22 DG 125 2H2 G 125 -9.641 -28.989 0.986 23 H5 DC 126 5H C 126 -8.010 -23.959 -4.330 24 H6 DC 126 6H C 126 -9.996 -23.509 -2.973 25 H5' DC 126 H5' C 126 -13.528 -26.199 -1.178 26 H5'' DC 126 H5" C 126 -14.579 -24.959 -0.461 27 H4' DC 126 H4' C 126 -12.647 -25.152 0.917 28 H3' DC 126 H3' C 126 -13.290 -22.668 -0.269 29 H2' DC 126 H2' C 126 -11.435 -22.723 -1.735 30 H2'' DC 126 H2" C 126 -10.658 -21.896 -0.335 31 H1' DC 126 H1' C 126 -10.077 -24.069 0.685 32 H41 DC 126 1H4 C 126 -5.038 -25.524 -2.861 33 H42 DC 126 2H4 C 126 -5.839 -25.006 -4.327 34 H8 DG 127 8H G 127 -9.686 -21.757 1.630 35 H1 DG 127 1H G 127 -3.451 -22.959 0.651 36 H5' DG 127 H5' G 127 -12.176 -23.618 3.935 37 H5'' DG 127 H5" G 127 -12.608 -22.543 5.273 38 H4' DG 127 H4' G 127 -10.555 -23.721 5.822 39 H3' DG 127 H3' G 127 -10.730 -20.895 5.773 40 H2' DG 127 H2' G 127 -9.220 -20.543 4.043 41 H2'' DG 127 H2" G 127 -7.980 -20.795 5.307 42 H1' DG 127 H1' G 127 -7.644 -23.038 4.693 43 H21 DG 127 1H2 G 127 -2.463 -23.364 2.526 44 H22 DG 127 2H2 G 127 -3.302 -23.197 4.057 45 H8 DG 128 8H G 128 -7.444 -18.647 4.203 46 H1 DG 128 1H G 128 -2.689 -19.793 0.038 47 H5' DG 128 H5' G 128 -6.711 -21.941 7.660 48 H5'' DG 128 H5" G 128 -6.565 -21.052 9.194 49 H4' DG 128 H4' G 128 -4.558 -20.654 7.995 50 H3' DG 128 H3' G 128 -6.260 -18.434 8.552 51 H2' DG 128 H2' G 128 -6.705 -18.017 6.276 52 H2'' DG 128 H2" G 128 -5.172 -17.090 6.426 53 H1' DG 128 H1' G 128 -3.869 -19.033 5.719 54 H21 DG 128 1H2 G 128 -0.806 -19.970 1.087 55 H22 DG 128 2H2 G 128 -0.729 -20.003 2.838 56 H8 DG 129 8H G 129 -3.389 -16.200 5.641 57 H1 DG 129 1H G 129 -1.070 -16.549 -0.323 58 H5' DG 129 H5' G 129 -1.616 -18.383 8.679 59 H5'' DG 129 H5" G 129 -0.998 -17.340 9.938 60 H4' DG 129 H4' G 129 0.639 -17.343 8.189 61 H3' DG 129 H3' G 129 -0.654 -14.875 8.770 62 H2' DG 129 H2' G 129 -1.861 -14.857 6.790 63 H2'' DG 129 H2" G 129 -0.400 -14.064 6.162 64 H1' DG 129 H1' G 129 0.495 -16.157 5.344 65 H21 DG 129 1H2 G 129 1.107 -16.510 -0.293 66 H22 DG 129 2H2 G 129 2.014 -16.450 1.209 67 H8 DG 130 8H G 130 0.558 -13.376 4.242 68 H1 DG 130 1H G 130 -0.650 -12.864 -2.018 69 H5' DG 130 H5' G 130 3.073 -15.514 5.609 70 H5'' DG 130 H5" G 130 4.150 -14.561 6.644 71 H4' DG 130 H4' G 130 5.108 -14.399 4.525 72 H3' DG 130 H3' G 130 4.184 -12.081 5.778 73 H2' DG 130 H2' G 130 2.360 -11.675 4.411 74 H2'' DG 130 H2" G 130 3.563 -10.958 3.322 75 H1' DG 130 H1' G 130 3.661 -12.843 1.940 76 H21 DG 130 1H2 G 130 1.145 -12.457 -3.156 77 H22 DG 130 2H2 G 130 2.706 -12.258 -2.371 78 H8 DG 131 8H G 131 2.598 -9.519 2.380 79 H1 DG 131 1H G 131 -1.869 -9.258 -2.171 80 H5' DG 131 H5' G 131 5.932 -11.762 1.703 81 H5'' DG 131 H5" G 131 7.377 -10.746 1.803 82 H4' DG 131 H4' G 131 6.594 -10.382 -0.392 83 H3' DG 131 H3' G 131 6.547 -8.244 1.457 84 H2' DG 131 H2' G 131 4.241 -8.158 1.703 85 H2'' DG 131 H2" G 131 4.348 -7.114 0.272 86 H1' DG 131 H1' G 131 3.878 -8.932 -1.238 87 H21 DG 131 1H2 G 131 -0.988 -8.932 -4.093 88 H22 DG 131 2H2 G 131 0.745 -8.728 -4.302 89 H5 DC 132 5H C 132 1.326 -6.432 1.631 90 H6 DC 132 6H C 132 2.806 -5.672 -0.163 91 H5' DC 132 H5' C 132 5.257 -7.627 -2.816 92 H5'' DC 132 H5" C 132 6.316 -6.360 -3.457 93 H4' DC 132 H4' C 132 4.302 -6.112 -4.638 94 H3' DC 132 H3' C 132 5.271 -4.070 -2.957 95 H2' DC 132 H2' C 132 3.576 -4.228 -1.411 96 H2'' DC 132 H2" C 132 2.767 -3.134 -2.523 97 H1' DC 132 H1' C 132 1.583 -4.942 -3.635 98 H41 DC 132 1H4 C 132 -2.301 -6.673 1.103 99 H42 DC 132 2H4 C 132 -0.951 -6.965 2.209 100 H8 DG 133 8H G 133 1.231 -2.101 -3.278 101 H1 DG 133 1H G 133 -4.949 -2.671 -1.564 102 H5' DG 133 H5' G 133 2.595 -3.223 -6.740 103 H5'' DG 133 H5" G 133 3.270 -1.799 -7.544 104 H4' DG 133 H4' G 133 0.906 -1.888 -8.002 105 H3' DG 133 H3' G 133 2.122 0.357 -6.773 106 H2' DG 133 H2' G 133 1.194 -0.179 -4.682 107 H2'' DG 133 H2" G 133 -0.133 0.806 -5.283 108 H1' DG 133 H1' G 133 -1.405 -1.165 -5.950 109 H21 DG 133 1H2 G 133 -6.239 -2.246 -3.229 110 H22 DG 133 2H2 G 133 -5.617 -1.716 -4.776 111 H5' DT 134 H5' T 134 -2.310 -0.126 -7.288 112 H5'' DT 134 H5" T 134 -2.720 1.046 -8.531 113 H4' DT 134 H4' T 134 -4.655 1.067 -7.233 114 H3' DT 134 H3' T 134 -3.025 3.364 -7.058 115 H2' DT 134 H2' T 134 -2.485 3.246 -4.903 116 H2'' DT 134 H2" T 134 -4.054 3.997 -4.711 117 H1' DT 134 H1' T 134 -5.129 1.947 -4.240 118 H3 DT 134 3H T 134 -4.086 0.401 -0.130 119 H71 DT 134 1H7 T 134 0.604 0.291 -1.814 120 H72 DT 134 2H7 T 134 0.560 1.961 -2.432 121 H73 DT 134 3H7 T 134 0.416 1.659 -0.678 122 H6 DT 134 6H T 134 -1.391 1.908 -3.793 123 H5 DC 135 5H C 135 -3.626 4.702 -2.685 124 H6 DC 135 6H C 135 -5.444 5.424 -4.137 125 H5' DC 135 H5' C 135 -7.400 3.552 -7.351 126 H5'' DC 135 H5" C 135 -8.027 5.018 -8.158 127 H4' DC 135 H4' C 135 -9.450 4.372 -6.351 128 H3' DC 135 H3' C 135 -8.608 6.989 -6.550 129 H2' DC 135 H2' C 135 -6.919 6.636 -4.893 130 H2'' DC 135 H2" C 135 -8.215 7.246 -3.888 131 H1' DC 135 H1' C 135 -9.018 5.044 -3.324 132 H41 DC 135 1H4 C 135 -4.262 3.339 0.674 133 H42 DC 135 2H4 C 135 -3.079 3.978 -0.421 134 H5' DT 136 H5' T 136 -10.855 5.284 -2.618 135 H5'' DT 136 H5" T 136 -12.368 6.082 -3.045 136 H4' DT 136 H4' T 136 -12.493 6.025 -0.706 137 H3' DT 136 H3' T 136 -12.235 8.600 -1.842 138 H2' DT 136 H2' T 136 -10.108 8.991 -1.316 139 H2'' DT 136 H2" T 136 -10.693 9.445 0.260 140 H1' DT 136 H1' T 136 -10.167 7.408 1.292 141 H3 DT 136 3H T 136 -5.793 6.659 1.777 142 H71 DT 136 1H7 T 136 -6.501 8.713 -3.188 143 H72 DT 136 2H7 T 136 -5.198 9.327 -2.147 144 H73 DT 136 3H7 T 136 -5.100 7.690 -2.833 145 H6 DT 136 6H T 136 -8.442 8.153 -1.967 146 H8 DG 137 8H G 137 -9.602 10.258 1.767 147 H1 DG 137 1H G 137 -3.690 9.448 4.134 148 H5' DG 137 H5' G 137 -12.240 7.480 2.547 149 H5'' DG 137 H5" G 137 -13.683 8.273 3.180 150 H4' DG 137 H4' G 137 -12.390 7.943 5.070 151 H3' DG 137 H3' G 137 -12.949 10.589 4.285 152 H2' DG 137 H2' G 137 -10.827 11.038 3.463 153 H2'' DG 137 H2" G 137 -10.520 11.521 5.101 154 H1' DG 137 H1' G 137 -9.361 9.420 5.592 155 H21 DG 137 1H2 G 137 -3.749 8.818 6.214 156 H22 DG 137 2H2 G 137 -5.265 8.725 7.098 157 H5 DC 138 5H C 138 -8.570 13.039 3.997 158 H6 DC 138 6H C 138 -9.173 12.345 6.252 159 H5' DC 138 H5' C 138 -10.270 9.197 7.645 160 H5'' DC 138 H5" C 138 -11.237 9.744 9.029 161 H4' DC 138 H4' C 138 -9.029 9.596 9.825 162 H3' DC 138 H3' C 138 -10.395 12.068 9.842 163 H2' DC 138 H2' C 138 -9.199 13.137 8.200 164 H2'' DC 138 H2" C 138 -8.028 13.456 9.466 165 H1' DC 138 H1' C 138 -6.627 11.659 8.876 166 H41 DC 138 1H4 C 138 -5.045 13.200 2.960 167 H42 DC 138 2H4 C 138 -6.722 13.307 2.470 168 H8 DG 139 8H G 139 -6.385 14.687 9.702 169 H1 DG 139 1H G 139 -2.150 15.911 5.053 170 H5' DG 139 H5' G 139 -6.107 11.022 11.205 171 H5'' DG 139 H5" G 139 -6.177 11.346 12.945 172 H4' DG 139 H4' G 139 -3.874 11.459 12.333 173 H3' DG 139 H3' G 139 -5.147 13.667 13.516 174 H2' DG 139 H2' G 139 -5.278 14.965 11.641 175 H2'' DG 139 H2" G 139 -3.653 15.471 12.064 176 H1' DG 139 H1' G 139 -2.640 13.972 10.526 177 H21 DG 139 1H2 G 139 -0.158 15.312 5.649 178 H22 DG 139 2H2 G 139 0.171 14.696 7.262 179 H5 DC 140 5H C 140 -4.118 17.614 10.504 180 H6 DC 140 6H C 140 -2.109 16.839 11.654 181 H5' DC 140 H5' C 140 -0.693 13.353 12.172 182 H5'' DC 140 H5" C 140 0.202 13.730 13.651 183 H4' DC 140 H4' C 140 1.579 14.186 11.726 184 H3' DC 140 H3' C 140 1.299 16.010 13.770 185 H2' DC 140 H2' C 140 -0.300 17.362 12.710 186 H2'' DC 140 H2" C 140 1.182 18.202 12.164 187 H1' DC 140 H1' C 140 1.281 16.992 10.107 188 H41 DC 140 1H4 C 140 -3.933 18.980 7.122 189 H42 DC 140 2H4 C 140 -4.954 18.471 8.449 190 H8 DG 141 8H G 141 -3.404 21.534 0.805 191 H1 DG 141 1H G 141 -1.567 18.758 6.321 192 H5' DG 141 H5' G 141 -0.730 24.588 -0.600 193 H5'' DG 141 H5" G 141 -0.952 23.945 -2.239 194 H4' DG 141 H4' G 141 0.922 22.883 -0.975 195 H3' DG 141 H3' G 141 -0.856 21.415 -2.546 196 H2' DG 141 H2' G 141 -2.121 20.593 -0.819 197 H2'' DG 141 H2" G 141 -0.915 19.304 -0.804 198 H1' DG 141 H1' G 141 0.297 20.313 0.991 199 H21 DG 141 1H2 G 141 0.581 18.298 6.263 200 H22 DG 141 2H2 G 141 1.550 18.583 4.827 201 H5 DC 142 5H C 142 -2.601 17.792 0.451 202 H6 DC 142 6H C 142 -0.246 17.352 0.017 203 H5' DC 142 H5' C 142 2.040 19.583 0.321 204 H5'' DC 142 H5" C 142 3.264 19.203 -0.867 205 H4' DC 142 H4' C 142 3.973 18.017 0.899 206 H3' DC 142 H3' C 142 3.156 16.513 -1.291 207 H2' DC 142 H2' C 142 1.107 15.862 -0.468 208 H2'' DC 142 H2" C 142 2.030 14.580 0.279 209 H1' DC 142 H1' C 142 1.974 15.560 2.422 210 H41 DC 142 1H4 C 142 -4.126 16.893 3.656 211 H42 DC 142 2H4 C 142 -4.315 17.718 2.121 212 H8 DG 143 8H G 143 1.565 13.015 1.322 213 H1 DG 143 1H G 143 -3.687 12.436 4.969 214 H5' DG 143 H5' G 143 4.246 15.379 3.294 215 H5'' DG 143 H5" G 143 5.753 14.503 2.948 216 H4' DG 143 H4' G 143 4.914 13.568 4.954 217 H3' DG 143 H3' G 143 5.392 11.965 2.732 218 H2' DG 143 H2' G 143 3.170 11.757 2.011 219 H2'' DG 143 H2" G 143 3.172 10.378 3.087 220 H1' DG 143 H1' G 143 2.146 11.565 4.844 221 H21 DG 143 1H2 G 143 -3.190 11.590 6.929 222 H22 DG 143 2H2 G 143 -1.546 11.110 7.328 223 H5 DC 144 5H C 144 0.849 9.710 2.008 224 H6 DC 144 6H C 144 1.829 8.924 4.108 225 H5' DC 144 H5' C 144 2.994 10.942 6.430 226 H5'' DC 144 H5" C 144 4.284 10.045 7.184 227 H4' DC 144 H4' C 144 2.507 9.400 8.372 228 H3' DC 144 H3' C 144 3.765 7.398 6.894 229 H2' DC 144 H2' C 144 2.175 7.125 5.220 230 H2'' DC 144 H2" C 144 1.381 6.094 6.398 231 H1' DC 144 H1' C 144 -0.222 7.723 6.972 232 H41 DC 144 1H4 C 144 -2.819 9.947 1.635 233 H42 DC 144 2H4 C 144 -1.253 10.330 0.949 234 H8 DA 145 8H A 145 -0.219 4.899 5.931 235 H2 DA 145 2H A 145 -6.274 6.278 4.479 236 H5' DA 145 H5' A 145 0.034 7.361 9.491 237 H5'' DA 145 H5" A 145 0.255 6.134 10.750 238 H4' DA 145 H4' A 145 -2.098 6.363 10.382 239 H3' DA 145 H3' A 145 -0.942 3.859 10.156 240 H2' DA 145 H2' A 145 -0.890 3.871 7.819 241 H2'' DA 145 H2" A 145 -2.468 3.123 8.022 242 H1' DA 145 H1' A 145 -3.618 5.209 7.829 243 H61 DA 145 2H6 A 145 -1.934 5.950 1.559 244 H62 DA 145 1H6 A 145 -3.492 6.499 0.975 245 H8 DG 146 8H G 146 -3.876 1.807 7.313 246 H1 DG 146 1H G 146 -5.637 3.207 1.351 247 H5' DG 146 H5' G 146 -5.267 4.637 9.860 248 H5'' DG 146 H5" G 146 -6.430 4.402 11.140 249 H4' DG 146 H4' G 146 -7.855 3.888 9.554 250 H3' DG 146 H3' G 146 -6.725 1.435 10.408 251 H2' DG 146 H2' G 146 -5.514 1.025 8.456 252 H2'' DG 146 H2" G 146 -7.074 0.428 7.861 253 H1' DG 146 H1' G 146 -7.633 2.458 6.803 254 H21 DG 146 1H2 G 146 -7.810 3.619 1.269 255 H22 DG 146 2H2 G 146 -8.792 3.664 2.711 256 H8 DA 147 8H A 147 -6.894 -1.226 6.453 257 H2 DA 147 2H A 147 -6.437 0.426 0.267 258 H5' DA 147 H5' A 147 -10.048 1.845 7.501 259 H5'' DA 147 H5" A 147 -11.467 0.839 7.848 260 H4' DA 147 H4' A 147 -11.285 1.109 5.454 261 H3' DA 147 H3' A 147 -11.300 -1.457 6.565 262 H2' DA 147 H2' A 147 -9.086 -1.949 6.121 263 H2'' DA 147 H2" A 147 -9.754 -2.465 4.535 264 H1' DA 147 H1' A 147 -9.364 -0.315 3.557 265 H61 DA 147 2H6 A 147 -2.796 -0.670 3.861 266 H62 DA 147 1H6 A 147 -2.501 -0.303 2.165 267 H5 DC 148 5H C 148 -7.030 -3.620 3.241 268 H6 DC 148 6H C 148 -9.351 -3.507 2.424 269 H5' DC 148 H5' C 148 -12.392 -0.765 1.918 270 H5'' DC 148 H5" C 148 -13.845 -1.779 1.726 271 H4' DC 148 H4' C 148 -12.751 -1.722 -0.390 272 H3' DC 148 H3' C 148 -13.155 -4.217 0.845 273 H2' DC 148 H2' C 148 -10.917 -4.512 1.439 274 H2'' DC 148 H2" C 148 -10.803 -5.271 -0.153 275 H1' DC 148 H1' C 148 -10.178 -3.181 -1.218 276 H41 DC 148 1H4 C 148 -4.198 -3.001 0.950 277 H42 DC 148 2H4 C 148 -4.700 -3.357 2.590 278 H8 DG 149 8H G 149 -9.138 -6.864 -0.904 279 H1 DG 149 1H G 149 -2.773 -5.833 -1.101 280 H5' DG 149 H5' G 149 -10.727 -3.561 -3.124 281 H5'' DG 149 H5" G 149 -11.991 -4.243 -4.141 282 H4' DG 149 H4' G 149 -10.069 -4.497 -5.430 283 H3' DG 149 H3' G 149 -11.469 -6.737 -4.549 284 H2' DG 149 H2' G 149 -9.999 -7.368 -2.842 285 H2'' DG 149 H2" G 149 -9.227 -8.270 -4.137 286 H1' DG 149 H1' G 149 -7.556 -6.569 -4.473 287 H21 DG 149 1H2 G 149 -2.138 -5.587 -3.151 288 H22 DG 149 2H2 G 149 -3.284 -5.502 -4.471 289 H5 DC 150 5H C 150 -6.952 -9.543 -1.689 290 H6 DC 150 6H C 150 -7.117 -9.816 -4.094 291 H5' DC 150 H5' C 150 -8.145 -9.085 -5.723 292 H5'' DC 150 H5" C 150 -7.976 -7.411 -6.309 293 H4' DC 150 H4' C 150 -6.709 -8.190 -8.247 294 H3' DC 150 H3' C 150 -7.735 -10.682 -7.721 295 H2' DC 150 H2' C 150 -6.776 -11.092 -5.680 296 H2'' DC 150 H2" C 150 -5.442 -11.666 -6.645 297 H1' DC 150 H1' C 150 -4.134 -9.758 -6.349 298 H41 DC 150 1H4 C 150 -3.698 -9.201 -0.045 299 H42 DC 150 2H4 C 150 -5.436 -9.324 0.168 300 H5 DC 151 5H C 151 -5.141 -12.949 -4.365 301 H6 DC 151 6H C 151 -3.924 -12.926 -6.491 302 H5' DC 151 H5' C 151 -3.449 -10.199 -9.219 303 H5'' DC 151 H5" C 151 -3.183 -11.315 -10.568 304 H4' DC 151 H4' C 151 -1.088 -10.919 -9.397 305 H3' DC 151 H3' C 151 -2.137 -13.466 -9.956 306 H2' DC 151 H2' C 151 -2.672 -13.976 -7.785 307 H2'' DC 151 H2" C 151 -1.023 -14.530 -7.688 308 H1' DC 151 H1' C 151 -0.233 -12.484 -6.688 309 H41 DC 151 1H4 C 151 -3.339 -12.899 -1.191 310 H42 DC 151 2H4 C 151 -4.891 -12.948 -1.997 311 H5 DC 152 5H C 152 -3.104 -15.975 -5.014 312 H6 DC 152 6H C 152 -0.907 -15.960 -6.095 313 H5' DC 152 H5' C 152 1.599 -13.304 -7.468 314 H5'' DC 152 H5" C 152 2.886 -14.001 -8.461 315 H4' DC 152 H4' C 152 3.568 -14.622 -6.346 316 H3' DC 152 H3' C 152 2.572 -16.743 -7.980 317 H2' DC 152 H2' C 152 0.737 -17.221 -6.680 318 H2'' DC 152 H2" C 152 1.888 -18.164 -5.713 319 H1' DC 152 H1' C 152 2.292 -16.348 -4.181 320 H41 DC 152 1H4 C 152 -3.412 -16.195 -1.350 321 H42 DC 152 2H4 C 152 -4.241 -16.058 -2.889 322 H5 DC 153 5H C 153 -1.317 -19.596 -4.675 323 H6 DC 153 6H C 153 1.090 -19.984 -4.436 324 H5' DC 153 H5' C 153 4.623 -17.591 -4.071 325 H5'' DC 153 H5" C 153 5.925 -18.743 -4.411 326 H4' DC 153 H4' C 153 5.230 -19.194 -2.209 327 H3' DC 153 H3' C 153 4.883 -21.174 -4.240 328 H2' DC 153 H2' C 153 2.638 -21.266 -4.084 329 H2'' DC 153 H2" C 153 2.935 -22.313 -2.702 330 H1' DC 153 H1' C 153 2.730 -20.519 -1.107 331 H41 DC 153 1H4 C 153 -3.475 -19.159 -1.715 332 H42 DC 153 2H4 C 153 -3.417 -19.414 -3.452 333 H5 DC 154 5H C 154 -0.185 -22.767 -3.060 334 H6 DC 154 6H C 154 1.667 -23.436 -1.590 335 H5' DC 154 H5' C 154 4.635 -21.823 0.140 336 H5'' DC 154 H5" C 154 5.759 -23.129 0.552 337 H4' DC 154 H4' C 154 4.070 -23.091 2.227 338 H3' DC 154 H3' C 154 4.493 -25.382 0.571 339 H2' DC 154 H2' C 154 2.402 -25.373 -0.377 340 H2'' DC 154 H2" C 154 1.912 -26.098 1.182 341 H1' DC 154 H1' C 154 1.177 -24.040 2.075 342 H41 DC 154 1H4 C 154 -3.647 -22.638 -1.777 343 H42 DC 154 2H4 C 154 -2.583 -22.389 -3.148 344 H8 DG 155 8H G 155 0.581 -27.625 0.947 345 H1 DG 155 1H G 155 -5.455 -25.853 -0.354 346 H5' DG 155 H5' G 155 2.271 -25.557 4.488 347 H5'' DG 155 H5" G 155 2.753 -26.909 5.528 348 H4' DG 155 H4' G 155 0.399 -26.503 5.864 349 H3' DG 155 H3' G 155 1.400 -28.995 4.989 350 H2' DG 155 H2' G 155 0.508 -28.885 2.851 351 H2'' DG 155 H2" G 155 -0.942 -29.518 3.688 352 H1' DG 155 H1' G 155 -1.868 -27.345 3.976 353 H21 DG 155 1H2 G 155 -6.653 -25.898 1.468 354 H22 DG 155 2H2 G 155 -5.955 -26.343 3.018 355 H5 DC 156 5H C 156 -1.605 -30.690 1.149 356 H6 DC 156 6H C 156 -2.488 -30.954 3.423 357 H5' DC 156 H5' C 156 -2.689 -28.734 7.003 358 H5'' DC 156 H5" C 156 -3.047 -30.026 8.159 359 H4' DC 156 H4' C 156 -5.098 -29.386 7.014 360 H3' DC 156 H3' C 156 -3.994 -32.021 6.971 361 H2' DC 156 H2' C 156 -3.714 -32.171 4.692 362 H2'' DC 156 H2" C 156 -5.478 -32.452 4.729 363 H1' DC 156 H1' C 156 -6.049 -30.220 4.298 364 H41 DC 156 1H4 C 156 -3.715 -29.298 -1.530 365 H42 DC 156 2H4 C 156 -2.104 -29.775 -1.040 366 H8 DG 157 8H G 157 -6.413 -34.823 4.673 367 H1 DG 157 1H G 157 -6.884 -32.235 -1.177 368 H5' DG 157 H5' G 157 -8.722 -31.545 7.313 369 H5'' DG 157 H5" G 157 -9.482 -32.788 8.323 370 H4' DG 157 H4' G 157 -10.814 -32.338 6.289 371 H3' DG 157 H3' G 157 -10.201 -34.909 7.140 372 H2' DG 157 H2' G 157 -8.334 -35.175 5.712 373 H2'' DG 157 H2" G 157 -9.597 -35.870 4.658 374 H1' DG 157 H1' G 157 -9.973 -33.807 3.540 375 H21 DG 157 1H2 G 157 -8.957 -31.791 -1.612 376 H22 DG 157 2H2 G 157 -10.200 -31.922 -0.387 377 HA ALA 1 HA ALA 1 -1.135 24.810 -4.408 378 H1 ALA 1 HN ALA 1 -1.244 26.285 -6.527 379 HB1 ALA 1 1HB ALA 1 -1.873 23.499 -7.067 380 HB2 ALA 1 2HB ALA 1 -2.410 22.970 -5.456 381 HB3 ALA 1 3HB ALA 1 -2.935 24.540 -6.089 382 H SER 2 HN SER 2 1.469 24.704 -6.477 383 HA SER 2 HA SER 2 2.804 22.640 -4.931 384 HG SER 2 HG SER 2 0.950 21.361 -5.629 385 HB2 SER 2 2HB SER 2 2.056 22.064 -7.830 386 HB3 SER 2 3HB SER 2 3.375 21.230 -6.987 387 H GLU 3 HN GLU 3 5.055 22.689 -5.202 388 HA GLU 3 HA GLU 3 6.097 25.034 -6.685 389 HB2 GLU 3 2HB GLU 3 7.357 23.067 -4.729 390 HB3 GLU 3 3HB GLU 3 8.270 24.332 -5.563 391 HG2 GLU 3 2HG GLU 3 6.744 26.032 -4.528 392 HG3 GLU 3 3HG GLU 3 5.985 24.730 -3.593 393 H LYS 4 HN LYS 4 8.204 24.711 -7.918 394 HA LYS 4 HA LYS 4 8.166 22.132 -9.454 395 HB2 LYS 4 2HB LYS 4 8.543 24.967 -10.552 396 HB3 LYS 4 3HB LYS 4 8.762 23.475 -11.464 397 HG2 LYS 4 2HG LYS 4 6.655 23.890 -12.113 398 HG3 LYS 4 3HG LYS 4 6.294 22.930 -10.683 399 HD2 LYS 4 2HD LYS 4 5.960 25.122 -9.407 400 HD3 LYS 4 3HD LYS 4 6.294 25.982 -10.914 401 HE2 LYS 4 2HE LYS 4 3.918 25.883 -10.668 402 HE3 LYS 4 3HE LYS 4 4.354 24.756 -11.965 403 HZ1 LYS 4 3HZ LYS 4 2.780 23.778 -10.452 404 HZ2 LYS 4 1HZ LYS 4 3.760 24.067 -9.158 405 HZ3 LYS 4 2HZ LYS 4 4.220 22.977 -10.309 406 H ARG 5 HN ARG 5 9.889 23.295 -7.156 407 HA ARG 5 HA ARG 5 12.563 23.701 -8.185 408 HE ARG 5 HE ARG 5 10.305 24.117 -2.939 409 HB2 ARG 5 2HB ARG 5 13.252 23.279 -5.826 410 HB3 ARG 5 3HB ARG 5 11.896 24.383 -5.916 411 HG2 ARG 5 2HG ARG 5 10.356 22.586 -5.239 412 HG3 ARG 5 3HG ARG 5 11.675 21.404 -5.293 413 HD2 ARG 5 2HD ARG 5 11.287 21.979 -3.009 414 HD3 ARG 5 3HD ARG 5 12.846 22.647 -3.480 415 HH11 ARG 5 2HH2 ARG 5 13.780 24.407 -3.488 416 HH12 ARG 5 1HH2 ARG 5 13.761 26.114 -3.104 417 HH21 ARG 5 2HH1 ARG 5 10.362 26.296 -2.591 418 HH22 ARG 5 1HH1 ARG 5 11.901 27.136 -2.572 419 HA PRO 6 HA PRO 6 13.819 19.549 -9.144 420 HB2 PRO 6 2HB PRO 6 16.424 19.423 -8.191 421 HB3 PRO 6 3HB PRO 6 15.924 20.355 -9.622 422 HG2 PRO 6 2HG PRO 6 16.305 21.381 -6.797 423 HG3 PRO 6 3HG PRO 6 16.944 22.070 -8.324 424 HD2 PRO 6 2HD PRO 6 14.720 23.053 -7.193 425 HD3 PRO 6 3HD PRO 6 14.806 22.866 -8.962 426 H PHE 7 HN PHE 7 12.414 18.287 -7.899 427 HA PHE 7 HA PHE 7 13.086 17.708 -5.058 428 HD1 PHE 7 1HD PHE 7 10.524 18.598 -3.731 429 HD2 PHE 7 2HD PHE 7 9.802 18.204 -7.959 430 HE1 PHE 7 1HE PHE 7 9.001 20.562 -3.676 431 HE2 PHE 7 2HE PHE 7 8.335 20.184 -7.909 432 HZ PHE 7 HZ PHE 7 7.927 21.348 -5.773 433 HB2 PHE 7 2HB PHE 7 10.920 16.500 -6.784 434 HB3 PHE 7 3HB PHE 7 11.002 16.454 -5.041 435 H MET 8 HN MET 8 13.509 15.591 -4.277 436 HA MET 8 HA MET 8 13.834 13.443 -6.290 437 HB2 MET 8 2HB MET 8 15.909 12.630 -5.311 438 HB3 MET 8 3HB MET 8 16.120 14.235 -6.004 439 HG2 MET 8 2HG MET 8 16.109 15.279 -3.831 440 HG3 MET 8 3HG MET 8 15.696 13.761 -3.029 441 HE1 MET 8 3HE MET 8 18.872 11.667 -3.033 442 HE2 MET 8 1HE MET 8 17.271 11.952 -2.313 443 HE3 MET 8 2HE MET 8 17.407 11.525 -4.030 444 H CYS 9 HN CYS 9 13.323 11.429 -5.560 445 HA CYS 9 HA CYS 9 11.693 11.236 -3.197 446 HB2 CYS 9 2HB CYS 9 11.401 9.722 -5.091 447 HB3 CYS 9 3HB CYS 9 13.026 9.076 -4.909 448 H ALA 10 HN ALA 10 12.125 9.844 -1.304 449 HA ALA 10 HA ALA 10 14.962 10.104 -0.388 450 HB1 ALA 10 1HB ALA 10 14.029 10.095 1.898 451 HB2 ALA 10 2HB ALA 10 13.306 11.395 0.927 452 HB3 ALA 10 3HB ALA 10 12.387 9.905 1.240 453 H TYR 11 HN TYR 11 12.637 7.847 -1.469 454 HA TYR 11 HA TYR 11 13.280 5.698 0.397 455 HD1 TYR 11 1HD TYR 11 11.129 4.844 1.334 456 HD2 TYR 11 2HD TYR 11 11.919 2.998 -2.468 457 HE1 TYR 11 1HE TYR 11 11.126 2.610 2.389 458 HE2 TYR 11 2HE TYR 11 11.620 0.749 -1.456 459 HH TYR 11 HH TYR 11 11.152 0.345 2.059 460 HB2 TYR 11 2HB TYR 11 11.081 6.120 -0.935 461 HB3 TYR 11 3HB TYR 11 11.934 5.383 -2.291 462 HA PRO 12 HA PRO 12 16.933 4.245 -1.755 463 HB2 PRO 12 2HB PRO 12 17.059 1.696 -0.680 464 HB3 PRO 12 3HB PRO 12 17.508 3.176 0.214 465 HG2 PRO 12 2HG PRO 12 14.866 1.688 0.291 466 HG3 PRO 12 3HG PRO 12 15.861 2.255 1.674 467 HD2 PRO 12 2HD PRO 12 13.758 3.668 0.766 468 HD3 PRO 12 3HD PRO 12 15.241 4.517 1.297 469 H GLY 13 HN GLY 13 17.490 2.778 -3.475 470 HA2 GLY 13 2HA GLY 13 17.019 1.393 -5.297 471 HA3 GLY 13 3HA GLY 13 15.455 0.979 -4.568 472 H CYS 14 HN CYS 14 15.365 4.228 -4.388 473 HA CYS 14 HA CYS 14 14.486 4.663 -7.209 474 HB2 CYS 14 2HB CYS 14 12.460 4.366 -5.881 475 HB3 CYS 14 3HB CYS 14 13.037 5.466 -4.628 476 H ASN 15 HN ASN 15 14.264 6.926 -4.476 477 HA ASN 15 HA ASN 15 15.101 9.045 -4.216 478 HB2 ASN 15 2HB ASN 15 17.647 7.662 -5.168 479 HB3 ASN 15 3HB ASN 15 17.611 9.302 -4.529 480 HD21 ASN 15 1HD2 ASN 15 16.054 9.364 -2.349 481 HD22 ASN 15 2HD2 ASN 15 16.646 8.125 -1.212 482 H LYS 16 HN LYS 16 13.939 8.258 -6.906 483 HA LYS 16 HA LYS 16 15.420 9.623 -8.940 484 HB2 LYS 16 2HB LYS 16 12.523 8.701 -8.749 485 HB3 LYS 16 3HB LYS 16 13.208 9.405 -10.215 486 HG2 LYS 16 2HG LYS 16 14.898 7.652 -10.363 487 HG3 LYS 16 3HG LYS 16 14.320 6.900 -8.875 488 HD2 LYS 16 2HD LYS 16 12.594 7.268 -11.361 489 HD3 LYS 16 3HD LYS 16 13.531 5.804 -11.006 490 HE2 LYS 16 2HE LYS 16 12.315 5.482 -8.896 491 HE3 LYS 16 3HE LYS 16 11.395 6.954 -9.162 492 HZ1 LYS 16 3HZ LYS 16 10.450 5.966 -11.132 493 HZ2 LYS 16 1HZ LYS 16 10.174 5.005 -9.820 494 HZ3 LYS 16 2HZ LYS 16 11.332 4.587 -10.916 495 H ARG 17 HN ARG 17 14.688 11.459 -10.207 496 HA ARG 17 HA ARG 17 13.997 13.583 -8.296 497 HE ARG 17 HE ARG 17 18.644 14.463 -8.072 498 HB2 ARG 17 2HB ARG 17 15.493 13.442 -10.928 499 HB3 ARG 17 3HB ARG 17 14.796 14.974 -10.415 500 HG2 ARG 17 2HG ARG 17 17.106 14.860 -9.764 501 HG3 ARG 17 3HG ARG 17 16.061 14.990 -8.356 502 HD2 ARG 17 2HD ARG 17 16.414 12.625 -7.816 503 HD3 ARG 17 3HD ARG 17 17.336 12.392 -9.316 504 HH11 ARG 17 1HH1 ARG 17 17.899 11.205 -6.812 505 HH12 ARG 17 2HH1 ARG 17 19.424 11.175 -5.962 506 HH21 ARG 17 1HH2 ARG 17 20.441 14.321 -6.844 507 HH22 ARG 17 2HH2 ARG 17 20.749 12.881 -5.906 508 H TYR 18 HN TYR 18 12.265 14.830 -8.389 509 HA TYR 18 HA TYR 18 10.397 14.549 -10.714 510 HD1 TYR 18 2HD TYR 18 10.930 12.799 -7.196 511 HD2 TYR 18 1HD TYR 18 7.742 13.096 -10.100 512 HE1 TYR 18 2HE TYR 18 10.803 10.340 -7.332 513 HE2 TYR 18 1HE TYR 18 7.729 10.633 -10.324 514 HH TYR 18 HH TYR 18 9.701 8.564 -8.291 515 HB2 TYR 18 2HB TYR 18 9.863 14.973 -7.747 516 HB3 TYR 18 3HB TYR 18 8.637 15.104 -8.986 517 H PHE 19 HN PHE 19 8.929 16.460 -11.023 518 HA PHE 19 HA PHE 19 10.344 19.038 -10.390 519 HD1 PHE 19 1HD PHE 19 7.494 19.460 -13.514 520 HD2 PHE 19 2HD PHE 19 10.396 16.282 -13.682 521 HE1 PHE 19 1HE PHE 19 6.108 18.280 -15.211 522 HE2 PHE 19 2HE PHE 19 9.045 15.137 -15.417 523 HZ PHE 19 HZ PHE 19 6.889 16.124 -16.171 524 HB2 PHE 19 2HB PHE 19 9.859 19.747 -12.699 525 HB3 PHE 19 3HB PHE 19 10.928 18.374 -12.618 526 H LYS 20 HN LYS 20 7.574 17.402 -9.773 527 HA LYS 20 HA LYS 20 6.003 19.916 -9.514 528 HB2 LYS 20 2HB LYS 20 5.253 17.564 -11.229 529 HB3 LYS 20 3HB LYS 20 3.964 18.299 -10.230 530 HG2 LYS 20 2HG LYS 20 4.388 20.479 -11.223 531 HG3 LYS 20 3HG LYS 20 5.723 19.818 -12.180 532 HD2 LYS 20 2HD LYS 20 4.139 18.267 -13.316 533 HD3 LYS 20 3HD LYS 20 2.799 18.989 -12.397 534 HE2 LYS 20 2HE LYS 20 3.323 21.206 -13.385 535 HE3 LYS 20 3HE LYS 20 4.665 20.488 -14.292 536 HZ1 LYS 20 3HZ LYS 20 3.065 19.095 -15.429 537 HZ2 LYS 20 1HZ LYS 20 2.690 20.684 -15.636 538 HZ3 LYS 20 2HZ LYS 20 1.821 19.764 -14.584 539 H LEU 21 HN LEU 21 6.310 19.807 -7.322 540 HA LEU 21 HA LEU 21 6.479 17.937 -5.535 541 HG LEU 21 HG LEU 21 7.010 19.413 -3.445 542 HB2 LEU 21 2HB LEU 21 5.903 20.528 -5.232 543 HB3 LEU 21 3HB LEU 21 4.338 19.935 -4.798 544 HD11 LEU 21 1HD1 LEU 21 5.944 21.560 -2.971 545 HD12 LEU 21 2HD1 LEU 21 5.985 20.536 -1.533 546 HD13 LEU 21 3HD1 LEU 21 4.468 20.725 -2.439 547 HD21 LEU 21 3HD2 LEU 21 5.876 18.157 -1.654 548 HD22 LEU 21 1HD2 LEU 21 5.983 17.294 -3.185 549 HD23 LEU 21 2HD2 LEU 21 4.446 18.017 -2.690 550 H SER 22 HN SER 22 3.242 18.718 -6.887 551 HA SER 22 HA SER 22 1.755 16.717 -5.345 552 HG SER 22 HG SER 22 1.316 19.632 -7.284 553 HB2 SER 22 2HB SER 22 0.152 17.106 -7.482 554 HB3 SER 22 3HB SER 22 0.273 18.248 -6.141 555 H HIS 23 HN HIS 23 3.185 16.755 -8.589 556 HA HIS 23 HA HIS 23 2.334 14.098 -9.394 557 HD1 HIS 23 1HD HIS 23 4.978 14.063 -12.892 558 HD2 HIS 23 2HD HIS 23 6.622 15.834 -9.473 559 HE1 HIS 23 1HE HIS 23 7.445 14.465 -13.371 560 HB2 HIS 23 2HB HIS 23 3.287 14.645 -11.248 561 HB3 HIS 23 3HB HIS 23 3.663 16.174 -10.631 562 H LEU 24 HN LEU 24 5.465 15.276 -7.983 563 HA LEU 24 HA LEU 24 6.486 12.821 -7.228 564 HG LEU 24 HG LEU 24 9.094 14.572 -5.433 565 HB2 LEU 24 2HB LEU 24 7.638 14.966 -7.053 566 HB3 LEU 24 3HB LEU 24 6.629 15.476 -5.765 567 HD11 LEU 24 1HD1 LEU 24 8.596 14.186 -3.065 568 HD12 LEU 24 2HD1 LEU 24 6.861 14.094 -3.435 569 HD13 LEU 24 3HD1 LEU 24 7.754 15.608 -3.699 570 HD21 LEU 24 3HD2 LEU 24 9.462 12.395 -4.891 571 HD22 LEU 24 1HD2 LEU 24 8.261 12.152 -6.169 572 HD23 LEU 24 2HD2 LEU 24 7.794 12.062 -4.458 573 H GLN 25 HN GLN 25 3.938 14.712 -5.500 574 HA GLN 25 HA GLN 25 3.803 13.151 -3.129 575 HB2 GLN 25 2HB GLN 25 2.536 15.287 -3.572 576 HB3 GLN 25 3HB GLN 25 1.397 14.384 -4.573 577 HG2 GLN 25 2HG GLN 25 1.887 13.806 -1.692 578 HG3 GLN 25 3HG GLN 25 0.574 14.805 -2.330 579 HE21 GLN 25 1HE2 GLN 25 1.210 11.786 -1.070 580 HE22 GLN 25 2HE2 GLN 25 -0.114 10.953 -1.893 581 H MET 26 HN MET 26 2.127 12.705 -6.288 582 HA MET 26 HA MET 26 0.763 10.310 -5.605 583 HB2 MET 26 2HB MET 26 0.320 11.620 -7.659 584 HB3 MET 26 3HB MET 26 1.886 11.171 -8.327 585 HG2 MET 26 2HG MET 26 0.038 9.750 -9.198 586 HG3 MET 26 3HG MET 26 1.267 8.816 -8.353 587 HE1 MET 26 3HE MET 26 -1.535 6.500 -7.284 588 HE2 MET 26 1HE MET 26 0.183 6.668 -7.696 589 HE3 MET 26 2HE MET 26 -1.063 7.107 -8.878 590 H HIS 27 HN HIS 27 4.054 10.824 -7.032 591 HA HIS 27 HA HIS 27 4.794 8.075 -7.217 592 HD1 HIS 27 1HD HIS 27 7.183 6.937 -7.852 593 HD2 HIS 27 2HD HIS 27 8.528 10.026 -5.321 594 HE1 HIS 27 1HE HIS 27 9.281 6.071 -6.629 595 HB2 HIS 27 2HB HIS 27 6.222 9.699 -8.250 596 HB3 HIS 27 3HB HIS 27 6.438 10.608 -6.754 597 H SER 28 HN SER 28 5.026 10.369 -4.492 598 HA SER 28 HA SER 28 6.472 8.746 -2.686 599 HG SER 28 HG SER 28 3.426 10.796 -2.422 600 HB2 SER 28 2HB SER 28 5.860 10.253 -1.020 601 HB3 SER 28 3HB SER 28 5.726 11.243 -2.473 602 H ARG 29 HN ARG 29 3.009 8.717 -3.561 603 HA ARG 29 HA ARG 29 2.003 7.159 -1.374 604 HE ARG 29 HE ARG 29 -2.703 7.968 -1.681 605 HB2 ARG 29 2HB ARG 29 0.707 8.376 -3.169 606 HB3 ARG 29 3HB ARG 29 1.053 7.035 -4.272 607 HG2 ARG 29 2HG ARG 29 -0.172 5.479 -2.950 608 HG3 ARG 29 3HG ARG 29 -0.324 6.605 -1.592 609 HD2 ARG 29 2HD ARG 29 -1.472 7.315 -4.322 610 HD3 ARG 29 3HD ARG 29 -2.341 6.247 -3.238 611 HH11 ARG 29 1HH2 ARG 29 -1.038 9.291 -4.524 612 HH12 ARG 29 2HH2 ARG 29 -1.201 10.935 -3.914 613 HH21 ARG 29 1HH1 ARG 29 -2.958 10.093 -1.105 614 HH22 ARG 29 2HH1 ARG 29 -2.316 11.359 -2.143 615 H LYS 30 HN LYS 30 3.709 6.264 -4.393 616 HA LYS 30 HA LYS 30 3.228 3.439 -4.342 617 HB2 LYS 30 2HB LYS 30 4.262 4.737 -6.250 618 HB3 LYS 30 3HB LYS 30 5.714 4.925 -5.272 619 HG2 LYS 30 2HG LYS 30 6.252 3.221 -6.737 620 HG3 LYS 30 3HG LYS 30 5.982 2.432 -5.203 621 HD2 LYS 30 2HD LYS 30 4.991 1.040 -6.816 622 HD3 LYS 30 3HD LYS 30 3.615 1.861 -6.060 623 HE2 LYS 30 2HE LYS 30 3.387 3.368 -7.939 624 HE3 LYS 30 3HE LYS 30 4.971 2.901 -8.584 625 HZ1 LYS 30 3HZ LYS 30 4.093 0.712 -9.020 626 HZ2 LYS 30 1HZ LYS 30 3.212 1.861 -9.805 627 HZ3 LYS 30 2HZ LYS 30 2.608 1.152 -8.452 628 H HIS 31 HN HIS 31 5.562 5.502 -2.572 629 HA HIS 31 HA HIS 31 6.989 3.117 -1.576 630 HD1 HIS 31 1HD HIS 31 8.865 2.769 -2.645 631 HD2 HIS 31 2HD HIS 31 9.187 6.947 -3.072 632 HE1 HIS 31 1HE HIS 31 10.475 3.189 -4.589 633 HB2 HIS 31 2HB HIS 31 7.442 6.108 -1.227 634 HB3 HIS 31 3HB HIS 31 8.400 4.872 -0.395 635 H THR 32 HN THR 32 4.752 5.651 -0.274 636 HA THR 32 HA THR 32 4.869 5.428 2.338 637 HB THR 32 HB THR 32 2.394 5.457 2.569 638 HG1 THR 32 1HG THR 32 2.355 4.936 -0.249 639 HG21 THR 32 3HG2 THR 32 1.933 7.499 1.343 640 HG22 THR 32 1HG2 THR 32 3.422 7.302 0.408 641 HG23 THR 32 2HG2 THR 32 3.507 7.548 2.158 642 H GLY 33 HN GLY 33 3.858 2.672 0.368 643 HA2 GLY 33 2HA GLY 33 3.029 1.039 2.665 644 HA3 GLY 33 3HA GLY 33 3.239 0.491 0.994 645 H GLU 34 HN GLU 34 5.757 2.215 2.865 646 HA GLU 34 HA GLU 34 7.490 -0.212 2.619 647 HB2 GLU 34 2HB GLU 34 9.356 1.292 2.646 648 HB3 GLU 34 3HB GLU 34 8.261 1.777 1.386 649 HG2 GLU 34 2HG GLU 34 8.825 3.858 2.313 650 HG3 GLU 34 3HG GLU 34 7.351 3.515 3.197 651 H LYS 35 HN LYS 35 6.309 2.238 4.943 652 HA LYS 35 HA LYS 35 8.105 2.276 6.944 653 HB2 LYS 35 2HB LYS 35 5.735 3.281 6.821 654 HB3 LYS 35 3HB LYS 35 5.170 1.834 7.625 655 HG2 LYS 35 2HG LYS 35 7.176 3.887 8.678 656 HG3 LYS 35 3HG LYS 35 5.492 3.699 9.166 657 HD2 LYS 35 2HD LYS 35 6.126 1.350 9.992 658 HD3 LYS 35 3HD LYS 35 7.817 1.844 9.780 659 HE2 LYS 35 2HE LYS 35 7.485 3.740 11.298 660 HE3 LYS 35 3HE LYS 35 5.774 3.311 11.484 661 HZ1 LYS 35 3HZ LYS 35 6.451 1.220 12.423 662 HZ2 LYS 35 1HZ LYS 35 7.113 2.458 13.291 663 HZ3 LYS 35 2HZ LYS 35 8.045 1.591 12.244 664 HA PRO 36 HA PRO 36 8.432 -2.115 7.908 665 HB2 PRO 36 2HB PRO 36 10.950 -2.115 8.992 666 HB3 PRO 36 3HB PRO 36 10.651 -1.830 7.262 667 HG2 PRO 36 2HG PRO 36 11.077 0.270 9.412 668 HG3 PRO 36 3HG PRO 36 11.901 0.123 7.827 669 HD2 PRO 36 2HD PRO 36 9.743 1.754 8.225 670 HD3 PRO 36 3HD PRO 36 10.022 0.915 6.668 671 H TYR 37 HN TYR 37 6.678 -2.008 9.465 672 HA TYR 37 HA TYR 37 7.285 -1.448 12.305 673 HD1 TYR 37 2HD TYR 37 4.461 -1.420 9.214 674 HD2 TYR 37 1HD TYR 37 4.588 -0.113 13.325 675 HE1 TYR 37 2HE TYR 37 3.255 0.673 8.602 676 HE2 TYR 37 1HE TYR 37 3.329 1.941 12.717 677 HH TYR 37 HH TYR 37 2.528 3.245 10.913 678 HB2 TYR 37 2HB TYR 37 4.947 -2.999 11.099 679 HB3 TYR 37 3HB TYR 37 5.116 -2.348 12.739 680 H GLN 38 HN GLN 38 6.754 -3.375 13.863 681 HA GLN 38 HA GLN 38 7.897 -5.928 12.812 682 HB2 GLN 38 2HB GLN 38 8.532 -4.918 15.593 683 HB3 GLN 38 3HB GLN 38 9.321 -6.207 14.698 684 HG2 GLN 38 2HG GLN 38 9.585 -3.206 14.124 685 HG3 GLN 38 3HG GLN 38 10.709 -4.180 15.039 686 HE21 GLN 38 1HE2 GLN 38 10.257 -2.859 11.869 687 HE22 GLN 38 2HE2 GLN 38 11.340 -4.033 11.149 688 H CYS 39 HN CYS 39 7.239 -7.814 14.065 689 HA CYS 39 HA CYS 39 4.491 -7.885 14.500 690 HB2 CYS 39 2HB CYS 39 5.896 -9.896 14.145 691 HB3 CYS 39 3HB CYS 39 6.553 -9.721 15.795 692 H ASP 40 HN ASP 40 3.107 -7.430 16.099 693 HA ASP 40 HA ASP 40 4.067 -6.011 18.456 694 HB2 ASP 40 2HB ASP 40 2.028 -5.352 17.194 695 HB3 ASP 40 3HB ASP 40 1.278 -6.888 17.620 696 H PHE 41 HN PHE 41 3.766 -9.306 17.724 697 HA PHE 41 HA PHE 41 2.691 -10.286 20.244 698 HD1 PHE 41 1HD PHE 41 1.471 -12.310 20.414 699 HD2 PHE 41 2HD PHE 41 5.177 -13.823 18.820 700 HE1 PHE 41 1HE PHE 41 1.055 -14.497 21.500 701 HE2 PHE 41 2HE PHE 41 4.780 -15.990 19.929 702 HZ PHE 41 HZ PHE 41 2.709 -16.341 21.270 703 HB2 PHE 41 2HB PHE 41 2.771 -11.526 18.077 704 HB3 PHE 41 3HB PHE 41 4.515 -11.667 18.248 705 H LYS 42 HN LYS 42 5.771 -9.001 19.229 706 HA LYS 42 HA LYS 42 7.669 -8.456 20.455 707 HB2 LYS 42 2HB LYS 42 6.439 -9.701 22.962 708 HB3 LYS 42 3HB LYS 42 7.679 -8.487 22.831 709 HG2 LYS 42 2HG LYS 42 4.721 -8.132 22.278 710 HG3 LYS 42 3HG LYS 42 5.674 -7.422 23.566 711 HD2 LYS 42 2HD LYS 42 6.906 -6.022 21.953 712 HD3 LYS 42 3HD LYS 42 6.033 -6.778 20.602 713 HE2 LYS 42 2HE LYS 42 3.880 -5.995 21.562 714 HE3 LYS 42 3HE LYS 42 4.766 -5.139 22.831 715 HZ1 LYS 42 3HZ LYS 42 5.127 -4.685 19.942 716 HZ2 LYS 42 1HZ LYS 42 5.776 -3.783 21.161 717 HZ3 LYS 42 2HZ LYS 42 4.141 -3.784 20.890 718 H ASP 43 HN ASP 43 6.404 -11.719 21.332 719 HA ASP 43 HA ASP 43 9.087 -12.860 21.612 720 HB2 ASP 43 2HB ASP 43 6.329 -14.124 21.321 721 HB3 ASP 43 3HB ASP 43 7.812 -15.034 21.616 722 H CYS 44 HN CYS 44 6.937 -12.141 18.973 723 HA CYS 44 HA CYS 44 8.186 -13.996 17.067 724 HB2 CYS 44 2HB CYS 44 5.815 -13.331 16.827 725 HB3 CYS 44 3HB CYS 44 6.285 -11.646 16.710 726 H GLU 45 HN GLU 45 9.112 -12.982 15.000 727 HA GLU 45 HA GLU 45 10.765 -10.566 15.621 728 HB2 GLU 45 2HB GLU 45 12.782 -11.652 14.850 729 HB3 GLU 45 3HB GLU 45 12.112 -12.564 16.180 730 HG2 GLU 45 2HG GLU 45 11.899 -13.371 13.238 731 HG3 GLU 45 3HG GLU 45 13.083 -13.966 14.382 732 H ARG 46 HN ARG 46 8.370 -10.983 13.919 733 HA ARG 46 HA ARG 46 9.483 -10.902 11.158 734 HE ARG 46 HE ARG 46 6.477 -15.300 10.107 735 HB2 ARG 46 2HB ARG 46 6.651 -11.093 12.271 736 HB3 ARG 46 3HB ARG 46 6.992 -10.887 10.549 737 HG2 ARG 46 2HG ARG 46 8.184 -12.975 10.415 738 HG3 ARG 46 3HG ARG 46 8.153 -13.191 12.173 739 HD2 ARG 46 2HD ARG 46 5.700 -13.307 12.139 740 HD3 ARG 46 3HD ARG 46 5.694 -13.100 10.382 741 HH11 ARG 46 1HH1 ARG 46 6.467 -14.583 13.613 742 HH12 ARG 46 2HH1 ARG 46 6.679 -16.263 13.994 743 HH21 ARG 46 1HH2 ARG 46 6.777 -17.394 10.739 744 HH22 ARG 46 2HH2 ARG 46 6.847 -17.780 12.447 745 H ARG 47 HN ARG 47 8.523 -9.250 9.673 746 HA ARG 47 HA ARG 47 7.843 -6.691 10.996 747 HE ARG 47 HE ARG 47 12.544 -6.342 11.081 748 HB2 ARG 47 2HB ARG 47 9.511 -5.494 9.521 749 HB3 ARG 47 3HB ARG 47 10.140 -6.462 10.827 750 HG2 ARG 47 2HG ARG 47 10.462 -8.307 8.893 751 HG3 ARG 47 3HG ARG 47 10.301 -6.922 7.829 752 HD2 ARG 47 2HD ARG 47 12.684 -7.507 8.401 753 HD3 ARG 47 3HD ARG 47 12.243 -5.852 8.835 754 HH11 ARG 47 1HH1 ARG 47 12.349 -9.556 9.570 755 HH12 ARG 47 2HH1 ARG 47 12.071 -10.246 11.185 756 HH21 ARG 47 1HH2 ARG 47 12.131 -7.343 12.889 757 HH22 ARG 47 2HH2 ARG 47 12.060 -9.126 12.911 758 H PHE 48 HN PHE 48 6.805 -5.192 9.674 759 HA PHE 48 HA PHE 48 5.847 -6.258 7.043 760 HD1 PHE 48 1HD PHE 48 3.669 -7.912 6.875 761 HD2 PHE 48 2HD PHE 48 4.649 -6.913 10.940 762 HE1 PHE 48 1HE PHE 48 3.531 -10.300 7.485 763 HE2 PHE 48 2HE PHE 48 4.673 -9.328 11.525 764 HZ PHE 48 HZ PHE 48 4.156 -11.020 9.775 765 HB2 PHE 48 2HB PHE 48 4.128 -5.153 9.295 766 HB3 PHE 48 3HB PHE 48 3.558 -5.569 7.685 767 H SER 49 HN SER 49 5.519 -4.731 5.487 768 HA SER 49 HA SER 49 6.702 -2.127 6.056 769 HG SER 49 HG SER 49 5.138 -2.206 2.634 770 HB2 SER 49 2HB SER 49 6.813 -1.867 3.730 771 HB3 SER 49 3HB SER 49 7.041 -3.592 3.958 772 H ARG 50 HN ARG 50 3.615 -3.210 6.602 773 HA ARG 50 HA ARG 50 2.559 -0.454 6.478 774 HE ARG 50 HE ARG 50 -0.657 -2.445 3.180 775 HB2 ARG 50 2HB ARG 50 1.349 -2.798 4.954 776 HB3 ARG 50 3HB ARG 50 0.342 -1.517 5.623 777 HG2 ARG 50 2HG ARG 50 1.968 0.133 4.430 778 HG3 ARG 50 3HG ARG 50 2.414 -1.273 3.449 779 HD2 ARG 50 2HD ARG 50 -0.402 -0.149 3.844 780 HD3 ARG 50 3HD ARG 50 0.612 0.163 2.449 781 HH11 ARG 50 1HH2 ARG 50 0.892 -0.508 0.674 782 HH12 ARG 50 2HH2 ARG 50 0.572 -1.760 -0.520 783 HH21 ARG 50 1HH1 ARG 50 -1.012 -3.883 1.553 784 HH22 ARG 50 2HH1 ARG 50 -0.474 -3.496 -0.061 785 H SER 51 HN SER 51 0.973 -0.012 7.993 786 HA SER 51 HA SER 51 0.968 -1.520 10.396 787 HG SER 51 HG SER 51 -1.445 0.825 11.614 788 HB2 SER 51 2HB SER 51 0.400 0.907 10.200 789 HB3 SER 51 3HB SER 51 -1.113 0.473 9.397 790 H ASP 52 HN ASP 52 -1.359 -1.427 7.663 791 HA ASP 52 HA ASP 52 -3.341 -3.091 8.872 792 HB2 ASP 52 2HB ASP 52 -4.072 -3.458 6.470 793 HB3 ASP 52 3HB ASP 52 -3.951 -1.793 7.035 794 H GLN 53 HN GLN 53 -0.417 -3.875 6.942 795 HA GLN 53 HA GLN 53 -1.005 -6.696 6.681 796 HB2 GLN 53 2HB GLN 53 0.638 -5.279 5.299 797 HB3 GLN 53 3HB GLN 53 1.732 -5.375 6.656 798 HG2 GLN 53 2HG GLN 53 2.394 -7.097 5.163 799 HG3 GLN 53 3HG GLN 53 1.527 -7.935 6.463 800 HE21 GLN 53 1HE2 GLN 53 0.954 -9.791 5.244 801 HE22 GLN 53 2HE2 GLN 53 -0.135 -9.599 3.845 802 H LEU 54 HN LEU 54 0.785 -4.691 9.062 803 HA LEU 54 HA LEU 54 1.683 -6.900 10.710 804 HG LEU 54 HG LEU 54 1.034 -4.886 13.439 805 HB2 LEU 54 2HB LEU 54 2.736 -4.744 10.922 806 HB3 LEU 54 3HB LEU 54 1.215 -3.935 11.213 807 HD11 LEU 54 1HD1 LEU 54 2.152 -7.096 13.110 808 HD12 LEU 54 2HD1 LEU 54 2.881 -6.178 14.428 809 HD13 LEU 54 3HD1 LEU 54 3.702 -6.269 12.864 810 HD21 LEU 54 3HD2 LEU 54 3.890 -3.985 13.078 811 HD22 LEU 54 1HD2 LEU 54 2.843 -3.704 14.465 812 HD23 LEU 54 2HD2 LEU 54 2.521 -2.837 12.947 813 H LYS 55 HN LYS 55 -1.274 -4.819 10.700 814 HA LYS 55 HA LYS 55 -2.477 -5.945 13.070 815 HB2 LYS 55 2HB LYS 55 -3.386 -4.247 10.764 816 HB3 LYS 55 3HB LYS 55 -4.631 -5.185 11.569 817 HG2 LYS 55 2HG LYS 55 -4.599 -3.081 12.642 818 HG3 LYS 55 3HG LYS 55 -3.939 -4.262 13.773 819 HD2 LYS 55 2HD LYS 55 -1.612 -3.483 13.102 820 HD3 LYS 55 3HD LYS 55 -2.401 -2.237 12.103 821 HE2 LYS 55 2HE LYS 55 -3.502 -1.316 14.099 822 HE3 LYS 55 3HE LYS 55 -2.706 -2.540 15.110 823 HZ1 LYS 55 3HZ LYS 55 -0.600 -1.638 14.493 824 HZ2 LYS 55 1HZ LYS 55 -1.533 -0.397 15.047 825 HZ3 LYS 55 2HZ LYS 55 -1.275 -0.590 13.424 826 H ARG 56 HN ARG 56 -2.571 -6.865 9.604 827 HA ARG 56 HA ARG 56 -4.397 -9.073 9.887 828 HE ARG 56 HE ARG 56 -3.790 -8.788 5.305 829 HB2 ARG 56 2HB ARG 56 -3.684 -8.124 7.692 830 HB3 ARG 56 3HB ARG 56 -2.045 -8.670 7.981 831 HG2 ARG 56 2HG ARG 56 -3.083 -11.067 8.109 832 HG3 ARG 56 3HG ARG 56 -4.475 -10.328 7.323 833 HD2 ARG 56 2HD ARG 56 -1.595 -10.219 6.290 834 HD3 ARG 56 3HD ARG 56 -2.767 -11.441 5.816 835 HH11 ARG 56 2HH1 ARG 56 -1.771 -11.303 3.804 836 HH12 ARG 56 1HH1 ARG 56 -1.726 -10.407 2.302 837 HH21 ARG 56 2HH2 ARG 56 -3.827 -7.931 3.168 838 HH22 ARG 56 1HH2 ARG 56 -2.841 -8.750 1.969 839 H HIS 57 HN HIS 57 -0.800 -8.851 10.071 840 HA HIS 57 HA HIS 57 -0.315 -11.590 10.567 841 HD1 HIS 57 1HD HIS 57 1.913 -12.813 10.335 842 HD2 HIS 57 2HD HIS 57 2.888 -10.095 13.397 843 HE1 HIS 57 1HE HIS 57 3.399 -14.073 12.011 844 HB2 HIS 57 2HB HIS 57 1.423 -9.949 9.972 845 HB3 HIS 57 3HB HIS 57 1.271 -9.171 11.555 846 H GLN 58 HN GLN 58 -1.047 -8.927 12.866 847 HA GLN 58 HA GLN 58 -0.574 -10.228 15.298 848 HB2 GLN 58 2HB GLN 58 -2.621 -8.205 14.418 849 HB3 GLN 58 3HB GLN 58 -2.655 -8.859 16.052 850 HG2 GLN 58 2HG GLN 58 -0.417 -7.987 16.489 851 HG3 GLN 58 3HG GLN 58 -0.388 -7.241 14.879 852 HE21 GLN 58 1HE2 GLN 58 -0.836 -6.181 18.061 853 HE22 GLN 58 2HE2 GLN 58 -2.136 -5.080 17.656 854 H ARG 59 HN ARG 59 -3.375 -10.624 13.063 855 HA ARG 59 HA ARG 59 -5.090 -12.030 14.914 856 HE ARG 59 HE ARG 59 -6.233 -10.325 15.528 857 HB2 ARG 59 2HB ARG 59 -4.980 -11.693 11.935 858 HB3 ARG 59 3HB ARG 59 -5.879 -13.053 12.570 859 HG2 ARG 59 2HG ARG 59 -7.348 -11.157 12.236 860 HG3 ARG 59 3HG ARG 59 -7.284 -11.620 13.920 861 HD2 ARG 59 2HD ARG 59 -5.612 -9.353 12.838 862 HD3 ARG 59 3HD ARG 59 -7.300 -9.116 13.297 863 HH11 ARG 59 1HH2 ARG 59 -5.041 -7.532 13.784 864 HH12 ARG 59 2HH2 ARG 59 -4.491 -6.742 15.237 865 HH21 ARG 59 1HH1 ARG 59 -5.397 -9.389 17.267 866 HH22 ARG 59 2HH1 ARG 59 -4.780 -7.737 17.199 867 H ARG 60 HN ARG 60 -2.361 -13.061 12.886 868 HA ARG 60 HA ARG 60 -2.751 -15.908 13.048 869 HE ARG 60 HE ARG 60 1.004 -18.552 11.647 870 HB2 ARG 60 2HB ARG 60 -1.072 -14.661 11.601 871 HB3 ARG 60 3HB ARG 60 -0.071 -14.441 13.053 872 HG2 ARG 60 2HG ARG 60 0.163 -16.840 13.342 873 HG3 ARG 60 3HG ARG 60 -0.997 -17.154 12.048 874 HD2 ARG 60 2HD ARG 60 0.616 -15.949 10.471 875 HD3 ARG 60 3HD ARG 60 1.761 -15.875 11.816 876 HH11 ARG 60 1HH2 ARG 60 2.637 -16.343 9.422 877 HH12 ARG 60 2HH2 ARG 60 3.599 -17.643 8.753 878 HH21 ARG 60 1HH1 ARG 60 2.210 -20.121 10.681 879 HH22 ARG 60 2HH1 ARG 60 3.332 -19.709 9.406 880 H HIS 61 HN HIS 61 -1.536 -13.505 15.373 881 HA HIS 61 HA HIS 61 -0.651 -15.674 17.225 882 HD1 HIS 61 1HD HIS 61 1.870 -15.972 17.536 883 HD2 HIS 61 2HD HIS 61 2.003 -12.152 15.760 884 HE1 HIS 61 1HE HIS 61 4.163 -15.750 16.402 885 HB2 HIS 61 2HB HIS 61 -0.162 -12.668 17.138 886 HB3 HIS 61 3HB HIS 61 0.300 -13.676 18.498 887 H THR 62 HN THR 62 -3.466 -13.916 16.638 888 HA THR 62 HA THR 62 -4.235 -13.897 19.551 889 HB THR 62 HB THR 62 -5.555 -11.816 19.058 890 HG1 THR 62 1HG THR 62 -3.952 -11.679 16.743 891 HG21 THR 62 3HG2 THR 62 -3.670 -10.247 18.933 892 HG22 THR 62 1HG2 THR 62 -2.574 -11.547 18.422 893 HG23 THR 62 2HG2 THR 62 -3.303 -11.585 20.032 894 H GLY 63 HN GLY 63 -5.005 -14.982 16.390 895 HA2 GLY 63 2HA GLY 63 -6.803 -16.264 15.660 896 HA3 GLY 63 3HA GLY 63 -7.534 -16.151 17.274 897 H VAL 64 HN VAL 64 -9.216 -14.807 17.586 898 HA VAL 64 HA VAL 64 -10.865 -13.236 17.212 899 HB VAL 64 HB VAL 64 -8.930 -11.756 15.351 900 HG11 VAL 64 1HG1 VAL 64 -10.168 -9.801 16.096 901 HG12 VAL 64 2HG1 VAL 64 -11.293 -10.974 15.406 902 HG13 VAL 64 3HG1 VAL 64 -11.171 -10.802 17.165 903 HG21 VAL 64 3HG2 VAL 64 -9.094 -11.640 18.392 904 HG22 VAL 64 1HG2 VAL 64 -7.682 -12.115 17.424 905 HG23 VAL 64 2HG2 VAL 64 -8.257 -10.452 17.366 906 H LYS 65 HN LYS 65 -9.210 -13.346 13.976 907 HA LYS 65 HA LYS 65 -10.146 -13.339 11.847 908 HB2 LYS 65 2HB LYS 65 -11.761 -15.616 13.097 909 HB3 LYS 65 3HB LYS 65 -11.645 -15.270 11.365 910 HG2 LYS 65 2HG LYS 65 -9.070 -15.384 11.700 911 HG3 LYS 65 3HG LYS 65 -9.425 -16.168 13.241 912 HD2 LYS 65 2HD LYS 65 -10.325 -17.120 10.487 913 HD3 LYS 65 3HD LYS 65 -8.942 -17.756 11.376 914 HE2 LYS 65 2HE LYS 65 -10.341 -18.662 13.114 915 HE3 LYS 65 3HE LYS 65 -11.764 -17.811 12.494 916 HZ1 LYS 65 3HZ LYS 65 -10.307 -19.935 11.063 917 HZ2 LYS 65 1HZ LYS 65 -11.627 -19.114 10.500 918 HZ3 LYS 65 2HZ LYS 65 -11.767 -20.106 11.815 919 HA PRO 66 HA PRO 66 -13.692 -10.811 13.454 920 HB2 PRO 66 2HB PRO 66 -13.068 -8.431 12.174 921 HB3 PRO 66 3HB PRO 66 -12.327 -8.978 13.702 922 HG2 PRO 66 2HG PRO 66 -11.224 -9.277 10.895 923 HG3 PRO 66 3HG PRO 66 -10.385 -8.658 12.357 924 HD2 PRO 66 2HD PRO 66 -10.091 -11.210 11.558 925 HD3 PRO 66 3HD PRO 66 -10.237 -10.828 13.296 926 H PHE 67 HN PHE 67 -12.729 -11.626 10.173 927 HA PHE 67 HA PHE 67 -15.246 -10.537 8.995 928 HD1 PHE 67 2HD PHE 67 -14.535 -9.144 6.408 929 HD2 PHE 67 1HD PHE 67 -11.174 -10.812 8.513 930 HE1 PHE 67 2HE PHE 67 -13.287 -7.021 6.107 931 HE2 PHE 67 1HE PHE 67 -9.901 -8.707 8.163 932 HZ PHE 67 HZ PHE 67 -10.966 -6.803 6.965 933 HB2 PHE 67 2HB PHE 67 -13.040 -12.259 7.749 934 HB3 PHE 67 3HB PHE 67 -14.364 -11.536 6.892 935 H GLN 68 HN GLN 68 -17.107 -11.742 8.842 936 HA GLN 68 HA GLN 68 -16.897 -14.697 9.347 937 HB2 GLN 68 2HB GLN 68 -19.108 -12.916 10.494 938 HB3 GLN 68 3HB GLN 68 -18.894 -14.656 10.710 939 HG2 GLN 68 2HG GLN 68 -16.626 -14.052 11.829 940 HG3 GLN 68 3HG GLN 68 -17.233 -12.397 11.890 941 HE21 GLN 68 1HE2 GLN 68 -19.454 -12.095 13.049 942 HE22 GLN 68 2HE2 GLN 68 -19.754 -13.256 14.348 943 H CYS 69 HN CYS 69 -17.972 -15.905 7.887 944 HA CYS 69 HA CYS 69 -19.220 -14.691 5.624 945 HB2 CYS 69 2HB CYS 69 -18.241 -16.971 5.569 946 HB3 CYS 69 3HB CYS 69 -19.509 -17.534 6.682 947 H LYS 70 HN LYS 70 -21.146 -13.749 5.441 948 HA LYS 70 HA LYS 70 -23.175 -13.920 7.462 949 HB2 LYS 70 2HB LYS 70 -24.464 -12.484 6.007 950 HB3 LYS 70 3HB LYS 70 -22.813 -11.910 6.082 951 HG2 LYS 70 2HG LYS 70 -23.995 -13.492 3.741 952 HG3 LYS 70 3HG LYS 70 -23.943 -11.750 3.864 953 HD2 LYS 70 2HD LYS 70 -22.056 -11.870 2.677 954 HD3 LYS 70 3HD LYS 70 -21.288 -12.232 4.211 955 HE2 LYS 70 2HE LYS 70 -20.495 -13.854 2.615 956 HE3 LYS 70 3HE LYS 70 -21.628 -14.719 3.660 957 HZ1 LYS 70 3HZ LYS 70 -22.115 -15.281 1.478 958 HZ2 LYS 70 1HZ LYS 70 -22.154 -13.707 0.949 959 HZ3 LYS 70 2HZ LYS 70 -23.325 -14.296 1.957 960 H THR 71 HN THR 71 -22.358 -16.172 5.091 961 HA THR 71 HA THR 71 -25.150 -17.034 4.521 962 HB THR 71 HB THR 71 -22.976 -18.818 3.653 963 HG1 THR 71 1HG THR 71 -21.766 -17.075 3.342 964 HG21 THR 71 3HG2 THR 71 -24.136 -18.660 1.509 965 HG22 THR 71 1HG2 THR 71 -25.130 -17.324 2.122 966 HG23 THR 71 2HG2 THR 71 -25.289 -18.953 2.826 967 H CYS 72 HN CYS 72 -22.118 -18.322 5.998 968 HA CYS 72 HA CYS 72 -23.803 -20.305 7.483 969 HB2 CYS 72 2HB CYS 72 -21.660 -21.623 7.661 970 HB3 CYS 72 3HB CYS 72 -22.250 -21.427 6.012 971 H GLN 73 HN GLN 73 -20.504 -19.106 7.945 972 HA GLN 73 HA GLN 73 -20.656 -17.357 10.064 973 HB2 GLN 73 2HB GLN 73 -21.476 -20.033 11.016 974 HB3 GLN 73 3HB GLN 73 -20.013 -19.569 11.796 975 HG2 GLN 73 2HG GLN 73 -22.476 -17.784 11.716 976 HG3 GLN 73 3HG GLN 73 -22.075 -18.895 13.014 977 HE21 GLN 73 1HE2 GLN 73 -19.006 -17.597 12.132 978 HE22 GLN 73 2HE2 GLN 73 -19.110 -16.240 13.270 979 H ARG 74 HN ARG 74 -19.057 -19.229 7.919 980 HA ARG 74 HA ARG 74 -16.651 -20.072 9.085 981 HE ARG 74 HE ARG 74 -14.931 -22.885 8.180 982 HB2 ARG 74 2HB ARG 74 -17.510 -19.238 6.310 983 HB3 ARG 74 3HB ARG 74 -15.815 -19.455 6.614 984 HG2 ARG 74 2HG ARG 74 -17.402 -21.762 7.569 985 HG3 ARG 74 3HG ARG 74 -17.573 -21.424 5.849 986 HD2 ARG 74 2HD ARG 74 -15.788 -22.937 5.995 987 HD3 ARG 74 3HD ARG 74 -15.067 -21.383 5.612 988 HH11 ARG 74 1HH1 ARG 74 -13.751 -19.971 6.510 989 HH12 ARG 74 2HH1 ARG 74 -12.431 -19.814 7.639 990 HH21 ARG 74 1HH2 ARG 74 -13.176 -22.605 9.477 991 HH22 ARG 74 2HH2 ARG 74 -12.112 -21.239 9.207 992 H LYS 75 HN LYS 75 -15.499 -18.763 10.420 993 HA LYS 75 HA LYS 75 -15.183 -15.992 9.828 994 HB2 LYS 75 2HB LYS 75 -13.726 -17.710 11.889 995 HB3 LYS 75 3HB LYS 75 -13.873 -15.947 11.869 996 HG2 LYS 75 2HG LYS 75 -16.401 -16.274 12.082 997 HG3 LYS 75 3HG LYS 75 -16.071 -17.988 12.342 998 HD2 LYS 75 2HD LYS 75 -16.380 -16.928 14.474 999 HD3 LYS 75 3HD LYS 75 -14.695 -17.450 14.328 1000 HE2 LYS 75 2HE LYS 75 -14.005 -15.135 13.809 1001 HE3 LYS 75 3HE LYS 75 -15.693 -14.608 13.831 1002 HZ1 LYS 75 3HZ LYS 75 -15.795 -15.133 16.140 1003 HZ2 LYS 75 1HZ LYS 75 -14.479 -14.163 15.874 1004 HZ3 LYS 75 2HZ LYS 75 -14.268 -15.767 16.130 1005 H PHE 76 HN PHE 76 -13.508 -14.845 9.096 1006 HA PHE 76 HA PHE 76 -10.965 -16.248 8.425 1007 HD1 PHE 76 1HD PHE 76 -10.716 -17.387 5.634 1008 HD2 PHE 76 2HD PHE 76 -14.543 -15.523 6.352 1009 HE1 PHE 76 1HE PHE 76 -11.853 -19.242 4.465 1010 HE2 PHE 76 2HE PHE 76 -15.676 -17.399 5.237 1011 HZ PHE 76 HZ PHE 76 -14.330 -19.292 4.299 1012 HB2 PHE 76 2HB PHE 76 -12.442 -14.264 6.638 1013 HB3 PHE 76 3HB PHE 76 -10.888 -14.998 6.297 1014 H SER 77 HN SER 77 -9.131 -14.777 8.226 1015 HA SER 77 HA SER 77 -9.397 -12.467 10.069 1016 HG SER 77 HG SER 77 -6.977 -11.519 9.469 1017 HB2 SER 77 2HB SER 77 -7.589 -14.011 10.593 1018 HB3 SER 77 3HB SER 77 -7.000 -13.959 8.917 1019 H ARG 78 HN ARG 78 -9.610 -12.975 6.756 1020 HA ARG 78 HA ARG 78 -8.678 -10.200 6.168 1021 HE ARG 78 HE ARG 78 -6.035 -12.787 3.205 1022 HB2 ARG 78 2HB ARG 78 -7.986 -12.743 4.654 1023 HB3 ARG 78 3HB ARG 78 -7.749 -11.128 3.990 1024 HG2 ARG 78 2HG ARG 78 -5.914 -10.672 5.261 1025 HG3 ARG 78 3HG ARG 78 -6.498 -11.543 6.673 1026 HD2 ARG 78 2HD ARG 78 -4.605 -12.698 5.850 1027 HD3 ARG 78 3HD ARG 78 -6.031 -13.703 5.604 1028 HH11 ARG 78 1HH1 ARG 78 -3.059 -13.381 4.952 1029 HH12 ARG 78 2HH1 ARG 78 -2.148 -13.464 3.438 1030 HH21 ARG 78 1HH2 ARG 78 -4.903 -12.959 1.464 1031 HH22 ARG 78 2HH2 ARG 78 -3.173 -13.273 1.453 1032 H SER 79 HN SER 79 -9.869 -9.095 4.696 1033 HA SER 79 HA SER 79 -12.512 -9.971 4.032 1034 HG SER 79 HG SER 79 -10.549 -6.647 2.766 1035 HB2 SER 79 2HB SER 79 -12.445 -7.972 2.479 1036 HB3 SER 79 3HB SER 79 -12.043 -7.613 4.164 1037 H ASP 80 HN ASP 80 -9.445 -9.829 2.146 1038 HA ASP 80 HA ASP 80 -10.451 -10.683 -0.315 1039 HB2 ASP 80 2HB ASP 80 -8.137 -11.470 -0.802 1040 HB3 ASP 80 3HB ASP 80 -8.270 -9.853 -0.115 1041 H HIS 81 HN HIS 81 -9.544 -12.746 2.505 1042 HA HIS 81 HA HIS 81 -10.007 -15.311 1.146 1043 HD1 HIS 81 1HD HIS 81 -7.479 -15.430 1.389 1044 HD2 HIS 81 2HD HIS 81 -8.074 -15.881 5.525 1045 HE1 HIS 81 1HE HIS 81 -5.282 -16.038 2.331 1046 HB2 HIS 81 2HB HIS 81 -9.948 -14.517 4.095 1047 HB3 HIS 81 3HB HIS 81 -10.227 -16.146 3.528 1048 H LEU 82 HN LEU 82 -11.934 -13.130 3.311 1049 HA LEU 82 HA LEU 82 -14.210 -14.846 3.466 1050 HG LEU 82 HG LEU 82 -16.235 -13.841 3.996 1051 HB2 LEU 82 2HB LEU 82 -13.792 -12.967 4.995 1052 HB3 LEU 82 3HB LEU 82 -14.077 -11.794 3.705 1053 HD11 LEU 82 1HD1 LEU 82 -16.269 -11.778 6.162 1054 HD12 LEU 82 2HD1 LEU 82 -15.557 -13.425 6.416 1055 HD13 LEU 82 3HD1 LEU 82 -17.232 -13.210 5.910 1056 HD21 LEU 82 3HD2 LEU 82 -16.502 -11.828 2.545 1057 HD22 LEU 82 1HD2 LEU 82 -16.342 -10.790 3.974 1058 HD23 LEU 82 2HD2 LEU 82 -17.721 -11.900 3.815 1059 H LYS 83 HN LYS 83 -13.467 -12.127 1.218 1060 HA LYS 83 HA LYS 83 -15.939 -12.311 -0.268 1061 HB2 LYS 83 2HB LYS 83 -14.217 -10.389 -0.204 1062 HB3 LYS 83 3HB LYS 83 -13.265 -11.316 -1.376 1063 HG2 LYS 83 2HG LYS 83 -15.184 -11.282 -2.953 1064 HG3 LYS 83 3HG LYS 83 -16.220 -10.584 -1.710 1065 HD2 LYS 83 2HD LYS 83 -15.666 -8.796 -3.158 1066 HD3 LYS 83 3HD LYS 83 -14.770 -8.540 -1.664 1067 HE2 LYS 83 2HE LYS 83 -13.330 -8.031 -3.526 1068 HE3 LYS 83 3HE LYS 83 -12.731 -9.514 -2.765 1069 HZ1 LYS 83 3HZ LYS 83 -12.805 -9.665 -5.171 1070 HZ2 LYS 83 1HZ LYS 83 -14.428 -9.386 -5.179 1071 HZ3 LYS 83 2HZ LYS 83 -13.831 -10.764 -4.499 1072 H THR 84 HN THR 84 -12.741 -13.909 -0.525 1073 HA THR 84 HA THR 84 -13.235 -15.296 -2.990 1074 HB THR 84 HB THR 84 -11.506 -15.908 -0.583 1075 HG1 THR 84 1HG THR 84 -10.735 -14.260 -1.579 1076 HG21 THR 84 3HG2 THR 84 -10.206 -17.455 -1.808 1077 HG22 THR 84 1HG2 THR 84 -11.362 -17.425 -3.183 1078 HG23 THR 84 2HG2 THR 84 -11.829 -18.100 -1.598 1079 H HIS 85 HN HIS 85 -13.709 -16.289 0.435 1080 HA HIS 85 HA HIS 85 -15.002 -18.775 -0.124 1081 HD1 HIS 85 1HD HIS 85 -15.750 -20.710 1.849 1082 HD2 HIS 85 2HD HIS 85 -17.370 -17.171 3.482 1083 HE1 HIS 85 1HE HIS 85 -17.989 -21.334 2.931 1084 HB2 HIS 85 2HB HIS 85 -14.124 -18.272 2.059 1085 HB3 HIS 85 3HB HIS 85 -15.152 -16.854 2.228 1086 H THR 86 HN THR 86 -16.229 -15.433 0.150 1087 HA THR 86 HA THR 86 -19.009 -15.984 0.069 1088 HB THR 86 HB THR 86 -17.491 -13.634 -1.149 1089 HG1 THR 86 1HG THR 86 -17.196 -13.953 1.106 1090 HG21 THR 86 3HG2 THR 86 -19.758 -13.621 -2.032 1091 HG22 THR 86 1HG2 THR 86 -19.492 -12.342 -0.837 1092 HG23 THR 86 2HG2 THR 86 -20.405 -13.804 -0.379 1093 H ARG 87 HN ARG 87 -16.544 -15.770 -2.562 1094 HA ARG 87 HA ARG 87 -18.504 -16.021 -4.727 1095 HE ARG 87 HE ARG 87 -13.526 -15.619 -6.749 1096 HB2 ARG 87 2HB ARG 87 -15.486 -16.469 -4.621 1097 HB3 ARG 87 3HB ARG 87 -16.462 -16.667 -6.059 1098 HG2 ARG 87 2HG ARG 87 -17.237 -14.260 -5.783 1099 HG3 ARG 87 3HG ARG 87 -16.010 -14.081 -4.539 1100 HD2 ARG 87 2HD ARG 87 -15.558 -14.844 -7.454 1101 HD3 ARG 87 3HD ARG 87 -15.203 -13.276 -6.732 1102 HH11 ARG 87 1HH2 ARG 87 -14.231 -12.967 -4.560 1103 HH12 ARG 87 2HH2 ARG 87 -12.599 -13.025 -3.886 1104 HH21 ARG 87 1HH1 ARG 87 -11.653 -15.705 -5.821 1105 HH22 ARG 87 2HH1 ARG 87 -11.251 -14.707 -4.411 1106 H THR 88 HN THR 88 -16.954 -18.204 -2.475 1107 HA THR 88 HA THR 88 -17.365 -20.644 -4.048 1108 HB THR 88 HB THR 88 -16.875 -20.279 -1.039 1109 HG1 THR 88 1HG THR 88 -15.230 -19.627 -2.577 1110 HG21 THR 88 3HG2 THR 88 -17.021 -22.729 -2.716 1111 HG22 THR 88 1HG2 THR 88 -17.869 -22.376 -1.200 1112 HG23 THR 88 2HG2 THR 88 -16.116 -22.647 -1.177 1113 H HIS 89 HN HIS 89 -19.250 -18.635 -1.797 1114 HA HIS 89 HA HIS 89 -21.436 -20.647 -1.641 1115 HD1 HIS 89 1HD HIS 89 -22.711 -21.290 0.405 1116 HD2 HIS 89 2HD HIS 89 -20.140 -18.372 2.014 1117 HE1 HIS 89 1HE HIS 89 -22.262 -21.959 2.846 1118 HB2 HIS 89 2HB HIS 89 -20.899 -17.927 -0.428 1119 HB3 HIS 89 3HB HIS 89 -22.559 -18.479 -0.573 1120 H THR 90 HN THR 90 -20.449 -17.817 -3.477 1121 HA THR 90 HA THR 90 -23.115 -17.370 -4.601 1122 HB THR 90 HB THR 90 -20.451 -16.127 -5.401 1123 HG1 THR 90 1HG THR 90 -20.793 -15.848 -3.178 1124 HG21 THR 90 3HG2 THR 90 -22.166 -15.416 -6.972 1125 HG22 THR 90 1HG2 THR 90 -21.785 -14.089 -5.877 1126 HG23 THR 90 2HG2 THR 90 -23.270 -15.031 -5.629 1127 H GLY 91 HN GLY 91 -20.584 -19.532 -5.321 1128 HA2 GLY 91 2HA GLY 91 -20.138 -20.873 -7.158 1129 HA3 GLY 91 3HA GLY 91 -21.710 -20.400 -7.830 1130 H GLU 92 HN GLU 92 -19.519 -17.817 -7.001 1131 HA GLU 92 HA GLU 92 -19.486 -16.950 -9.789 1132 HB2 GLU 92 2HB GLU 92 -19.841 -15.347 -7.983 1133 HB3 GLU 92 3HB GLU 92 -18.314 -15.764 -7.236 1134 HG2 GLU 92 2HG GLU 92 -18.237 -13.606 -8.427 1135 HG3 GLU 92 3HG GLU 92 -17.073 -14.737 -9.085 1136 H LYS 93 HN LYS 93 -18.227 -18.443 -10.918 1137 HA LYS 93 HA LYS 93 -15.331 -18.520 -10.177 1138 HB2 LYS 93 2HB LYS 93 -17.066 -20.545 -11.656 1139 HB3 LYS 93 3HB LYS 93 -15.310 -20.671 -11.450 1140 HG2 LYS 93 2HG LYS 93 -15.525 -20.772 -9.039 1141 HG3 LYS 93 3HG LYS 93 -17.284 -20.568 -9.137 1142 HD2 LYS 93 2HD LYS 93 -17.480 -22.712 -10.332 1143 HD3 LYS 93 3HD LYS 93 -15.712 -22.890 -10.325 1144 HE2 LYS 93 2HE LYS 93 -15.732 -22.840 -7.831 1145 HE3 LYS 93 3HE LYS 93 -17.502 -22.761 -7.865 1146 HZ1 LYS 93 3HZ LYS 93 -15.867 -24.942 -8.992 1147 HZ2 LYS 93 1HZ LYS 93 -17.512 -24.881 -8.991 1148 HZ3 LYS 93 2HZ LYS 93 -16.692 -25.010 -7.569 1149 HA PRO 94 HA PRO 94 -15.703 -16.283 -14.197 1150 HB2 PRO 94 2HB PRO 94 -14.129 -14.118 -13.661 1151 HB3 PRO 94 3HB PRO 94 -15.782 -14.281 -12.994 1152 HG2 PRO 94 2HG PRO 94 -13.155 -14.962 -11.625 1153 HG3 PRO 94 3HG PRO 94 -14.502 -13.961 -10.995 1154 HD2 PRO 94 2HD PRO 94 -14.239 -16.603 -10.387 1155 HD3 PRO 94 3HD PRO 94 -15.842 -15.837 -10.602 1156 H PHE 95 HN PHE 95 -12.907 -17.512 -12.423 1157 HA PHE 95 HA PHE 95 -10.971 -16.937 -14.572 1158 HD1 PHE 95 2HD PHE 95 -8.621 -15.983 -13.438 1159 HD2 PHE 95 1HD PHE 95 -11.381 -17.243 -10.394 1160 HE1 PHE 95 2HE PHE 95 -8.072 -13.952 -12.110 1161 HE2 PHE 95 1HE PHE 95 -10.828 -15.208 -9.054 1162 HZ PHE 95 HZ PHE 95 -9.176 -13.571 -9.916 1163 HB2 PHE 95 2HB PHE 95 -10.763 -18.749 -12.123 1164 HB3 PHE 95 3HB PHE 95 -9.459 -18.353 -13.218 1165 H SER 96 HN SER 96 -12.286 -17.903 -16.316 1166 HA SER 96 HA SER 96 -12.585 -20.815 -16.388 1167 HG SER 96 HG SER 96 -12.436 -20.764 -19.430 1168 HB2 SER 96 2HB SER 96 -14.160 -19.370 -17.603 1169 HB3 SER 96 3HB SER 96 -12.833 -18.659 -18.534 1170 H CYS 97 HN CYS 97 -11.406 -22.286 -17.524 1171 HA CYS 97 HA CYS 97 -8.658 -21.706 -18.153 1172 HB2 CYS 97 2HB CYS 97 -9.393 -23.924 -17.385 1173 HB3 CYS 97 3HB CYS 97 -10.440 -24.092 -18.790 1174 H ARG 98 HN ARG 98 -7.694 -22.126 -20.293 1175 HA ARG 98 HA ARG 98 -9.418 -21.058 -22.492 1176 HE ARG 98 HE ARG 98 -10.247 -19.387 -21.084 1177 HB2 ARG 98 2HB ARG 98 -6.445 -20.627 -22.033 1178 HB3 ARG 98 3HB ARG 98 -7.361 -19.996 -23.395 1179 HG2 ARG 98 2HG ARG 98 -7.877 -19.198 -20.487 1180 HG3 ARG 98 3HG ARG 98 -6.805 -18.347 -21.585 1181 HD2 ARG 98 2HD ARG 98 -8.888 -17.165 -21.518 1182 HD3 ARG 98 3HD ARG 98 -8.689 -17.889 -23.121 1183 HH11 ARG 98 2HH1 ARG 98 -10.535 -17.493 -24.060 1184 HH12 ARG 98 1HH1 ARG 98 -11.969 -18.395 -24.523 1185 HH21 ARG 98 1HH2 ARG 98 -11.860 -20.473 -21.779 1186 HH22 ARG 98 2HH2 ARG 98 -12.732 -20.112 -23.244 1187 H TRP 99 HN TRP 99 -7.859 -23.792 -21.371 1188 HA TRP 99 HA TRP 99 -6.715 -24.779 -23.861 1189 HD1 TRP 99 1HD TRP 99 -5.857 -24.034 -20.353 1190 HE1 TRP 99 1HE TRP 99 -3.395 -24.236 -19.744 1191 HE3 TRP 99 3HE TRP 99 -4.706 -28.168 -23.130 1192 HZ2 TRP 99 2HZ TRP 99 -1.179 -25.969 -20.383 1193 HZ3 TRP 99 3HZ TRP 99 -2.384 -29.053 -23.139 1194 HH2 TRP 99 2HH TRP 99 -0.620 -27.969 -21.779 1195 HB2 TRP 99 2HB TRP 99 -7.609 -26.193 -21.309 1196 HB3 TRP 99 3HB TRP 99 -6.871 -26.993 -22.666 1197 HA PRO 100 HA PRO 100 -10.642 -25.282 -25.782 1198 HB2 PRO 100 2HB PRO 100 -9.907 -26.789 -27.991 1199 HB3 PRO 100 3HB PRO 100 -9.510 -25.062 -27.777 1200 HG2 PRO 100 2HG PRO 100 -7.755 -27.458 -27.164 1201 HG3 PRO 100 3HG PRO 100 -7.333 -25.983 -28.098 1202 HD2 PRO 100 2HD PRO 100 -6.667 -26.232 -25.489 1203 HD3 PRO 100 3HD PRO 100 -7.248 -24.658 -26.127 1204 H SER 101 HN SER 101 -8.849 -27.997 -24.569 1205 HA SER 101 HA SER 101 -11.121 -29.871 -25.034 1206 HG SER 101 HG SER 101 -8.285 -30.553 -22.880 1207 HB2 SER 101 2HB SER 101 -9.533 -31.627 -24.367 1208 HB3 SER 101 3HB SER 101 -8.840 -30.627 -25.654 1209 H CYS 102 HN CYS 102 -10.843 -27.534 -22.957 1210 HA CYS 102 HA CYS 102 -11.603 -29.158 -20.574 1211 HB2 CYS 102 2HB CYS 102 -9.251 -28.574 -20.304 1212 HB3 CYS 102 3HB CYS 102 -9.577 -26.875 -20.655 1213 H GLN 103 HN GLN 103 -10.991 -25.654 -20.713 1214 HA GLN 103 HA GLN 103 -12.347 -23.823 -20.360 1215 HB2 GLN 103 2HB GLN 103 -14.707 -25.496 -21.371 1216 HB3 GLN 103 3HB GLN 103 -14.592 -23.757 -21.277 1217 HG2 GLN 103 2HG GLN 103 -12.875 -25.472 -23.128 1218 HG3 GLN 103 3HG GLN 103 -14.365 -24.657 -23.572 1219 HE21 GLN 103 1HE2 GLN 103 -10.901 -24.206 -23.091 1220 HE22 GLN 103 2HE2 GLN 103 -10.993 -22.471 -23.472 1221 H LYS 104 HN LYS 104 -11.802 -25.608 -18.163 1222 HA LYS 104 HA LYS 104 -14.256 -25.788 -16.514 1223 HB2 LYS 104 2HB LYS 104 -11.363 -26.535 -16.191 1224 HB3 LYS 104 3HB LYS 104 -12.105 -25.878 -14.774 1225 HG2 LYS 104 2HG LYS 104 -12.526 -28.035 -14.385 1226 HG3 LYS 104 3HG LYS 104 -14.043 -27.568 -15.131 1227 HD2 LYS 104 2HD LYS 104 -11.727 -29.038 -16.474 1228 HD3 LYS 104 3HD LYS 104 -13.216 -29.777 -15.875 1229 HE2 LYS 104 2HE LYS 104 -14.537 -28.437 -17.516 1230 HE3 LYS 104 3HE LYS 104 -13.023 -27.732 -18.111 1231 HZ1 LYS 104 3HZ LYS 104 -13.695 -30.590 -18.219 1232 HZ2 LYS 104 1HZ LYS 104 -12.274 -29.887 -18.708 1233 HZ3 LYS 104 2HZ LYS 104 -13.669 -29.510 -19.483 1234 H LYS 105 HN LYS 105 -14.429 -24.556 -14.456 1235 HA LYS 105 HA LYS 105 -13.323 -21.783 -14.776 1236 HB2 LYS 105 2HB LYS 105 -16.136 -22.762 -14.199 1237 HB3 LYS 105 3HB LYS 105 -15.602 -21.236 -13.548 1238 HG2 LYS 105 2HG LYS 105 -16.852 -20.859 -15.536 1239 HG3 LYS 105 3HG LYS 105 -15.193 -20.301 -15.734 1240 HD2 LYS 105 2HD LYS 105 -14.653 -22.118 -17.184 1241 HD3 LYS 105 3HD LYS 105 -16.130 -23.012 -16.774 1242 HE2 LYS 105 2HE LYS 105 -17.501 -21.474 -17.974 1243 HE3 LYS 105 3HE LYS 105 -16.195 -20.276 -18.089 1244 HZ1 LYS 105 3HZ LYS 105 -16.018 -22.936 -19.329 1245 HZ2 LYS 105 1HZ LYS 105 -15.011 -21.656 -19.530 1246 HZ3 LYS 105 2HZ LYS 105 -16.545 -21.584 -20.140 1247 H PHE 106 HN PHE 106 -12.543 -20.766 -12.987 1248 HA PHE 106 HA PHE 106 -12.902 -22.134 -10.328 1249 HD1 PHE 106 1HD PHE 106 -11.001 -24.018 -9.569 1250 HD2 PHE 106 2HD PHE 106 -10.052 -22.181 -13.349 1251 HE1 PHE 106 1HE PHE 106 -10.758 -26.259 -10.610 1252 HE2 PHE 106 2HE PHE 106 -9.836 -24.420 -14.391 1253 HZ PHE 106 HZ PHE 106 -10.222 -26.460 -13.019 1254 HB2 PHE 106 2HB PHE 106 -10.353 -20.814 -11.381 1255 HB3 PHE 106 3HB PHE 106 -10.575 -21.534 -9.785 1256 H ALA 107 HN ALA 107 -12.559 -20.687 -8.440 1257 HA ALA 107 HA ALA 107 -13.628 -17.976 -9.062 1258 HB1 ALA 107 1HB ALA 107 -14.263 -17.960 -6.644 1259 HB2 ALA 107 2HB ALA 107 -14.984 -19.318 -7.497 1260 HB3 ALA 107 3HB ALA 107 -13.565 -19.582 -6.457 1261 H ARG 108 HN ARG 108 -10.668 -19.403 -8.626 1262 HA ARG 108 HA ARG 108 -9.534 -16.869 -7.553 1263 HE ARG 108 HE ARG 108 -7.307 -19.573 -4.744 1264 HB2 ARG 108 2HB ARG 108 -8.671 -19.665 -6.743 1265 HB3 ARG 108 3HB ARG 108 -7.885 -18.136 -6.309 1266 HG2 ARG 108 2HG ARG 108 -9.465 -17.514 -4.785 1267 HG3 ARG 108 3HG ARG 108 -10.744 -18.512 -5.488 1268 HD2 ARG 108 2HD ARG 108 -9.912 -19.374 -3.331 1269 HD3 ARG 108 3HD ARG 108 -9.836 -20.527 -4.659 1270 HH11 ARG 108 1HH1 ARG 108 -9.198 -20.555 -1.983 1271 HH12 ARG 108 2HH1 ARG 108 -7.826 -21.269 -1.165 1272 HH21 ARG 108 2HH2 ARG 108 -5.580 -20.551 -3.724 1273 HH22 ARG 108 1HH2 ARG 108 -5.837 -21.300 -2.147 1274 H SER 109 HN SER 109 -7.740 -16.160 -8.572 1275 HA SER 109 HA SER 109 -7.111 -17.087 -11.152 1276 HG SER 109 HG SER 109 -5.192 -15.765 -12.007 1277 HB2 SER 109 2HB SER 109 -6.618 -14.801 -10.413 1278 HB3 SER 109 3HB SER 109 -5.483 -15.400 -9.202 1279 H ASP 110 HN ASP 110 -5.575 -17.831 -7.988 1280 HA ASP 110 HA ASP 110 -3.288 -19.205 -9.150 1281 HB2 ASP 110 2HB ASP 110 -2.748 -19.836 -6.930 1282 HB3 ASP 110 3HB ASP 110 -3.260 -18.159 -6.896 1283 H GLU 111 HN GLU 111 -6.583 -20.134 -8.071 1284 HA GLU 111 HA GLU 111 -6.214 -22.992 -8.136 1285 HB2 GLU 111 2HB GLU 111 -8.620 -21.156 -8.386 1286 HB3 GLU 111 3HB GLU 111 -8.757 -22.843 -8.831 1287 HG2 GLU 111 2HG GLU 111 -7.932 -23.535 -6.616 1288 HG3 GLU 111 3HG GLU 111 -7.945 -21.847 -6.095 1289 H LEU 112 HN LEU 112 -7.168 -20.564 -10.627 1290 HA LEU 112 HA LEU 112 -7.400 -22.459 -12.779 1291 HG LEU 112 HG LEU 112 -6.073 -20.597 -14.961 1292 HB2 LEU 112 2HB LEU 112 -8.301 -20.200 -12.917 1293 HB3 LEU 112 3HB LEU 112 -6.686 -19.492 -12.819 1294 HD11 LEU 112 1HD1 LEU 112 -7.717 -21.611 -16.374 1295 HD12 LEU 112 2HD1 LEU 112 -9.021 -21.351 -15.207 1296 HD13 LEU 112 3HD1 LEU 112 -7.711 -22.516 -14.881 1297 HD21 LEU 112 3HD2 LEU 112 -6.978 -18.285 -14.928 1298 HD22 LEU 112 1HD2 LEU 112 -8.604 -18.947 -15.240 1299 HD23 LEU 112 2HD2 LEU 112 -7.316 -19.160 -16.431 1300 H VAL 113 HN VAL 113 -4.600 -20.472 -11.594 1301 HA VAL 113 HA VAL 113 -2.687 -21.277 -13.526 1302 HB VAL 113 HB VAL 113 -2.315 -20.657 -10.559 1303 HG11 VAL 113 1HG1 VAL 113 -0.327 -21.859 -11.260 1304 HG12 VAL 113 2HG1 VAL 113 -0.204 -20.869 -12.732 1305 HG13 VAL 113 3HG1 VAL 113 0.054 -20.146 -11.131 1306 HG21 VAL 113 3HG2 VAL 113 -1.740 -18.440 -11.153 1307 HG22 VAL 113 1HG2 VAL 113 -1.607 -18.846 -12.875 1308 HG23 VAL 113 2HG2 VAL 113 -3.184 -18.775 -12.125 1309 H ARG 114 HN ARG 114 -3.446 -22.803 -10.352 1310 HA ARG 114 HA ARG 114 -1.685 -25.036 -10.641 1311 HE ARG 114 HE ARG 114 -1.949 -25.832 -6.623 1312 HB2 ARG 114 2HB ARG 114 -2.772 -24.431 -8.502 1313 HB3 ARG 114 3HB ARG 114 -4.357 -24.869 -9.159 1314 HG2 ARG 114 2HG ARG 114 -3.536 -27.218 -9.513 1315 HG3 ARG 114 3HG ARG 114 -1.977 -26.776 -8.826 1316 HD2 ARG 114 2HD ARG 114 -4.619 -26.505 -7.330 1317 HD3 ARG 114 3HD ARG 114 -3.648 -27.990 -7.333 1318 HH11 ARG 114 1HH2 ARG 114 -4.656 -27.626 -5.205 1319 HH12 ARG 114 2HH2 ARG 114 -4.076 -27.374 -3.585 1320 HH21 ARG 114 1HH1 ARG 114 -1.276 -25.539 -4.508 1321 HH22 ARG 114 2HH1 ARG 114 -2.338 -26.123 -3.227 1322 H HIS 115 HN HIS 115 -5.204 -24.758 -11.401 1323 HA HIS 115 HA HIS 115 -5.619 -27.282 -12.426 1324 HD1 HIS 115 1HD HIS 115 -8.306 -28.048 -13.904 1325 HD2 HIS 115 2HD HIS 115 -6.910 -24.497 -15.703 1326 HE1 HIS 115 1HE HIS 115 -8.940 -28.148 -16.395 1327 HB2 HIS 115 2HB HIS 115 -7.501 -25.911 -12.224 1328 HB3 HIS 115 3HB HIS 115 -6.772 -24.579 -13.107 1329 H HIS 116 HN HIS 116 -4.357 -24.434 -14.273 1330 HA HIS 116 HA HIS 116 -4.103 -25.740 -16.791 1331 HD1 HIS 116 1HD HIS 116 -5.639 -24.317 -17.736 1332 HD2 HIS 116 2HD HIS 116 -3.154 -21.082 -16.597 1333 HE1 HIS 116 1HE HIS 116 -6.704 -22.239 -18.607 1334 HB2 HIS 116 2HB HIS 116 -2.549 -23.472 -15.501 1335 HB3 HIS 116 3HB HIS 116 -2.219 -24.038 -17.132 1336 H ASN 117 HN ASN 117 -2.042 -25.874 -13.879 1337 HA ASN 117 HA ASN 117 0.237 -27.101 -15.247 1338 HB2 ASN 117 2HB ASN 117 -0.496 -26.650 -12.316 1339 HB3 ASN 117 3HB ASN 117 0.813 -27.717 -12.776 1340 HD21 ASN 117 1HD2 ASN 117 -0.313 -24.251 -13.228 1341 HD22 ASN 117 2HD2 ASN 117 1.379 -23.758 -13.425 1342 H MET 118 HN MET 118 -2.879 -28.226 -14.192 1343 HA MET 118 HA MET 118 -2.076 -31.056 -13.912 1344 HB2 MET 118 2HB MET 118 -4.886 -29.936 -14.288 1345 HB3 MET 118 3HB MET 118 -4.428 -31.511 -13.687 1346 HG2 MET 118 2HG MET 118 -3.451 -30.482 -11.657 1347 HG3 MET 118 3HG MET 118 -3.943 -28.891 -12.248 1348 HE1 MET 118 3HE MET 118 -6.542 -29.209 -9.411 1349 HE2 MET 118 1HE MET 118 -4.789 -29.534 -9.419 1350 HE3 MET 118 2HE MET 118 -5.448 -28.121 -10.282 1351 H HIS 119 HN HIS 119 -2.418 -28.898 -16.515 1352 HA HIS 119 HA HIS 119 -3.355 -31.013 -18.410 1353 HD1 HIS 119 1HD HIS 119 -5.678 -30.736 -19.083 1354 HD2 HIS 119 2HD HIS 119 -5.115 -26.600 -18.505 1355 HE1 HIS 119 1HE HIS 119 -8.011 -29.668 -18.911 1356 HB2 HIS 119 2HB HIS 119 -2.904 -28.013 -18.775 1357 HB3 HIS 119 3HB HIS 119 -3.291 -29.131 -20.062 Start of MODEL 8 1 H5 DC 124 5H C 124 -4.008 -31.369 -5.027 2 H6 DC 124 6H C 124 -5.915 -31.023 -6.519 3 H5' DC 124 H5' C 124 -8.902 -32.456 -9.849 4 H5'' DC 124 H5" C 124 -7.503 -32.386 -8.755 5 H4' DC 124 H4' C 124 -10.409 -32.432 -7.806 6 H3' DC 124 H3' C 124 -9.112 -30.266 -8.987 7 H2' DC 124 H2' C 124 -7.414 -29.990 -7.438 8 H2'' DC 124 H2" C 124 -8.649 -29.001 -6.613 9 H1' DC 124 H1' C 124 -9.429 -30.812 -5.270 10 H41 DC 124 1H4 C 124 -4.527 -32.268 -1.505 11 H42 DC 124 2H4 C 124 -3.372 -31.906 -2.773 12 H8 DG 125 8H G 125 -9.162 -26.974 -5.671 13 H1 DG 125 1H G 125 -6.412 -29.060 -0.241 14 H5' DG 125 H5' G 125 -12.769 -29.693 -6.316 15 H5'' DG 125 H5" G 125 -13.933 -28.447 -6.807 16 H4' DG 125 H4' G 125 -13.802 -28.571 -4.387 17 H3' DG 125 H3' G 125 -13.389 -26.133 -5.766 18 H2' DG 125 H2' G 125 -11.123 -26.016 -5.278 19 H2'' DG 125 H2" G 125 -11.677 -25.302 -3.750 20 H1' DG 125 H1' G 125 -11.540 -27.392 -2.597 21 H21 DG 125 1H2 G 125 -7.895 -29.245 1.330 22 H22 DG 125 2H2 G 125 -9.603 -28.963 1.027 23 H5 DC 126 5H C 126 -8.063 -23.933 -4.324 24 H6 DC 126 6H C 126 -10.072 -23.626 -2.959 25 H5' DC 126 H5' C 126 -13.543 -26.251 -1.105 26 H5'' DC 126 H5" C 126 -14.578 -24.948 -0.473 27 H4' DC 126 H4' C 126 -12.679 -25.211 0.968 28 H3' DC 126 H3' C 126 -13.279 -22.717 -0.159 29 H2' DC 126 H2' C 126 -11.455 -22.846 -1.668 30 H2'' DC 126 H2" C 126 -10.658 -21.983 -0.314 31 H1' DC 126 H1' C 126 -10.028 -24.113 0.749 32 H41 DC 126 1H4 C 126 -5.017 -25.415 -2.886 33 H42 DC 126 2H4 C 126 -5.812 -24.819 -4.325 34 H8 DG 127 8H G 127 -9.635 -21.749 1.639 35 H1 DG 127 1H G 127 -3.399 -22.997 0.722 36 H5' DG 127 H5' G 127 -12.131 -23.649 3.991 37 H5'' DG 127 H5" G 127 -12.591 -22.532 5.296 38 H4' DG 127 H4' G 127 -10.503 -23.749 5.892 39 H3' DG 127 H3' G 127 -10.686 -20.901 5.753 40 H2' DG 127 H2' G 127 -9.194 -20.552 4.076 41 H2'' DG 127 H2" G 127 -7.953 -20.791 5.343 42 H1' DG 127 H1' G 127 -7.620 -23.055 4.741 43 H21 DG 127 1H2 G 127 -2.405 -23.364 2.646 44 H22 DG 127 2H2 G 127 -3.265 -23.176 4.167 45 H8 DG 128 8H G 128 -7.476 -18.629 4.155 46 H1 DG 128 1H G 128 -2.670 -19.719 -0.007 47 H5' DG 128 H5' G 128 -6.802 -21.895 7.524 48 H5'' DG 128 H5" G 128 -6.606 -21.171 9.134 49 H4' DG 128 H4' G 128 -4.569 -20.700 8.025 50 H3' DG 128 H3' G 128 -6.202 -18.434 8.588 51 H2' DG 128 H2' G 128 -6.702 -18.043 6.291 52 H2'' DG 128 H2" G 128 -5.178 -17.103 6.429 53 H1' DG 128 H1' G 128 -3.872 -19.068 5.690 54 H21 DG 128 1H2 G 128 -0.813 -20.025 1.074 55 H22 DG 128 2H2 G 128 -0.775 -20.121 2.824 56 H8 DG 129 8H G 129 -3.479 -16.332 5.549 57 H1 DG 129 1H G 129 -1.000 -16.454 -0.363 58 H5' DG 129 H5' G 129 -1.611 -18.324 8.600 59 H5'' DG 129 H5" G 129 -0.981 -17.363 9.916 60 H4' DG 129 H4' G 129 0.655 -17.219 8.195 61 H3' DG 129 H3' G 129 -0.714 -14.781 8.725 62 H2' DG 129 H2' G 129 -1.988 -14.842 6.758 63 H2'' DG 129 H2" G 129 -0.572 -13.946 6.131 64 H1' DG 129 H1' G 129 0.439 -15.973 5.295 65 H21 DG 129 1H2 G 129 1.199 -16.305 -0.278 66 H22 DG 129 2H2 G 129 2.048 -16.178 1.254 67 H8 DG 130 8H G 130 0.525 -13.450 4.224 68 H1 DG 130 1H G 130 -0.620 -12.853 -2.055 69 H5' DG 130 H5' G 130 3.011 -15.559 5.493 70 H5'' DG 130 H5" G 130 4.081 -14.672 6.593 71 H4' DG 130 H4' G 130 5.100 -14.378 4.514 72 H3' DG 130 H3' G 130 4.122 -12.092 5.809 73 H2' DG 130 H2' G 130 2.292 -11.693 4.412 74 H2'' DG 130 H2" G 130 3.489 -10.921 3.364 75 H1' DG 130 H1' G 130 3.635 -12.763 1.929 76 H21 DG 130 1H2 G 130 1.180 -12.456 -3.148 77 H22 DG 130 2H2 G 130 2.717 -12.208 -2.332 78 H8 DG 131 8H G 131 2.607 -9.362 2.388 79 H1 DG 131 1H G 131 -1.892 -9.316 -2.155 80 H5' DG 131 H5' G 131 5.898 -11.758 1.619 81 H5'' DG 131 H5" G 131 7.354 -10.764 1.814 82 H4' DG 131 H4' G 131 6.620 -10.306 -0.377 83 H3' DG 131 H3' G 131 6.614 -8.181 1.442 84 H2' DG 131 H2' G 131 4.294 -8.077 1.710 85 H2'' DG 131 H2" G 131 4.411 -7.018 0.291 86 H1' DG 131 H1' G 131 3.905 -8.817 -1.236 87 H21 DG 131 1H2 G 131 -1.026 -8.971 -4.098 88 H22 DG 131 2H2 G 131 0.705 -8.742 -4.308 89 H5 DC 132 5H C 132 1.294 -6.420 1.607 90 H6 DC 132 6H C 132 2.803 -5.750 -0.196 91 H5' DC 132 H5' C 132 5.255 -7.665 -2.907 92 H5'' DC 132 H5" C 132 6.321 -6.410 -3.582 93 H4' DC 132 H4' C 132 4.247 -6.092 -4.668 94 H3' DC 132 H3' C 132 5.225 -4.055 -2.918 95 H2' DC 132 H2' C 132 3.458 -4.081 -1.443 96 H2'' DC 132 H2" C 132 2.646 -3.125 -2.700 97 H1' DC 132 H1' C 132 1.589 -5.052 -3.661 98 H41 DC 132 1H4 C 132 -2.329 -6.608 1.089 99 H42 DC 132 2H4 C 132 -0.999 -6.801 2.210 100 H8 DG 133 8H G 133 1.228 -1.786 -3.022 101 H1 DG 133 1H G 133 -4.926 -2.704 -1.460 102 H5' DG 133 H5' G 133 2.581 -3.382 -6.465 103 H5'' DG 133 H5" G 133 3.257 -2.118 -7.513 104 H4' DG 133 H4' G 133 0.957 -2.109 -7.898 105 H3' DG 133 H3' G 133 2.116 0.212 -6.802 106 H2' DG 133 H2' G 133 1.193 -0.163 -4.708 107 H2'' DG 133 H2" G 133 -0.149 0.747 -5.376 108 H1' DG 133 H1' G 133 -1.378 -1.289 -5.906 109 H21 DG 133 1H2 G 133 -6.183 -2.416 -3.187 110 H22 DG 133 2H2 G 133 -5.544 -1.903 -4.731 111 H5' DT 134 H5' T 134 -2.359 -0.035 -7.290 112 H5'' DT 134 H5" T 134 -2.785 1.183 -8.489 113 H4' DT 134 H4' T 134 -4.664 1.128 -7.182 114 H3' DT 134 H3' T 134 -2.945 3.412 -7.244 115 H2' DT 134 H2' T 134 -2.251 3.241 -5.033 116 H2'' DT 134 H2" T 134 -3.733 4.132 -4.760 117 H1' DT 134 H1' T 134 -5.029 2.101 -4.307 118 H3 DT 134 3H T 134 -4.200 0.394 -0.243 119 H71 DT 134 1H7 T 134 0.413 0.263 -1.198 120 H72 DT 134 2H7 T 134 0.596 1.286 -2.649 121 H73 DT 134 3H7 T 134 0.458 2.026 -1.043 122 H6 DT 134 6H T 134 -1.351 1.908 -3.831 123 H5 DC 135 5H C 135 -3.658 4.833 -2.730 124 H6 DC 135 6H C 135 -5.498 5.208 -4.286 125 H5' DC 135 H5' C 135 -7.296 3.503 -7.252 126 H5'' DC 135 H5" C 135 -8.132 4.737 -8.209 127 H4' DC 135 H4' C 135 -9.556 4.269 -6.363 128 H3' DC 135 H3' C 135 -8.578 6.926 -6.493 129 H2' DC 135 H2' C 135 -6.979 6.543 -4.823 130 H2'' DC 135 H2" C 135 -8.245 7.147 -3.790 131 H1' DC 135 H1' C 135 -9.060 4.863 -3.301 132 H41 DC 135 1H4 C 135 -4.202 3.374 0.545 133 H42 DC 135 2H4 C 135 -3.066 4.021 -0.600 134 H5' DT 136 H5' T 136 -10.776 5.292 -2.551 135 H5'' DT 136 H5" T 136 -12.241 6.120 -3.046 136 H4' DT 136 H4' T 136 -12.501 5.974 -0.752 137 H3' DT 136 H3' T 136 -12.259 8.500 -1.877 138 H2' DT 136 H2' T 136 -10.150 9.022 -1.359 139 H2'' DT 136 H2" T 136 -10.711 9.526 0.175 140 H1' DT 136 H1' T 136 -10.243 7.545 1.305 141 H3 DT 136 3H T 136 -5.851 6.516 1.772 142 H71 DT 136 1H7 T 136 -5.322 7.653 -2.890 143 H72 DT 136 2H7 T 136 -6.598 8.885 -3.047 144 H73 DT 136 3H7 T 136 -5.148 9.222 -2.071 145 H6 DT 136 6H T 136 -8.481 8.237 -1.860 146 H8 DG 137 8H G 137 -9.629 10.269 1.694 147 H1 DG 137 1H G 137 -3.725 9.373 4.031 148 H5' DG 137 H5' G 137 -12.030 7.550 2.373 149 H5'' DG 137 H5" G 137 -13.529 8.246 2.971 150 H4' DG 137 H4' G 137 -12.338 7.936 4.908 151 H3' DG 137 H3' G 137 -12.953 10.544 4.207 152 H2' DG 137 H2' G 137 -10.870 11.125 3.348 153 H2'' DG 137 H2" G 137 -10.577 11.631 5.000 154 H1' DG 137 H1' G 137 -9.380 9.634 5.535 155 H21 DG 137 1H2 G 137 -3.797 8.794 6.112 156 H22 DG 137 2H2 G 137 -5.307 8.780 7.012 157 H5 DC 138 5H C 138 -8.525 13.108 4.066 158 H6 DC 138 6H C 138 -9.122 12.348 6.319 159 H5' DC 138 H5' C 138 -10.371 9.242 7.736 160 H5'' DC 138 H5" C 138 -11.269 9.899 9.104 161 H4' DC 138 H4' C 138 -9.065 9.534 9.862 162 H3' DC 138 H3' C 138 -10.354 12.036 9.955 163 H2' DC 138 H2' C 138 -9.149 13.039 8.298 164 H2'' DC 138 H2" C 138 -7.979 13.367 9.538 165 H1' DC 138 H1' C 138 -6.562 11.577 8.934 166 H41 DC 138 1H4 C 138 -5.035 13.241 3.010 167 H42 DC 138 2H4 C 138 -6.713 13.386 2.550 168 H8 DG 139 8H G 139 -6.368 14.627 9.711 169 H1 DG 139 1H G 139 -2.119 15.927 5.066 170 H5' DG 139 H5' G 139 -6.157 11.045 11.076 171 H5'' DG 139 H5" G 139 -6.193 11.250 12.833 172 H4' DG 139 H4' G 139 -3.923 11.391 12.284 173 H3' DG 139 H3' G 139 -5.132 13.609 13.461 174 H2' DG 139 H2' G 139 -5.262 14.923 11.623 175 H2'' DG 139 H2" G 139 -3.636 15.419 12.067 176 H1' DG 139 H1' G 139 -2.616 13.979 10.516 177 H21 DG 139 1H2 G 139 -0.115 15.325 5.679 178 H22 DG 139 2H2 G 139 0.201 14.674 7.281 179 H5 DC 140 5H C 140 -4.144 17.661 10.566 180 H6 DC 140 6H C 140 -2.111 16.870 11.675 181 H5' DC 140 H5' C 140 -0.737 13.407 12.055 182 H5'' DC 140 H5" C 140 0.165 13.660 13.556 183 H4' DC 140 H4' C 140 1.607 14.199 11.739 184 H3' DC 140 H3' C 140 1.220 16.030 13.779 185 H2' DC 140 H2' C 140 -0.279 17.437 12.641 186 H2'' DC 140 H2" C 140 1.237 18.195 12.088 187 H1' DC 140 H1' C 140 1.267 17.011 10.048 188 H41 DC 140 1H4 C 140 -4.035 18.926 7.133 189 H42 DC 140 2H4 C 140 -5.024 18.511 8.516 190 H8 DG 141 8H G 141 -3.489 21.461 0.818 191 H1 DG 141 1H G 141 -1.631 18.719 6.323 192 H5' DG 141 H5' G 141 -0.821 24.570 -0.536 193 H5'' DG 141 H5" G 141 -1.076 23.946 -2.169 194 H4' DG 141 H4' G 141 0.827 22.924 -0.978 195 H3' DG 141 H3' G 141 -0.909 21.471 -2.572 196 H2' DG 141 H2' G 141 -2.208 20.665 -0.834 197 H2'' DG 141 H2" G 141 -1.038 19.341 -0.850 198 H1' DG 141 H1' G 141 0.229 20.275 0.947 199 H21 DG 141 1H2 G 141 0.502 18.366 6.336 200 H22 DG 141 2H2 G 141 1.503 18.692 4.928 201 H5 DC 142 5H C 142 -2.647 17.538 0.389 202 H6 DC 142 6H C 142 -0.269 17.220 -0.044 203 H5' DC 142 H5' C 142 2.170 19.707 0.397 204 H5'' DC 142 H5" C 142 3.335 19.242 -0.839 205 H4' DC 142 H4' C 142 3.988 18.033 1.023 206 H3' DC 142 H3' C 142 3.252 16.616 -1.245 207 H2' DC 142 H2' C 142 1.182 15.955 -0.563 208 H2'' DC 142 H2" C 142 1.978 14.613 0.165 209 H1' DC 142 H1' C 142 2.007 15.522 2.350 210 H41 DC 142 1H4 C 142 -4.074 16.701 3.654 211 H42 DC 142 2H4 C 142 -4.364 17.302 2.039 212 H8 DG 143 8H G 143 1.485 12.967 1.264 213 H1 DG 143 1H G 143 -3.692 12.369 4.961 214 H5' DG 143 H5' G 143 4.341 15.362 3.319 215 H5'' DG 143 H5" G 143 5.786 14.426 2.851 216 H4' DG 143 H4' G 143 4.972 13.441 4.884 217 H3' DG 143 H3' G 143 5.274 11.899 2.530 218 H2' DG 143 H2' G 143 3.056 11.747 1.969 219 H2'' DG 143 H2" G 143 3.026 10.397 3.076 220 H1' DG 143 H1' G 143 2.107 11.642 4.838 221 H21 DG 143 1H2 G 143 -3.161 11.547 6.908 222 H22 DG 143 2H2 G 143 -1.497 11.134 7.303 223 H5 DC 144 5H C 144 0.783 9.394 1.911 224 H6 DC 144 6H C 144 1.812 8.718 4.011 225 H5' DC 144 H5' C 144 3.149 10.912 6.283 226 H5'' DC 144 H5" C 144 4.406 9.961 7.030 227 H4' DC 144 H4' C 144 2.600 9.486 8.342 228 H3' DC 144 H3' C 144 3.730 7.408 6.932 229 H2' DC 144 H2' C 144 2.170 7.144 5.293 230 H2'' DC 144 H2" C 144 1.302 6.180 6.450 231 H1' DC 144 H1' C 144 -0.191 7.817 7.032 232 H41 DC 144 1H4 C 144 -2.831 9.846 1.664 233 H42 DC 144 2H4 C 144 -1.270 10.024 0.890 234 H8 DA 145 8H A 145 -0.235 4.909 5.930 235 H2 DA 145 2H A 145 -6.320 6.183 4.396 236 H5' DA 145 H5' A 145 -0.003 7.304 9.615 237 H5'' DA 145 H5" A 145 0.192 5.997 10.809 238 H4' DA 145 H4' A 145 -2.170 6.318 10.359 239 H3' DA 145 H3' A 145 -0.958 3.806 10.168 240 H2' DA 145 H2' A 145 -0.842 3.847 7.802 241 H2'' DA 145 H2" A 145 -2.410 3.046 7.986 242 H1' DA 145 H1' A 145 -3.620 5.130 7.842 243 H61 DA 145 2H6 A 145 -1.915 6.142 1.623 244 H62 DA 145 1H6 A 145 -3.501 6.529 0.989 245 H8 DG 146 8H G 146 -3.904 1.597 7.248 246 H1 DG 146 1H G 146 -5.728 3.303 1.361 247 H5' DG 146 H5' G 146 -5.292 4.609 9.939 248 H5'' DG 146 H5" G 146 -6.491 4.366 11.180 249 H4' DG 146 H4' G 146 -7.843 3.829 9.520 250 H3' DG 146 H3' G 146 -6.762 1.326 10.377 251 H2' DG 146 H2' G 146 -5.624 0.921 8.422 252 H2'' DG 146 H2" G 146 -7.204 0.394 7.827 253 H1' DG 146 H1' G 146 -7.676 2.488 6.815 254 H21 DG 146 1H2 G 146 -7.796 3.759 1.292 255 H22 DG 146 2H2 G 146 -8.777 3.843 2.732 256 H8 DA 147 8H A 147 -6.895 -1.224 6.464 257 H2 DA 147 2H A 147 -6.500 0.171 0.207 258 H5' DA 147 H5' A 147 -10.100 1.853 7.483 259 H5'' DA 147 H5" A 147 -11.478 0.796 7.815 260 H4' DA 147 H4' A 147 -11.282 1.134 5.429 261 H3' DA 147 H3' A 147 -11.307 -1.419 6.655 262 H2' DA 147 H2' A 147 -9.102 -1.958 6.107 263 H2'' DA 147 H2" A 147 -9.834 -2.454 4.552 264 H1' DA 147 H1' A 147 -9.392 -0.343 3.555 265 H61 DA 147 2H6 A 147 -2.806 -0.430 3.836 266 H62 DA 147 1H6 A 147 -2.520 -0.210 2.119 267 H5 DC 148 5H C 148 -7.080 -3.500 3.270 268 H6 DC 148 6H C 148 -9.379 -3.392 2.448 269 H5' DC 148 H5' C 148 -12.268 -0.719 1.983 270 H5'' DC 148 H5" C 148 -13.751 -1.671 1.802 271 H4' DC 148 H4' C 148 -12.744 -1.607 -0.360 272 H3' DC 148 H3' C 148 -13.175 -4.105 0.900 273 H2' DC 148 H2' C 148 -10.926 -4.443 1.491 274 H2'' DC 148 H2" C 148 -10.854 -5.228 -0.092 275 H1' DC 148 H1' C 148 -10.170 -3.224 -1.194 276 H41 DC 148 1H4 C 148 -4.239 -3.064 0.985 277 H42 DC 148 2H4 C 148 -4.757 -3.408 2.632 278 H8 DG 149 8H G 149 -9.154 -7.112 -1.025 279 H1 DG 149 1H G 149 -2.866 -5.852 -1.066 280 H5' DG 149 H5' G 149 -10.840 -3.511 -3.179 281 H5'' DG 149 H5" G 149 -12.046 -4.289 -4.203 282 H4' DG 149 H4' G 149 -10.047 -4.490 -5.380 283 H3' DG 149 H3' G 149 -11.444 -6.755 -4.529 284 H2' DG 149 H2' G 149 -10.000 -7.422 -2.943 285 H2'' DG 149 H2" G 149 -9.192 -8.280 -4.232 286 H1' DG 149 H1' G 149 -7.550 -6.476 -4.501 287 H21 DG 149 1H2 G 149 -2.188 -5.545 -3.094 288 H22 DG 149 2H2 G 149 -3.318 -5.376 -4.423 289 H5 DC 150 5H C 150 -6.964 -9.414 -1.617 290 H6 DC 150 6H C 150 -7.113 -9.800 -4.019 291 H5' DC 150 H5' C 150 -8.160 -9.159 -5.726 292 H5'' DC 150 H5" C 150 -7.961 -7.446 -6.209 293 H4' DC 150 H4' C 150 -6.646 -8.196 -8.158 294 H3' DC 150 H3' C 150 -7.706 -10.715 -7.649 295 H2' DC 150 H2' C 150 -6.686 -11.147 -5.652 296 H2'' DC 150 H2" C 150 -5.355 -11.627 -6.678 297 H1' DC 150 H1' C 150 -4.104 -9.682 -6.271 298 H41 DC 150 1H4 C 150 -3.710 -9.369 0.036 299 H42 DC 150 2H4 C 150 -5.450 -9.294 0.231 300 H5 DC 151 5H C 151 -5.164 -12.881 -4.426 301 H6 DC 151 6H C 151 -3.915 -12.895 -6.534 302 H5' DC 151 H5' C 151 -3.455 -10.195 -9.141 303 H5'' DC 151 H5" C 151 -3.157 -11.170 -10.596 304 H4' DC 151 H4' C 151 -1.087 -10.947 -9.421 305 H3' DC 151 H3' C 151 -2.174 -13.494 -9.961 306 H2' DC 151 H2' C 151 -2.615 -14.012 -7.772 307 H2'' DC 151 H2" C 151 -0.947 -14.502 -7.696 308 H1' DC 151 H1' C 151 -0.234 -12.432 -6.691 309 H41 DC 151 1H4 C 151 -3.374 -12.911 -1.216 310 H42 DC 151 2H4 C 151 -4.935 -12.746 -2.012 311 H5 DC 152 5H C 152 -3.086 -15.907 -5.001 312 H6 DC 152 6H C 152 -0.888 -15.998 -6.085 313 H5' DC 152 H5' C 152 1.469 -13.276 -7.441 314 H5'' DC 152 H5" C 152 2.836 -13.815 -8.414 315 H4' DC 152 H4' C 152 3.556 -14.544 -6.342 316 H3' DC 152 H3' C 152 2.600 -16.671 -7.974 317 H2' DC 152 H2' C 152 0.718 -17.155 -6.725 318 H2'' DC 152 H2" C 152 1.850 -18.137 -5.768 319 H1' DC 152 H1' C 152 2.287 -16.351 -4.185 320 H41 DC 152 1H4 C 152 -3.423 -16.168 -1.343 321 H42 DC 152 2H4 C 152 -4.242 -15.997 -2.884 322 H5 DC 153 5H C 153 -1.439 -19.658 -4.635 323 H6 DC 153 6H C 153 0.992 -19.903 -4.451 324 H5' DC 153 H5' C 153 4.287 -17.589 -4.014 325 H5'' DC 153 H5" C 153 5.766 -18.495 -4.332 326 H4' DC 153 H4' C 153 5.183 -19.171 -2.178 327 H3' DC 153 H3' C 153 4.960 -21.116 -4.292 328 H2' DC 153 H2' C 153 2.649 -21.143 -4.222 329 H2'' DC 153 H2" C 153 2.899 -22.334 -2.947 330 H1' DC 153 H1' C 153 2.700 -20.620 -1.173 331 H41 DC 153 1H4 C 153 -3.528 -19.222 -1.661 332 H42 DC 153 2H4 C 153 -3.515 -19.571 -3.379 333 H5 DC 154 5H C 154 -0.165 -22.769 -3.091 334 H6 DC 154 6H C 154 1.710 -23.380 -1.625 335 H5' DC 154 H5' C 154 4.587 -21.738 0.118 336 H5'' DC 154 H5" C 154 5.747 -23.016 0.516 337 H4' DC 154 H4' C 154 4.068 -22.989 2.252 338 H3' DC 154 H3' C 154 4.586 -25.293 0.668 339 H2' DC 154 H2' C 154 2.560 -25.311 -0.453 340 H2'' DC 154 H2" C 154 1.993 -26.138 1.034 341 H1' DC 154 H1' C 154 1.231 -24.105 2.015 342 H41 DC 154 1H4 C 154 -3.613 -22.739 -1.794 343 H42 DC 154 2H4 C 154 -2.568 -22.486 -3.179 344 H8 DG 155 8H G 155 0.483 -27.702 0.935 345 H1 DG 155 1H G 155 -5.517 -25.768 -0.318 346 H5' DG 155 H5' G 155 2.295 -25.583 4.642 347 H5'' DG 155 H5" G 155 2.726 -27.012 5.589 348 H4' DG 155 H4' G 155 0.387 -26.469 5.870 349 H3' DG 155 H3' G 155 1.357 -28.997 5.054 350 H2' DG 155 H2' G 155 0.478 -28.869 2.934 351 H2'' DG 155 H2" G 155 -0.993 -29.473 3.751 352 H1' DG 155 H1' G 155 -1.876 -27.243 4.033 353 H21 DG 155 1H2 G 155 -6.730 -25.839 1.479 354 H22 DG 155 2H2 G 155 -6.033 -26.198 3.051 355 H5 DC 156 5H C 156 -1.590 -30.619 1.121 356 H6 DC 156 6H C 156 -2.440 -30.960 3.391 357 H5' DC 156 H5' C 156 -2.712 -28.684 6.861 358 H5'' DC 156 H5" C 156 -3.035 -29.855 8.151 359 H4' DC 156 H4' C 156 -5.132 -29.384 7.070 360 H3' DC 156 H3' C 156 -4.022 -31.992 7.090 361 H2' DC 156 H2' C 156 -3.532 -32.044 4.824 362 H2'' DC 156 H2" C 156 -5.230 -32.545 4.738 363 H1' DC 156 H1' C 156 -6.034 -30.339 4.311 364 H41 DC 156 1H4 C 156 -3.793 -29.344 -1.524 365 H42 DC 156 2H4 C 156 -2.158 -29.754 -1.049 366 H8 DG 157 8H G 157 -6.362 -34.770 4.716 367 H1 DG 157 1H G 157 -6.848 -32.233 -1.172 368 H5' DG 157 H5' G 157 -8.736 -31.549 7.351 369 H5'' DG 157 H5" G 157 -9.566 -32.757 8.341 370 H4' DG 157 H4' G 157 -10.823 -32.323 6.258 371 H3' DG 157 H3' G 157 -10.197 -34.868 7.153 372 H2' DG 157 H2' G 157 -8.272 -35.136 5.768 373 H2'' DG 157 H2" G 157 -9.518 -35.888 4.725 374 H1' DG 157 H1' G 157 -9.954 -33.846 3.578 375 H21 DG 157 1H2 G 157 -8.964 -31.795 -1.647 376 H22 DG 157 2H2 G 157 -10.205 -31.910 -0.418 377 HA ALA 1 HA ALA 1 23.007 24.176 -18.032 378 H1 ALA 1 HN ALA 1 24.336 23.674 -20.227 379 HB1 ALA 1 1HB ALA 1 22.266 24.991 -20.253 380 HB2 ALA 1 2HB ALA 1 21.519 23.411 -20.588 381 HB3 ALA 1 3HB ALA 1 20.888 24.440 -19.283 382 H SER 2 HN SER 2 23.470 20.978 -18.944 383 HA SER 2 HA SER 2 21.925 19.958 -16.717 384 HG SER 2 HG SER 2 20.148 21.107 -17.762 385 HB2 SER 2 2HB SER 2 20.887 19.498 -19.544 386 HB3 SER 2 3HB SER 2 20.533 18.368 -18.223 387 H GLU 3 HN GLU 3 22.049 17.487 -16.656 388 HA GLU 3 HA GLU 3 24.367 16.419 -18.194 389 HB2 GLU 3 2HB GLU 3 24.083 16.350 -15.154 390 HB3 GLU 3 3HB GLU 3 25.253 15.405 -16.075 391 HG2 GLU 3 2HG GLU 3 26.278 17.500 -16.936 392 HG3 GLU 3 3HG GLU 3 25.155 18.446 -15.945 393 H LYS 4 HN LYS 4 24.555 14.013 -17.964 394 HA LYS 4 HA LYS 4 21.918 12.764 -18.180 395 HB2 LYS 4 2HB LYS 4 23.968 12.223 -19.596 396 HB3 LYS 4 3HB LYS 4 24.665 11.411 -18.197 397 HG2 LYS 4 2HG LYS 4 22.659 9.863 -18.176 398 HG3 LYS 4 3HG LYS 4 22.026 10.721 -19.591 399 HD2 LYS 4 2HD LYS 4 24.042 10.072 -20.887 400 HD3 LYS 4 3HD LYS 4 24.686 9.228 -19.461 401 HE2 LYS 4 2HE LYS 4 22.706 7.735 -19.452 402 HE3 LYS 4 3HE LYS 4 22.063 8.574 -20.875 403 HZ1 LYS 4 3HZ LYS 4 24.613 7.095 -20.769 404 HZ2 LYS 4 1HZ LYS 4 24.016 7.872 -22.091 405 HZ3 LYS 4 2HZ LYS 4 23.225 6.565 -21.479 406 H ARG 5 HN ARG 5 21.538 13.563 -15.803 407 HA ARG 5 HA ARG 5 22.320 11.340 -13.937 408 HE ARG 5 HE ARG 5 20.952 10.886 -11.311 409 HB2 ARG 5 2HB ARG 5 23.509 13.436 -13.427 410 HB3 ARG 5 3HB ARG 5 21.992 14.313 -13.325 411 HG2 ARG 5 2HG ARG 5 22.984 13.794 -11.133 412 HG3 ARG 5 3HG ARG 5 21.369 13.125 -11.280 413 HD2 ARG 5 2HD ARG 5 23.791 11.405 -11.903 414 HD3 ARG 5 3HD ARG 5 23.330 11.724 -10.223 415 HH11 ARG 5 1HH2 ARG 5 24.113 9.337 -11.119 416 HH12 ARG 5 2HH2 ARG 5 23.381 7.747 -11.009 417 HH21 ARG 5 1HH1 ARG 5 20.154 8.972 -11.185 418 HH22 ARG 5 2HH1 ARG 5 21.153 7.516 -11.036 419 HA PRO 6 HA PRO 6 17.717 11.426 -14.133 420 HB2 PRO 6 2HB PRO 6 17.338 8.694 -14.020 421 HB3 PRO 6 3HB PRO 6 17.798 9.551 -15.516 422 HG2 PRO 6 2HG PRO 6 19.591 8.084 -13.563 423 HG3 PRO 6 3HG PRO 6 19.546 7.938 -15.349 424 HD2 PRO 6 2HD PRO 6 21.345 9.515 -14.037 425 HD3 PRO 6 3HD PRO 6 20.683 9.976 -15.637 426 H PHE 7 HN PHE 7 16.119 10.080 -12.605 427 HA PHE 7 HA PHE 7 17.190 10.294 -9.804 428 HD1 PHE 7 2HD PHE 7 14.532 11.806 -12.566 429 HD2 PHE 7 1HD PHE 7 14.905 12.542 -8.326 430 HE1 PHE 7 2HE PHE 7 14.170 14.238 -12.932 431 HE2 PHE 7 1HE PHE 7 14.438 14.943 -8.707 432 HZ PHE 7 HZ PHE 7 14.161 15.801 -11.024 433 HB2 PHE 7 2HB PHE 7 14.326 9.990 -10.757 434 HB3 PHE 7 3HB PHE 7 14.837 10.304 -9.119 435 H MET 8 HN MET 8 16.935 8.445 -8.375 436 HA MET 8 HA MET 8 15.618 6.063 -9.559 437 HB2 MET 8 2HB MET 8 18.310 5.930 -8.147 438 HB3 MET 8 3HB MET 8 17.321 4.551 -8.636 439 HG2 MET 8 2HG MET 8 17.551 5.250 -11.012 440 HG3 MET 8 3HG MET 8 18.567 6.596 -10.510 441 HE1 MET 8 3HE MET 8 18.196 2.743 -10.908 442 HE2 MET 8 1HE MET 8 19.773 2.122 -10.372 443 HE3 MET 8 2HE MET 8 18.629 2.772 -9.184 444 H CYS 9 HN CYS 9 14.639 4.694 -8.068 445 HA CYS 9 HA CYS 9 13.791 5.989 -5.610 446 HB2 CYS 9 2HB CYS 9 12.350 4.427 -6.889 447 HB3 CYS 9 3HB CYS 9 13.445 3.089 -6.520 448 H ALA 10 HN ALA 10 14.014 5.065 -3.427 449 HA ALA 10 HA ALA 10 16.735 3.904 -2.964 450 HB1 ALA 10 1HB ALA 10 16.549 4.857 -0.691 451 HB2 ALA 10 2HB ALA 10 16.362 6.117 -1.928 452 HB3 ALA 10 3HB ALA 10 14.933 5.490 -1.077 453 H TYR 11 HN TYR 11 13.255 3.531 -2.410 454 HA TYR 11 HA TYR 11 13.195 1.716 -0.317 455 HD1 TYR 11 1HD TYR 11 10.527 2.971 0.507 456 HD2 TYR 11 2HD TYR 11 10.429 -0.724 -1.705 457 HE1 TYR 11 1HE TYR 11 9.042 1.992 2.233 458 HE2 TYR 11 2HE TYR 11 8.986 -1.732 0.071 459 HH TYR 11 HH TYR 11 7.652 0.229 2.670 460 HB2 TYR 11 2HB TYR 11 11.310 2.849 -1.786 461 HB3 TYR 11 3HB TYR 11 11.373 1.349 -2.688 462 HA PRO 12 HA PRO 12 15.176 -1.981 -1.799 463 HB2 PRO 12 2HB PRO 12 14.032 -3.838 -0.079 464 HB3 PRO 12 3HB PRO 12 15.292 -2.667 0.400 465 HG2 PRO 12 2HG PRO 12 12.292 -2.408 0.747 466 HG3 PRO 12 3HG PRO 12 13.578 -2.142 1.972 467 HD2 PRO 12 2HD PRO 12 12.482 -0.083 0.635 468 HD3 PRO 12 3HD PRO 12 14.245 -0.103 0.944 469 H GLY 13 HN GLY 13 14.746 -3.899 -3.025 470 HA2 GLY 13 2HA GLY 13 13.501 -5.283 -4.423 471 HA3 GLY 13 3HA GLY 13 12.020 -4.706 -3.636 472 H CYS 14 HN CYS 14 12.778 -1.825 -4.244 473 HA CYS 14 HA CYS 14 11.859 -1.791 -7.070 474 HB2 CYS 14 2HB CYS 14 10.505 -0.469 -5.511 475 HB3 CYS 14 3HB CYS 14 11.923 0.394 -4.907 476 H ASN 15 HN ASN 15 13.679 0.796 -5.452 477 HA ASN 15 HA ASN 15 15.469 2.025 -6.205 478 HB2 ASN 15 2HB ASN 15 16.631 -0.768 -6.600 479 HB3 ASN 15 3HB ASN 15 17.579 0.727 -6.607 480 HD21 ASN 15 1HD2 ASN 15 16.747 2.263 -4.576 481 HD22 ASN 15 2HD2 ASN 15 16.822 1.324 -3.061 482 H LYS 16 HN LYS 16 13.431 1.683 -8.157 483 HA LYS 16 HA LYS 16 14.780 1.094 -10.722 484 HB2 LYS 16 2HB LYS 16 11.942 1.954 -9.998 485 HB3 LYS 16 3HB LYS 16 12.496 1.705 -11.659 486 HG2 LYS 16 2HG LYS 16 13.172 -0.641 -11.029 487 HG3 LYS 16 3HG LYS 16 12.387 -0.412 -9.467 488 HD2 LYS 16 2HD LYS 16 11.030 -0.188 -12.189 489 HD3 LYS 16 3HD LYS 16 10.977 -1.610 -11.150 490 HE2 LYS 16 2HE LYS 16 9.886 1.128 -10.368 491 HE3 LYS 16 3HE LYS 16 8.923 -0.188 -11.058 492 HZ1 LYS 16 3HZ LYS 16 9.657 -1.547 -9.144 493 HZ2 LYS 16 1HZ LYS 16 8.727 -0.251 -8.714 494 HZ3 LYS 16 2HZ LYS 16 10.345 -0.201 -8.482 495 H ARG 17 HN ARG 17 14.548 2.655 -12.533 496 HA ARG 17 HA ARG 17 15.448 5.280 -11.491 497 HE ARG 17 HE ARG 17 15.196 2.285 -17.079 498 HB2 ARG 17 2HB ARG 17 16.800 5.454 -13.371 499 HB3 ARG 17 3HB ARG 17 16.896 3.744 -13.012 500 HG2 ARG 17 2HG ARG 17 15.275 5.074 -15.237 501 HG3 ARG 17 3HG ARG 17 16.776 4.185 -15.419 502 HD2 ARG 17 2HD ARG 17 15.729 2.089 -14.817 503 HD3 ARG 17 3HD ARG 17 14.213 2.889 -14.397 504 HH11 ARG 17 2HH2 ARG 17 12.813 4.233 -15.279 505 HH12 ARG 17 1HH2 ARG 17 11.760 4.295 -16.675 506 HH21 ARG 17 1HH1 ARG 17 13.796 2.490 -18.774 507 HH22 ARG 17 2HH1 ARG 17 12.302 3.377 -18.575 508 H TYR 18 HN TYR 18 14.761 7.194 -12.284 509 HA TYR 18 HA TYR 18 12.346 7.234 -14.034 510 HD1 TYR 18 1HD TYR 18 9.669 7.389 -12.727 511 HD2 TYR 18 2HD TYR 18 12.995 6.694 -10.058 512 HE1 TYR 18 1HE TYR 18 8.620 5.292 -11.956 513 HE2 TYR 18 2HE TYR 18 11.854 4.684 -9.187 514 HH TYR 18 HH TYR 18 10.008 3.359 -9.367 515 HB2 TYR 18 2HB TYR 18 12.867 8.709 -11.430 516 HB3 TYR 18 3HB TYR 18 11.523 9.029 -12.508 517 H PHE 19 HN PHE 19 11.907 9.344 -14.997 518 HA PHE 19 HA PHE 19 14.420 10.937 -15.395 519 HD1 PHE 19 1HD PHE 19 15.851 10.317 -17.580 520 HD2 PHE 19 2HD PHE 19 12.156 8.094 -17.688 521 HE1 PHE 19 1HE PHE 19 17.090 8.283 -18.279 522 HE2 PHE 19 2HE PHE 19 13.402 6.063 -18.383 523 HZ PHE 19 HZ PHE 19 15.867 6.153 -18.678 524 HB2 PHE 19 2HB PHE 19 12.108 10.474 -17.342 525 HB3 PHE 19 3HB PHE 19 13.541 11.456 -17.644 526 H LYS 20 HN LYS 20 10.810 11.153 -15.519 527 HA LYS 20 HA LYS 20 10.828 14.025 -15.069 528 HB2 LYS 20 2HB LYS 20 8.752 11.851 -15.240 529 HB3 LYS 20 3HB LYS 20 8.282 13.436 -14.575 530 HG2 LYS 20 2HG LYS 20 9.080 14.514 -16.651 531 HG3 LYS 20 3HG LYS 20 9.567 12.932 -17.293 532 HD2 LYS 20 2HD LYS 20 7.200 12.163 -17.197 533 HD3 LYS 20 3HD LYS 20 6.723 13.725 -16.515 534 HE2 LYS 20 2HE LYS 20 6.193 13.754 -18.861 535 HE3 LYS 20 3HE LYS 20 7.546 14.861 -18.585 536 HZ1 LYS 20 3HZ LYS 20 7.757 12.106 -19.625 537 HZ2 LYS 20 1HZ LYS 20 9.026 13.126 -19.368 538 HZ3 LYS 20 2HZ LYS 20 7.899 13.485 -20.513 539 H LEU 21 HN LEU 21 11.026 15.066 -13.190 540 HA LEU 21 HA LEU 21 11.439 13.843 -10.660 541 HG LEU 21 HG LEU 21 11.965 15.490 -8.903 542 HB2 LEU 21 2HB LEU 21 11.955 16.216 -11.391 543 HB3 LEU 21 3HB LEU 21 10.272 16.626 -11.175 544 HD11 LEU 21 1HD1 LEU 21 11.542 18.417 -9.644 545 HD12 LEU 21 2HD1 LEU 21 13.069 17.522 -9.794 546 HD13 LEU 21 3HD1 LEU 21 12.378 17.814 -8.196 547 HD21 LEU 21 3HD2 LEU 21 9.600 15.502 -8.322 548 HD22 LEU 21 1HD2 LEU 21 9.409 17.161 -8.937 549 HD23 LEU 21 2HD2 LEU 21 10.375 16.833 -7.484 550 H SER 22 HN SER 22 8.450 15.233 -12.121 551 HA SER 22 HA SER 22 6.755 14.754 -9.855 552 HG SER 22 HG SER 22 5.619 15.754 -13.630 553 HB2 SER 22 2HB SER 22 4.908 15.125 -11.549 554 HB3 SER 22 3HB SER 22 6.129 16.409 -11.470 555 H HIS 23 HN HIS 23 7.660 12.722 -12.620 556 HA HIS 23 HA HIS 23 5.459 10.814 -12.179 557 HD1 HIS 23 1HD HIS 23 7.035 8.583 -15.858 558 HD2 HIS 23 2HD HIS 23 9.818 10.101 -13.129 559 HE1 HIS 23 1HE HIS 23 9.321 7.694 -16.562 560 HB2 HIS 23 2HB HIS 23 6.004 9.935 -14.067 561 HB3 HIS 23 3HB HIS 23 6.856 11.365 -14.394 562 H LEU 24 HN LEU 24 8.942 11.113 -11.466 563 HA LEU 24 HA LEU 24 9.120 8.757 -9.854 564 HG LEU 24 HG LEU 24 12.528 9.550 -9.149 565 HB2 LEU 24 2HB LEU 24 11.034 10.056 -10.704 566 HB3 LEU 24 3HB LEU 24 10.651 11.367 -9.662 567 HD11 LEU 24 1HD1 LEU 24 10.866 10.888 -6.994 568 HD12 LEU 24 2HD1 LEU 24 12.198 11.616 -7.918 569 HD13 LEU 24 3HD1 LEU 24 12.520 10.270 -6.812 570 HD21 LEU 24 3HD2 LEU 24 10.624 7.720 -8.742 571 HD22 LEU 24 1HD2 LEU 24 10.635 8.447 -7.127 572 HD23 LEU 24 2HD2 LEU 24 12.114 7.790 -7.789 573 H GLN 25 HN GLN 25 7.968 12.068 -9.128 574 HA GLN 25 HA GLN 25 7.758 11.756 -6.287 575 HB2 GLN 25 2HB GLN 25 7.539 13.901 -7.764 576 HB3 GLN 25 3HB GLN 25 5.845 13.441 -7.945 577 HG2 GLN 25 2HG GLN 25 6.080 15.046 -6.156 578 HG3 GLN 25 3HG GLN 25 5.593 13.498 -5.473 579 HE21 GLN 25 1HE2 GLN 25 8.567 15.567 -6.060 580 HE22 GLN 25 2HE2 GLN 25 9.343 14.902 -4.616 581 H MET 26 HN MET 26 5.451 11.042 -8.978 582 HA MET 26 HA MET 26 3.334 10.043 -7.276 583 HB2 MET 26 2HB MET 26 3.137 10.670 -9.729 584 HB3 MET 26 3HB MET 26 3.951 9.153 -10.142 585 HG2 MET 26 2HG MET 26 1.455 9.311 -8.387 586 HG3 MET 26 3HG MET 26 1.362 9.191 -10.134 587 HE1 MET 26 3HE MET 26 0.500 7.149 -7.236 588 HE2 MET 26 1HE MET 26 -0.414 7.095 -8.774 589 HE3 MET 26 2HE MET 26 0.352 5.628 -8.107 590 H HIS 27 HN HIS 27 6.140 8.492 -8.937 591 HA HIS 27 HA HIS 27 5.600 5.828 -8.171 592 HD1 HIS 27 1HD HIS 27 7.123 3.587 -8.646 593 HD2 HIS 27 2HD HIS 27 9.946 6.223 -6.966 594 HE1 HIS 27 1HE HIS 27 8.677 2.186 -7.101 595 HB2 HIS 27 2HB HIS 27 7.382 6.244 -9.742 596 HB3 HIS 27 3HB HIS 27 8.239 7.297 -8.605 597 H SER 28 HN SER 28 7.555 8.337 -6.431 598 HA SER 28 HA SER 28 8.177 6.872 -4.193 599 HG SER 28 HG SER 28 8.954 9.382 -5.865 600 HB2 SER 28 2HB SER 28 7.393 9.823 -4.220 601 HB3 SER 28 3HB SER 28 8.452 9.014 -3.060 602 H ARG 29 HN ARG 29 5.068 8.427 -5.005 603 HA ARG 29 HA ARG 29 3.865 8.360 -2.412 604 HE ARG 29 HE ARG 29 3.644 10.283 -1.255 605 HB2 ARG 29 2HB ARG 29 3.049 9.054 -5.036 606 HB3 ARG 29 3HB ARG 29 1.939 7.781 -4.510 607 HG2 ARG 29 2HG ARG 29 1.012 9.863 -3.853 608 HG3 ARG 29 3HG ARG 29 1.631 9.161 -2.358 609 HD2 ARG 29 2HD ARG 29 3.109 11.227 -4.063 610 HD3 ARG 29 3HD ARG 29 2.065 11.645 -2.708 611 HH11 ARG 29 2HH1 ARG 29 4.994 11.725 -4.165 612 HH12 ARG 29 1HH1 ARG 29 6.452 12.227 -3.347 613 HH21 ARG 29 1HH2 ARG 29 5.715 10.391 -0.496 614 HH22 ARG 29 2HH2 ARG 29 6.875 11.394 -1.365 615 H LYS 30 HN LYS 30 4.299 5.874 -4.915 616 HA LYS 30 HA LYS 30 2.555 3.865 -3.858 617 HB2 LYS 30 2HB LYS 30 3.731 3.864 -6.092 618 HB3 LYS 30 3HB LYS 30 5.227 3.502 -5.220 619 HG2 LYS 30 2HG LYS 30 4.369 1.339 -4.500 620 HG3 LYS 30 3HG LYS 30 2.821 1.688 -5.289 621 HD2 LYS 30 2HD LYS 30 4.236 0.289 -6.778 622 HD3 LYS 30 3HD LYS 30 3.962 1.874 -7.486 623 HE2 LYS 30 2HE LYS 30 6.255 1.228 -7.843 624 HE3 LYS 30 3HE LYS 30 6.234 2.565 -6.678 625 HZ1 LYS 30 3HZ LYS 30 6.420 0.904 -4.925 626 HZ2 LYS 30 1HZ LYS 30 7.711 0.880 -5.926 627 HZ3 LYS 30 2HZ LYS 30 6.553 -0.298 -6.047 628 H HIS 31 HN HIS 31 5.901 4.824 -2.999 629 HA HIS 31 HA HIS 31 6.120 2.577 -1.077 630 HD1 HIS 31 1HD HIS 31 7.448 0.856 -1.865 631 HD2 HIS 31 2HD HIS 31 9.502 3.939 -3.929 632 HE1 HIS 31 1HE HIS 31 8.655 -0.230 -3.778 633 HB2 HIS 31 2HB HIS 31 8.029 4.784 -1.926 634 HB3 HIS 31 3HB HIS 31 8.377 3.628 -0.633 635 H THR 32 HN THR 32 6.014 6.203 -0.987 636 HA THR 32 HA THR 32 5.792 6.747 1.604 637 HB THR 32 HB THR 32 4.544 7.761 -0.772 638 HG1 THR 32 1HG THR 32 5.369 8.996 1.578 639 HG21 THR 32 3HG2 THR 32 2.934 8.381 1.698 640 HG22 THR 32 1HG2 THR 32 2.345 7.630 0.195 641 HG23 THR 32 2HG2 THR 32 2.887 9.312 0.193 642 H GLY 33 HN GLY 33 3.327 4.901 -0.191 643 HA2 GLY 33 2HA GLY 33 1.544 4.629 2.133 644 HA3 GLY 33 3HA GLY 33 1.448 3.740 0.599 645 H GLU 34 HN GLU 34 4.156 2.712 0.587 646 HA GLU 34 HA GLU 34 3.837 0.439 2.407 647 HB2 GLU 34 2HB GLU 34 6.075 1.144 0.428 648 HB3 GLU 34 3HB GLU 34 5.961 -0.300 1.425 649 HG2 GLU 34 2HG GLU 34 3.746 -0.817 0.326 650 HG3 GLU 34 3HG GLU 34 4.258 0.320 -0.939 651 H LYS 35 HN LYS 35 3.926 2.007 4.359 652 HA LYS 35 HA LYS 35 6.659 2.753 5.192 653 HB2 LYS 35 2HB LYS 35 4.225 3.765 5.864 654 HB3 LYS 35 3HB LYS 35 4.431 2.611 7.176 655 HG2 LYS 35 2HG LYS 35 5.457 4.427 8.114 656 HG3 LYS 35 3HG LYS 35 6.867 3.723 7.351 657 HD2 LYS 35 2HD LYS 35 5.141 5.974 6.191 658 HD3 LYS 35 3HD LYS 35 6.634 6.199 7.090 659 HE2 LYS 35 2HE LYS 35 7.281 6.481 4.883 660 HE3 LYS 35 3HE LYS 35 7.798 4.830 5.256 661 HZ1 LYS 35 3HZ LYS 35 5.778 4.060 4.153 662 HZ2 LYS 35 1HZ LYS 35 6.684 4.946 3.120 663 HZ3 LYS 35 2HZ LYS 35 5.328 5.594 3.801 664 HA PRO 36 HA PRO 36 7.225 -1.498 6.338 665 HB2 PRO 36 2HB PRO 36 9.872 -1.424 7.044 666 HB3 PRO 36 3HB PRO 36 9.311 -1.223 5.359 667 HG2 PRO 36 2HG PRO 36 10.015 0.961 7.350 668 HG3 PRO 36 3HG PRO 36 10.591 0.775 5.661 669 HD2 PRO 36 2HD PRO 36 8.500 2.392 6.308 670 HD3 PRO 36 3HD PRO 36 8.519 1.450 4.781 671 H TYR 37 HN TYR 37 7.300 -2.840 8.136 672 HA TYR 37 HA TYR 37 8.021 -1.707 10.790 673 HD1 TYR 37 2HD TYR 37 4.557 -1.266 8.611 674 HD2 TYR 37 1HD TYR 37 5.685 -0.214 12.635 675 HE1 TYR 37 2HE TYR 37 3.230 0.841 8.449 676 HE2 TYR 37 1HE TYR 37 4.289 1.838 12.498 677 HH TYR 37 HH TYR 37 3.058 3.266 10.936 678 HB2 TYR 37 2HB TYR 37 5.291 -2.971 10.301 679 HB3 TYR 37 3HB TYR 37 5.955 -2.412 11.835 680 H GLN 38 HN GLN 38 7.549 -3.576 12.512 681 HA GLN 38 HA GLN 38 7.875 -6.278 11.312 682 HB2 GLN 38 2HB GLN 38 9.555 -6.945 12.834 683 HB3 GLN 38 3HB GLN 38 10.153 -5.506 12.039 684 HG2 GLN 38 2HG GLN 38 10.342 -4.359 13.998 685 HG3 GLN 38 3HG GLN 38 8.807 -4.908 14.640 686 HE21 GLN 38 1HE2 GLN 38 8.700 -7.036 15.874 687 HE22 GLN 38 2HE2 GLN 38 10.258 -7.654 16.407 688 H CYS 39 HN CYS 39 7.001 -7.955 12.579 689 HA CYS 39 HA CYS 39 4.666 -7.522 13.879 690 HB2 CYS 39 2HB CYS 39 5.613 -9.774 13.265 691 HB3 CYS 39 3HB CYS 39 6.578 -9.721 14.764 692 H ASP 40 HN ASP 40 3.877 -6.815 15.788 693 HA ASP 40 HA ASP 40 5.830 -5.836 17.798 694 HB2 ASP 40 2HB ASP 40 3.851 -4.633 18.734 695 HB3 ASP 40 3HB ASP 40 4.195 -4.229 17.065 696 H PHE 41 HN PHE 41 4.353 -8.729 17.247 697 HA PHE 41 HA PHE 41 3.172 -9.378 19.790 698 HD1 PHE 41 1HD PHE 41 1.459 -11.223 19.935 699 HD2 PHE 41 2HD PHE 41 4.930 -13.305 18.460 700 HE1 PHE 41 1HE PHE 41 0.740 -13.281 21.132 701 HE2 PHE 41 2HE PHE 41 4.209 -15.356 19.645 702 HZ PHE 41 HZ PHE 41 2.123 -15.343 20.998 703 HB2 PHE 41 2HB PHE 41 2.843 -10.648 17.690 704 HB3 PHE 41 3HB PHE 41 4.525 -11.150 17.735 705 H LYS 42 HN LYS 42 4.049 -10.736 21.484 706 HA LYS 42 HA LYS 42 6.561 -9.710 22.400 707 HB2 LYS 42 2HB LYS 42 4.438 -10.552 23.720 708 HB3 LYS 42 3HB LYS 42 5.197 -12.134 23.598 709 HG2 LYS 42 2HG LYS 42 7.322 -10.598 24.526 710 HG3 LYS 42 3HG LYS 42 5.975 -9.678 25.147 711 HD2 LYS 42 2HD LYS 42 6.739 -11.229 26.841 712 HD3 LYS 42 3HD LYS 42 5.121 -11.702 26.319 713 HE2 LYS 42 2HE LYS 42 6.586 -13.667 26.607 714 HE3 LYS 42 3HE LYS 42 6.053 -13.502 24.934 715 HZ1 LYS 42 3HZ LYS 42 8.350 -14.003 24.984 716 HZ2 LYS 42 1HZ LYS 42 8.698 -12.723 25.980 717 HZ3 LYS 42 2HZ LYS 42 8.179 -12.479 24.426 718 H ASP 43 HN ASP 43 5.906 -12.385 20.334 719 HA ASP 43 HA ASP 43 8.681 -13.415 20.714 720 HB2 ASP 43 2HB ASP 43 6.216 -15.212 20.584 721 HB3 ASP 43 3HB ASP 43 7.889 -15.740 20.714 722 H CYS 44 HN CYS 44 7.811 -11.710 18.624 723 HA CYS 44 HA CYS 44 8.324 -13.512 16.334 724 HB2 CYS 44 2HB CYS 44 5.818 -13.221 16.452 725 HB3 CYS 44 3HB CYS 44 6.064 -11.476 16.273 726 H GLU 45 HN GLU 45 8.843 -12.231 14.338 727 HA GLU 45 HA GLU 45 9.682 -9.441 14.724 728 HB2 GLU 45 2HB GLU 45 12.041 -9.842 14.111 729 HB3 GLU 45 3HB GLU 45 11.634 -10.615 15.631 730 HG2 GLU 45 2HG GLU 45 11.487 -12.818 14.531 731 HG3 GLU 45 3HG GLU 45 11.794 -12.082 12.957 732 H ARG 46 HN ARG 46 7.842 -11.171 13.022 733 HA ARG 46 HA ARG 46 8.966 -11.381 10.358 734 HE ARG 46 HE ARG 46 5.997 -15.935 10.268 735 HB2 ARG 46 2HB ARG 46 6.130 -11.375 11.465 736 HB3 ARG 46 3HB ARG 46 6.467 -11.526 9.736 737 HG2 ARG 46 2HG ARG 46 7.644 -13.587 10.007 738 HG3 ARG 46 3HG ARG 46 7.720 -13.419 11.766 739 HD2 ARG 46 2HD ARG 46 5.262 -13.592 11.912 740 HD3 ARG 46 3HD ARG 46 5.158 -13.745 10.156 741 HH11 ARG 46 1HH1 ARG 46 6.090 -14.569 13.570 742 HH12 ARG 46 2HH1 ARG 46 6.240 -16.158 14.265 743 HH21 ARG 46 2HH2 ARG 46 6.283 -17.889 11.287 744 HH22 ARG 46 1HH2 ARG 46 6.363 -17.940 13.035 745 H ARG 47 HN ARG 47 9.222 -9.854 8.848 746 HA ARG 47 HA ARG 47 8.491 -7.117 9.596 747 HE ARG 47 HE ARG 47 7.990 -8.037 5.524 748 HB2 ARG 47 2HB ARG 47 9.966 -6.436 7.816 749 HB3 ARG 47 3HB ARG 47 10.743 -7.690 8.752 750 HG2 ARG 47 2HG ARG 47 11.315 -8.556 6.790 751 HG3 ARG 47 3HG ARG 47 9.702 -9.235 6.719 752 HD2 ARG 47 2HD ARG 47 10.428 -6.506 5.538 753 HD3 ARG 47 3HD ARG 47 10.642 -8.020 4.654 754 HH11 ARG 47 1HH1 ARG 47 9.885 -6.104 3.253 755 HH12 ARG 47 2HH1 ARG 47 8.475 -5.784 2.254 756 HH21 ARG 47 2HH2 ARG 47 6.272 -7.539 4.192 757 HH22 ARG 47 1HH2 ARG 47 6.521 -6.473 2.819 758 H PHE 48 HN PHE 48 7.327 -5.682 8.347 759 HA PHE 48 HA PHE 48 5.765 -6.793 6.065 760 HD1 PHE 48 1HD PHE 48 3.406 -8.068 6.390 761 HD2 PHE 48 2HD PHE 48 4.942 -6.729 10.189 762 HE1 PHE 48 1HE PHE 48 3.185 -10.361 7.296 763 HE2 PHE 48 2HE PHE 48 4.702 -9.021 11.093 764 HZ PHE 48 HZ PHE 48 3.927 -10.858 9.609 765 HB2 PHE 48 2HB PHE 48 4.627 -5.136 8.366 766 HB3 PHE 48 3HB PHE 48 3.756 -5.604 6.906 767 H SER 49 HN SER 49 4.878 -5.032 4.665 768 HA SER 49 HA SER 49 6.788 -2.727 4.729 769 HG SER 49 HG SER 49 5.177 -3.373 1.117 770 HB2 SER 49 2HB SER 49 6.637 -2.616 2.391 771 HB3 SER 49 3HB SER 49 6.793 -4.325 2.742 772 H ARG 50 HN ARG 50 3.769 -3.274 5.834 773 HA ARG 50 HA ARG 50 3.082 -0.447 5.583 774 HE ARG 50 HE ARG 50 -1.081 -1.832 2.920 775 HB2 ARG 50 2HB ARG 50 2.192 -1.593 3.495 776 HB3 ARG 50 3HB ARG 50 1.051 -2.449 4.532 777 HG2 ARG 50 2HG ARG 50 -0.140 -0.449 5.016 778 HG3 ARG 50 3HG ARG 50 1.242 0.587 4.635 779 HD2 ARG 50 2HD ARG 50 -0.574 0.641 2.897 780 HD3 ARG 50 3HD ARG 50 1.023 0.222 2.290 781 HH11 ARG 50 2HH1 ARG 50 1.541 -0.830 0.771 782 HH12 ARG 50 1HH1 ARG 50 1.265 -2.241 -0.235 783 HH21 ARG 50 2HH2 ARG 50 -1.306 -3.488 1.495 784 HH22 ARG 50 1HH2 ARG 50 -0.202 -3.627 0.178 785 H SER 51 HN SER 51 1.346 0.212 6.974 786 HA SER 51 HA SER 51 1.361 -1.009 9.518 787 HG SER 51 HG SER 51 0.060 0.620 11.021 788 HB2 SER 51 2HB SER 51 0.778 1.378 9.067 789 HB3 SER 51 3HB SER 51 -0.738 0.856 8.317 790 H ASP 52 HN ASP 52 -1.089 -1.199 6.882 791 HA ASP 52 HA ASP 52 -2.967 -2.714 8.403 792 HB2 ASP 52 2HB ASP 52 -4.206 -2.836 6.489 793 HB3 ASP 52 3HB ASP 52 -3.248 -1.362 6.253 794 H GLN 53 HN GLN 53 -0.213 -3.660 6.346 795 HA GLN 53 HA GLN 53 -0.786 -6.476 6.240 796 HB2 GLN 53 2HB GLN 53 1.808 -4.913 6.153 797 HB3 GLN 53 3HB GLN 53 1.705 -6.653 5.915 798 HG2 GLN 53 2HG GLN 53 0.540 -6.416 3.860 799 HG3 GLN 53 3HG GLN 53 0.256 -4.684 4.128 800 HE21 GLN 53 1HE2 GLN 53 1.501 -3.828 2.326 801 HE22 GLN 53 2HE2 GLN 53 3.265 -4.095 2.327 802 H LEU 54 HN LEU 54 1.167 -4.440 8.489 803 HA LEU 54 HA LEU 54 1.929 -6.597 10.232 804 HG LEU 54 HG LEU 54 1.545 -4.439 12.871 805 HB2 LEU 54 2HB LEU 54 3.132 -4.518 10.273 806 HB3 LEU 54 3HB LEU 54 1.681 -3.586 10.606 807 HD11 LEU 54 1HD1 LEU 54 3.273 -5.875 13.818 808 HD12 LEU 54 2HD1 LEU 54 4.069 -6.035 12.240 809 HD13 LEU 54 3HD1 LEU 54 2.474 -6.749 12.496 810 HD21 LEU 54 3HD2 LEU 54 3.471 -3.388 13.799 811 HD22 LEU 54 1HD2 LEU 54 3.181 -2.538 12.266 812 HD23 LEU 54 2HD2 LEU 54 4.458 -3.787 12.396 813 H LYS 55 HN LYS 55 -0.825 -4.247 10.351 814 HA LYS 55 HA LYS 55 -1.935 -5.211 12.835 815 HB2 LYS 55 2HB LYS 55 -3.121 -3.711 10.465 816 HB3 LYS 55 3HB LYS 55 -4.070 -4.131 11.899 817 HG2 LYS 55 2HG LYS 55 -2.584 -2.865 13.359 818 HG3 LYS 55 3HG LYS 55 -1.467 -2.545 12.039 819 HD2 LYS 55 2HD LYS 55 -2.735 -0.558 12.403 820 HD3 LYS 55 3HD LYS 55 -3.262 -1.241 10.860 821 HE2 LYS 55 2HE LYS 55 -5.243 -2.240 11.999 822 HE3 LYS 55 3HE LYS 55 -4.686 -1.579 13.546 823 HZ1 LYS 55 3HZ LYS 55 -5.418 0.008 11.178 824 HZ2 LYS 55 1HZ LYS 55 -4.929 0.624 12.620 825 HZ3 LYS 55 2HZ LYS 55 -6.357 -0.192 12.516 826 H ARG 56 HN ARG 56 -2.450 -6.134 9.409 827 HA ARG 56 HA ARG 56 -4.495 -8.102 9.852 828 HE ARG 56 HE ARG 56 -1.221 -9.323 6.615 829 HB2 ARG 56 2HB ARG 56 -3.971 -7.317 7.615 830 HB3 ARG 56 3HB ARG 56 -2.303 -7.830 7.771 831 HG2 ARG 56 2HG ARG 56 -3.186 -10.256 7.882 832 HG3 ARG 56 3HG ARG 56 -4.756 -9.577 7.428 833 HD2 ARG 56 2HD ARG 56 -3.620 -10.350 5.429 834 HD3 ARG 56 3HD ARG 56 -3.651 -8.579 5.387 835 HH11 ARG 56 1HH2 ARG 56 -2.625 -9.722 3.379 836 HH12 ARG 56 2HH2 ARG 56 -1.041 -9.699 2.637 837 HH21 ARG 56 1HH1 ARG 56 0.750 -9.405 5.533 838 HH22 ARG 56 2HH1 ARG 56 0.704 -9.532 3.766 839 H HIS 57 HN HIS 57 -0.902 -8.298 9.794 840 HA HIS 57 HA HIS 57 -0.704 -11.085 10.215 841 HD1 HIS 57 1HD HIS 57 1.276 -12.620 10.227 842 HD2 HIS 57 2HD HIS 57 2.906 -9.732 12.806 843 HE1 HIS 57 1HE HIS 57 2.838 -13.867 11.860 844 HB2 HIS 57 2HB HIS 57 1.198 -9.718 9.544 845 HB3 HIS 57 3HB HIS 57 1.186 -8.836 11.072 846 H GLN 58 HN GLN 58 -0.966 -8.398 12.588 847 HA GLN 58 HA GLN 58 -0.643 -9.869 14.962 848 HB2 GLN 58 2HB GLN 58 -2.445 -7.467 14.378 849 HB3 GLN 58 3HB GLN 58 -2.236 -8.182 15.965 850 HG2 GLN 58 2HG GLN 58 -0.197 -6.673 14.346 851 HG3 GLN 58 3HG GLN 58 -0.690 -6.443 16.012 852 HE21 GLN 58 1HE2 GLN 58 1.813 -7.578 14.099 853 HE22 GLN 58 2HE2 GLN 58 2.564 -8.709 15.237 854 H ARG 59 HN ARG 59 -3.498 -9.717 12.783 855 HA ARG 59 HA ARG 59 -5.443 -10.841 14.556 856 HE ARG 59 HE ARG 59 -6.789 -7.166 11.406 857 HB2 ARG 59 2HB ARG 59 -5.240 -11.301 11.554 858 HB3 ARG 59 3HB ARG 59 -6.654 -11.504 12.573 859 HG2 ARG 59 2HG ARG 59 -6.717 -9.109 13.109 860 HG3 ARG 59 3HG ARG 59 -5.246 -8.847 12.169 861 HD2 ARG 59 2HD ARG 59 -6.465 -9.750 10.150 862 HD3 ARG 59 3HD ARG 59 -7.963 -9.656 11.105 863 HH11 ARG 59 1HH2 ARG 59 -7.845 -8.972 8.562 864 HH12 ARG 59 2HH2 ARG 59 -7.888 -7.510 7.581 865 HH21 ARG 59 2HH1 ARG 59 -6.907 -5.386 10.104 866 HH22 ARG 59 1HH1 ARG 59 -7.384 -5.556 8.430 867 H ARG 60 HN ARG 60 -2.815 -12.352 12.683 868 HA ARG 60 HA ARG 60 -3.659 -15.120 13.045 869 HE ARG 60 HE ARG 60 0.722 -17.903 12.325 870 HB2 ARG 60 2HB ARG 60 -2.033 -14.450 11.297 871 HB3 ARG 60 3HB ARG 60 -0.917 -13.890 12.543 872 HG2 ARG 60 2HG ARG 60 -0.740 -16.248 13.409 873 HG3 ARG 60 3HG ARG 60 -1.640 -16.760 11.976 874 HD2 ARG 60 2HD ARG 60 0.150 -15.631 10.575 875 HD3 ARG 60 3HD ARG 60 0.992 -15.210 12.066 876 HH11 ARG 60 1HH1 ARG 60 2.126 -16.036 9.638 877 HH12 ARG 60 2HH1 ARG 60 3.313 -17.285 9.352 878 HH21 ARG 60 1HH2 ARG 60 2.206 -19.425 11.784 879 HH22 ARG 60 2HH2 ARG 60 3.319 -19.145 10.468 880 H HIS 61 HN HIS 61 -1.689 -12.804 14.947 881 HA HIS 61 HA HIS 61 -0.765 -14.905 16.798 882 HD1 HIS 61 1HD HIS 61 1.578 -15.200 17.424 883 HD2 HIS 61 2HD HIS 61 1.960 -11.602 15.267 884 HE1 HIS 61 1HE HIS 61 3.895 -15.235 16.321 885 HB2 HIS 61 2HB HIS 61 -0.332 -11.915 16.521 886 HB3 HIS 61 3HB HIS 61 0.042 -12.719 18.038 887 H THR 62 HN THR 62 -3.261 -12.404 16.652 888 HA THR 62 HA THR 62 -3.936 -12.608 19.484 889 HB THR 62 HB THR 62 -5.995 -11.286 18.736 890 HG1 THR 62 1HG THR 62 -4.495 -11.009 16.379 891 HG21 THR 62 3HG2 THR 62 -4.732 -9.209 18.303 892 HG22 THR 62 1HG2 THR 62 -3.250 -10.146 18.016 893 HG23 THR 62 2HG2 THR 62 -4.002 -10.143 19.621 894 H GLY 63 HN GLY 63 -5.608 -13.615 16.382 895 HA2 GLY 63 2HA GLY 63 -6.472 -15.974 16.372 896 HA3 GLY 63 3HA GLY 63 -7.021 -15.686 18.034 897 H VAL 64 HN VAL 64 -7.454 -12.762 16.537 898 HA VAL 64 HA VAL 64 -10.318 -13.043 16.611 899 HB VAL 64 HB VAL 64 -8.940 -11.002 17.176 900 HG11 VAL 64 1HG1 VAL 64 -8.984 -10.343 14.209 901 HG12 VAL 64 2HG1 VAL 64 -8.316 -9.383 15.543 902 HG13 VAL 64 3HG1 VAL 64 -7.555 -10.917 15.094 903 HG21 VAL 64 3HG2 VAL 64 -11.285 -10.542 15.299 904 HG22 VAL 64 1HG2 VAL 64 -11.376 -10.933 17.030 905 HG23 VAL 64 2HG2 VAL 64 -10.647 -9.410 16.501 906 H LYS 65 HN LYS 65 -11.852 -13.193 15.034 907 HA LYS 65 HA LYS 65 -11.018 -13.098 12.168 908 HB2 LYS 65 2HB LYS 65 -12.636 -15.327 13.472 909 HB3 LYS 65 3HB LYS 65 -12.365 -15.147 11.733 910 HG2 LYS 65 2HG LYS 65 -10.044 -15.657 11.943 911 HG3 LYS 65 3HG LYS 65 -10.103 -15.543 13.711 912 HD2 LYS 65 2HD LYS 65 -11.700 -17.521 13.692 913 HD3 LYS 65 3HD LYS 65 -11.399 -17.652 11.949 914 HE2 LYS 65 2HE LYS 65 -9.899 -19.188 12.997 915 HE3 LYS 65 3HE LYS 65 -8.920 -17.806 12.477 916 HZ1 LYS 65 3HZ LYS 65 -9.911 -18.311 15.212 917 HZ2 LYS 65 1HZ LYS 65 -9.087 -16.967 14.770 918 HZ3 LYS 65 2HZ LYS 65 -8.351 -18.442 14.702 919 HA PRO 66 HA PRO 66 -14.864 -10.763 13.203 920 HB2 PRO 66 2HB PRO 66 -14.298 -8.399 11.937 921 HB3 PRO 66 3HB PRO 66 -13.556 -8.864 13.495 922 HG2 PRO 66 2HG PRO 66 -12.380 -9.150 10.717 923 HG3 PRO 66 3HG PRO 66 -11.608 -8.457 12.178 924 HD2 PRO 66 2HD PRO 66 -11.216 -11.036 11.378 925 HD3 PRO 66 3HD PRO 66 -11.238 -10.585 13.103 926 H PHE 67 HN PHE 67 -13.443 -11.574 10.075 927 HA PHE 67 HA PHE 67 -15.798 -10.633 8.534 928 HD1 PHE 67 2HD PHE 67 -14.806 -9.206 6.160 929 HD2 PHE 67 1HD PHE 67 -11.629 -10.797 8.591 930 HE1 PHE 67 2HE PHE 67 -13.586 -7.051 5.982 931 HE2 PHE 67 1HE PHE 67 -10.385 -8.659 8.372 932 HZ PHE 67 HZ PHE 67 -11.372 -6.777 7.072 933 HB2 PHE 67 2HB PHE 67 -13.346 -12.256 7.712 934 HB3 PHE 67 3HB PHE 67 -14.534 -11.654 6.601 935 H GLN 68 HN GLN 68 -17.606 -11.824 9.212 936 HA GLN 68 HA GLN 68 -17.387 -14.826 9.250 937 HB2 GLN 68 2HB GLN 68 -18.329 -13.556 11.261 938 HB3 GLN 68 3HB GLN 68 -19.643 -13.022 10.222 939 HG2 GLN 68 2HG GLN 68 -19.837 -15.721 9.815 940 HG3 GLN 68 3HG GLN 68 -19.119 -15.725 11.409 941 HE21 GLN 68 1HE2 GLN 68 -22.015 -15.201 9.566 942 HE22 GLN 68 2HE2 GLN 68 -22.998 -14.729 10.979 943 H CYS 69 HN CYS 69 -18.378 -16.053 7.770 944 HA CYS 69 HA CYS 69 -19.701 -14.936 5.468 945 HB2 CYS 69 2HB CYS 69 -18.604 -17.144 5.407 946 HB3 CYS 69 3HB CYS 69 -19.726 -17.771 6.615 947 H LYS 70 HN LYS 70 -21.914 -14.973 4.891 948 HA LYS 70 HA LYS 70 -23.793 -14.878 7.216 949 HB2 LYS 70 2HB LYS 70 -24.271 -13.911 4.367 950 HB3 LYS 70 3HB LYS 70 -25.254 -13.575 5.793 951 HG2 LYS 70 2HG LYS 70 -22.473 -12.515 5.166 952 HG3 LYS 70 3HG LYS 70 -23.980 -11.609 5.238 953 HD2 LYS 70 2HD LYS 70 -24.137 -12.086 7.691 954 HD3 LYS 70 3HD LYS 70 -22.572 -12.908 7.622 955 HE2 LYS 70 2HE LYS 70 -23.061 -9.985 6.927 956 HE3 LYS 70 3HE LYS 70 -22.376 -10.595 8.443 957 HZ1 LYS 70 3HZ LYS 70 -21.180 -10.894 5.770 958 HZ2 LYS 70 1HZ LYS 70 -20.568 -11.559 7.141 959 HZ3 LYS 70 2HZ LYS 70 -20.636 -9.916 6.981 960 H THR 71 HN THR 71 -22.662 -17.173 5.243 961 HA THR 71 HA THR 71 -25.336 -18.386 4.630 962 HB THR 71 HB THR 71 -22.964 -19.644 3.405 963 HG1 THR 71 1HG THR 71 -22.171 -17.631 3.237 964 HG21 THR 71 3HG2 THR 71 -25.260 -20.176 2.740 965 HG22 THR 71 1HG2 THR 71 -24.292 -19.554 1.386 966 HG23 THR 71 2HG2 THR 71 -25.478 -18.496 2.182 967 H CYS 72 HN CYS 72 -21.945 -19.435 5.402 968 HA CYS 72 HA CYS 72 -23.078 -21.792 6.831 969 HB2 CYS 72 2HB CYS 72 -20.775 -22.647 6.738 970 HB3 CYS 72 3HB CYS 72 -21.320 -22.160 5.115 971 H GLN 73 HN GLN 73 -21.413 -18.734 7.411 972 HA GLN 73 HA GLN 73 -21.385 -17.574 9.499 973 HB2 GLN 73 2HB GLN 73 -22.846 -19.510 10.498 974 HB3 GLN 73 3HB GLN 73 -21.299 -20.174 11.073 975 HG2 GLN 73 2HG GLN 73 -21.397 -17.388 11.777 976 HG3 GLN 73 3HG GLN 73 -22.945 -18.100 12.198 977 HE21 GLN 73 1HE2 GLN 73 -19.423 -18.824 12.430 978 HE22 GLN 73 2HE2 GLN 73 -19.564 -19.484 14.093 979 H ARG 74 HN ARG 74 -19.315 -19.595 7.919 980 HA ARG 74 HA ARG 74 -17.137 -19.993 9.629 981 HE ARG 74 HE ARG 74 -12.901 -21.182 7.790 982 HB2 ARG 74 2HB ARG 74 -17.370 -20.954 7.353 983 HB3 ARG 74 3HB ARG 74 -17.098 -19.360 6.645 984 HG2 ARG 74 2HG ARG 74 -15.106 -20.625 6.426 985 HG3 ARG 74 3HG ARG 74 -14.763 -19.410 7.666 986 HD2 ARG 74 2HD ARG 74 -15.050 -21.106 9.420 987 HD3 ARG 74 3HD ARG 74 -15.607 -22.282 8.213 988 HH11 ARG 74 1HH2 ARG 74 -14.738 -23.840 9.177 989 HH12 ARG 74 2HH2 ARG 74 -13.353 -24.909 9.197 990 HH21 ARG 74 2HH1 ARG 74 -11.145 -22.654 7.837 991 HH22 ARG 74 1HH1 ARG 74 -11.423 -24.243 8.494 992 H LYS 75 HN LYS 75 -15.667 -18.727 10.584 993 HA LYS 75 HA LYS 75 -15.739 -15.846 9.917 994 HB2 LYS 75 2HB LYS 75 -14.687 -17.396 12.335 995 HB3 LYS 75 3HB LYS 75 -14.517 -15.649 12.105 996 HG2 LYS 75 2HG LYS 75 -16.932 -15.373 11.951 997 HG3 LYS 75 3HG LYS 75 -17.168 -17.110 12.243 998 HD2 LYS 75 2HD LYS 75 -16.069 -16.873 14.454 999 HD3 LYS 75 3HD LYS 75 -15.881 -15.132 14.182 1000 HE2 LYS 75 2HE LYS 75 -18.559 -16.604 14.181 1001 HE3 LYS 75 3HE LYS 75 -17.882 -15.785 15.597 1002 HZ1 LYS 75 3HZ LYS 75 -17.955 -13.724 14.411 1003 HZ2 LYS 75 1HZ LYS 75 -19.455 -14.417 14.356 1004 HZ3 LYS 75 2HZ LYS 75 -18.490 -14.462 13.039 1005 H PHE 76 HN PHE 76 -14.044 -14.722 9.206 1006 HA PHE 76 HA PHE 76 -11.411 -16.113 8.895 1007 HD1 PHE 76 1HD PHE 76 -11.005 -17.412 6.173 1008 HD2 PHE 76 2HD PHE 76 -14.833 -15.440 6.470 1009 HE1 PHE 76 1HE PHE 76 -12.079 -19.286 4.948 1010 HE2 PHE 76 2HE PHE 76 -15.906 -17.339 5.317 1011 HZ PHE 76 HZ PHE 76 -14.522 -19.267 4.544 1012 HB2 PHE 76 2HB PHE 76 -12.759 -14.232 6.898 1013 HB3 PHE 76 3HB PHE 76 -11.196 -14.986 6.703 1014 H SER 77 HN SER 77 -9.579 -14.584 8.633 1015 HA SER 77 HA SER 77 -10.040 -12.079 10.194 1016 HG SER 77 HG SER 77 -8.592 -13.465 12.178 1017 HB2 SER 77 2HB SER 77 -7.432 -13.527 9.578 1018 HB3 SER 77 3HB SER 77 -7.632 -12.151 10.666 1019 H ARG 78 HN ARG 78 -9.987 -12.953 7.022 1020 HA ARG 78 HA ARG 78 -8.711 -10.389 6.164 1021 HE ARG 78 HE ARG 78 -6.088 -12.826 3.332 1022 HB2 ARG 78 2HB ARG 78 -8.117 -13.199 5.189 1023 HB3 ARG 78 3HB ARG 78 -7.852 -11.797 4.145 1024 HG2 ARG 78 2HG ARG 78 -6.242 -10.839 5.637 1025 HG3 ARG 78 3HG ARG 78 -6.638 -11.980 6.928 1026 HD2 ARG 78 2HD ARG 78 -4.545 -12.566 5.895 1027 HD3 ARG 78 3HD ARG 78 -5.739 -13.841 5.685 1028 HH11 ARG 78 2HH1 ARG 78 -2.987 -13.015 4.949 1029 HH12 ARG 78 1HH1 ARG 78 -2.134 -13.146 3.412 1030 HH21 ARG 78 1HH2 ARG 78 -4.912 -12.975 1.425 1031 HH22 ARG 78 2HH2 ARG 78 -3.186 -13.196 1.498 1032 H SER 79 HN SER 79 -10.137 -9.241 5.083 1033 HA SER 79 HA SER 79 -12.598 -10.021 4.023 1034 HG SER 79 HG SER 79 -10.452 -6.784 2.805 1035 HB2 SER 79 2HB SER 79 -12.391 -8.014 2.522 1036 HB3 SER 79 3HB SER 79 -12.003 -7.678 4.216 1037 H ASP 80 HN ASP 80 -9.425 -9.960 2.307 1038 HA ASP 80 HA ASP 80 -10.286 -10.821 -0.222 1039 HB2 ASP 80 2HB ASP 80 -8.007 -9.995 0.344 1040 HB3 ASP 80 3HB ASP 80 -7.673 -11.495 1.208 1041 H HIS 81 HN HIS 81 -9.794 -12.762 2.723 1042 HA HIS 81 HA HIS 81 -9.948 -15.390 1.332 1043 HD1 HIS 81 1HD HIS 81 -7.611 -15.432 1.513 1044 HD2 HIS 81 2HD HIS 81 -8.029 -15.963 5.664 1045 HE1 HIS 81 1HE HIS 81 -5.353 -15.900 2.364 1046 HB2 HIS 81 2HB HIS 81 -10.018 -14.597 4.287 1047 HB3 HIS 81 3HB HIS 81 -10.271 -16.227 3.713 1048 H LEU 82 HN LEU 82 -12.064 -13.173 3.232 1049 HA LEU 82 HA LEU 82 -14.321 -14.958 3.265 1050 HG LEU 82 HG LEU 82 -16.382 -14.018 3.717 1051 HB2 LEU 82 2HB LEU 82 -14.032 -13.062 4.796 1052 HB3 LEU 82 3HB LEU 82 -14.257 -11.904 3.479 1053 HD11 LEU 82 1HD1 LEU 82 -17.510 -13.158 5.564 1054 HD12 LEU 82 2HD1 LEU 82 -16.419 -11.794 5.751 1055 HD13 LEU 82 3HD1 LEU 82 -15.861 -13.483 6.075 1056 HD21 LEU 82 3HD2 LEU 82 -17.908 -12.145 3.306 1057 HD22 LEU 82 1HD2 LEU 82 -16.625 -12.126 2.099 1058 HD23 LEU 82 2HD2 LEU 82 -16.572 -10.983 3.453 1059 H LYS 83 HN LYS 83 -13.359 -12.279 1.044 1060 HA LYS 83 HA LYS 83 -15.656 -12.472 -0.709 1061 HB2 LYS 83 2HB LYS 83 -14.078 -10.549 -0.699 1062 HB3 LYS 83 3HB LYS 83 -12.774 -11.595 -1.274 1063 HG2 LYS 83 2HG LYS 83 -14.139 -12.052 -3.358 1064 HG3 LYS 83 3HG LYS 83 -15.330 -10.885 -2.796 1065 HD2 LYS 83 2HD LYS 83 -12.372 -10.274 -3.288 1066 HD3 LYS 83 3HD LYS 83 -13.621 -10.073 -4.512 1067 HE2 LYS 83 2HE LYS 83 -13.628 -8.640 -1.824 1068 HE3 LYS 83 3HE LYS 83 -12.984 -7.963 -3.327 1069 HZ1 LYS 83 3HZ LYS 83 -15.777 -8.788 -2.888 1070 HZ2 LYS 83 1HZ LYS 83 -15.171 -8.208 -4.303 1071 HZ3 LYS 83 2HZ LYS 83 -15.219 -7.237 -2.977 1072 H THR 84 HN THR 84 -12.443 -14.094 -0.640 1073 HA THR 84 HA THR 84 -12.778 -15.614 -3.038 1074 HB THR 84 HB THR 84 -11.231 -16.114 -0.488 1075 HG1 THR 84 1HG THR 84 -10.399 -14.457 -1.466 1076 HG21 THR 84 3HG2 THR 84 -11.419 -18.317 -1.539 1077 HG22 THR 84 1HG2 THR 84 -9.793 -17.622 -1.541 1078 HG23 THR 84 2HG2 THR 84 -10.759 -17.624 -3.055 1079 H HIS 85 HN HIS 85 -13.444 -16.442 0.393 1080 HA HIS 85 HA HIS 85 -14.579 -19.001 -0.082 1081 HD1 HIS 85 1HD HIS 85 -15.704 -20.770 1.976 1082 HD2 HIS 85 2HD HIS 85 -17.161 -16.996 3.200 1083 HE1 HIS 85 1HE HIS 85 -18.043 -21.143 2.963 1084 HB2 HIS 85 2HB HIS 85 -13.910 -18.454 2.129 1085 HB3 HIS 85 3HB HIS 85 -14.841 -16.956 2.133 1086 H THR 86 HN THR 86 -15.993 -15.737 -0.108 1087 HA THR 86 HA THR 86 -18.734 -16.364 -0.167 1088 HB THR 86 HB THR 86 -17.210 -14.181 -1.637 1089 HG1 THR 86 1HG THR 86 -17.063 -14.190 0.642 1090 HG21 THR 86 3HG2 THR 86 -19.389 -14.234 -2.679 1091 HG22 THR 86 1HG2 THR 86 -19.132 -12.825 -1.636 1092 HG23 THR 86 2HG2 THR 86 -20.160 -14.174 -1.063 1093 H ARG 87 HN ARG 87 -16.291 -16.473 -2.813 1094 HA ARG 87 HA ARG 87 -18.211 -16.912 -4.955 1095 HE ARG 87 HE ARG 87 -13.143 -16.550 -6.710 1096 HB2 ARG 87 2HB ARG 87 -15.235 -17.585 -4.792 1097 HB3 ARG 87 3HB ARG 87 -16.233 -17.647 -6.238 1098 HG2 ARG 87 2HG ARG 87 -16.830 -15.175 -5.780 1099 HG3 ARG 87 3HG ARG 87 -15.534 -15.179 -4.602 1100 HD2 ARG 87 2HD ARG 87 -15.181 -15.832 -7.553 1101 HD3 ARG 87 3HD ARG 87 -14.921 -14.242 -6.848 1102 HH11 ARG 87 1HH2 ARG 87 -13.828 -13.528 -5.046 1103 HH12 ARG 87 2HH2 ARG 87 -12.206 -13.482 -4.363 1104 HH21 ARG 87 1HH1 ARG 87 -11.275 -16.461 -5.827 1105 HH22 ARG 87 2HH1 ARG 87 -10.808 -15.199 -4.667 1106 H THR 88 HN THR 88 -16.903 -18.946 -2.462 1107 HA THR 88 HA THR 88 -17.276 -21.537 -3.808 1108 HB THR 88 HB THR 88 -16.929 -22.568 -1.725 1109 HG1 THR 88 1HG THR 88 -17.322 -20.105 -0.408 1110 HG21 THR 88 3HG2 THR 88 -14.956 -21.444 -0.671 1111 HG22 THR 88 1HG2 THR 88 -15.170 -20.103 -1.814 1112 HG23 THR 88 2HG2 THR 88 -14.835 -21.726 -2.419 1113 H HIS 89 HN HIS 89 -19.308 -19.266 -1.972 1114 HA HIS 89 HA HIS 89 -21.578 -21.212 -1.959 1115 HD1 HIS 89 1HD HIS 89 -22.279 -22.079 0.215 1116 HD2 HIS 89 2HD HIS 89 -20.377 -18.645 1.742 1117 HE1 HIS 89 1HE HIS 89 -21.595 -22.616 2.629 1118 HB2 HIS 89 2HB HIS 89 -21.172 -18.448 -0.740 1119 HB3 HIS 89 3HB HIS 89 -22.741 -19.238 -0.795 1120 H THR 90 HN THR 90 -20.266 -18.521 -3.729 1121 HA THR 90 HA THR 90 -22.856 -17.843 -4.990 1122 HB THR 90 HB THR 90 -20.114 -16.623 -5.498 1123 HG1 THR 90 1HG THR 90 -20.547 -16.474 -3.304 1124 HG21 THR 90 3HG2 THR 90 -22.885 -15.430 -5.797 1125 HG22 THR 90 1HG2 THR 90 -21.721 -15.736 -7.106 1126 HG23 THR 90 2HG2 THR 90 -21.366 -14.517 -5.887 1127 H GLY 91 HN GLY 91 -20.904 -20.365 -5.537 1128 HA2 GLY 91 2HA GLY 91 -19.928 -21.463 -7.369 1129 HA3 GLY 91 3HA GLY 91 -21.459 -20.977 -8.122 1130 H GLU 92 HN GLU 92 -19.039 -18.583 -7.150 1131 HA GLU 92 HA GLU 92 -19.108 -17.563 -9.895 1132 HB2 GLU 92 2HB GLU 92 -19.317 -16.291 -7.605 1133 HB3 GLU 92 3HB GLU 92 -17.575 -16.278 -7.600 1134 HG2 GLU 92 2HG GLU 92 -19.393 -15.165 -9.780 1135 HG3 GLU 92 3HG GLU 92 -18.628 -14.218 -8.508 1136 H LYS 93 HN LYS 93 -17.837 -19.036 -11.085 1137 HA LYS 93 HA LYS 93 -14.922 -19.046 -10.435 1138 HB2 LYS 93 2HB LYS 93 -16.614 -20.929 -12.129 1139 HB3 LYS 93 3HB LYS 93 -14.861 -21.054 -11.919 1140 HG2 LYS 93 2HG LYS 93 -15.066 -21.522 -9.584 1141 HG3 LYS 93 3HG LYS 93 -16.812 -21.207 -9.591 1142 HD2 LYS 93 2HD LYS 93 -17.162 -23.121 -11.104 1143 HD3 LYS 93 3HD LYS 93 -15.426 -23.452 -11.123 1144 HE2 LYS 93 2HE LYS 93 -17.173 -23.488 -8.625 1145 HE3 LYS 93 3HE LYS 93 -16.735 -24.919 -9.570 1146 HZ1 LYS 93 3HZ LYS 93 -14.840 -23.144 -8.184 1147 HZ2 LYS 93 1HZ LYS 93 -14.423 -24.446 -9.105 1148 HZ3 LYS 93 2HZ LYS 93 -15.273 -24.657 -7.709 1149 HA PRO 94 HA PRO 94 -15.167 -16.479 -14.226 1150 HB2 PRO 94 2HB PRO 94 -13.608 -14.386 -13.483 1151 HB3 PRO 94 3HB PRO 94 -15.241 -14.619 -12.791 1152 HG2 PRO 94 2HG PRO 94 -12.571 -15.402 -11.578 1153 HG3 PRO 94 3HG PRO 94 -13.921 -14.529 -10.797 1154 HD2 PRO 94 2HD PRO 94 -13.501 -17.249 -10.595 1155 HD3 PRO 94 3HD PRO 94 -15.113 -16.495 -10.466 1156 H PHE 95 HN PHE 95 -12.381 -17.824 -12.494 1157 HA PHE 95 HA PHE 95 -10.419 -17.017 -14.536 1158 HD1 PHE 95 2HD PHE 95 -8.225 -15.959 -13.105 1159 HD2 PHE 95 1HD PHE 95 -11.005 -17.783 -10.380 1160 HE1 PHE 95 2HE PHE 95 -7.900 -14.079 -11.513 1161 HE2 PHE 95 1HE PHE 95 -10.686 -15.903 -8.782 1162 HZ PHE 95 HZ PHE 95 -9.124 -14.056 -9.347 1163 HB2 PHE 95 2HB PHE 95 -10.177 -19.026 -12.249 1164 HB3 PHE 95 3HB PHE 95 -8.866 -18.391 -13.226 1165 H SER 96 HN SER 96 -11.558 -17.916 -16.427 1166 HA SER 96 HA SER 96 -11.801 -20.826 -16.675 1167 HG SER 96 HG SER 96 -13.174 -20.406 -19.835 1168 HB2 SER 96 2HB SER 96 -13.254 -18.978 -17.801 1169 HB3 SER 96 3HB SER 96 -11.918 -18.835 -18.956 1170 H CYS 97 HN CYS 97 -10.517 -22.253 -17.803 1171 HA CYS 97 HA CYS 97 -7.764 -21.552 -18.253 1172 HB2 CYS 97 2HB CYS 97 -8.704 -23.853 -17.652 1173 HB3 CYS 97 3HB CYS 97 -9.216 -23.977 -19.334 1174 H ARG 98 HN ARG 98 -6.587 -21.905 -20.285 1175 HA ARG 98 HA ARG 98 -8.132 -21.006 -22.676 1176 HE ARG 98 HE ARG 98 -9.335 -16.392 -22.145 1177 HB2 ARG 98 2HB ARG 98 -5.580 -19.792 -21.533 1178 HB3 ARG 98 3HB ARG 98 -6.138 -19.466 -23.175 1179 HG2 ARG 98 2HG ARG 98 -7.831 -18.896 -20.699 1180 HG3 ARG 98 3HG ARG 98 -6.785 -17.712 -21.481 1181 HD2 ARG 98 2HD ARG 98 -8.025 -17.787 -23.529 1182 HD3 ARG 98 3HD ARG 98 -8.960 -19.184 -23.023 1183 HH11 ARG 98 1HH2 ARG 98 -10.405 -19.711 -21.469 1184 HH12 ARG 98 2HH2 ARG 98 -12.087 -19.208 -21.387 1185 HH21 ARG 98 1HH1 ARG 98 -11.444 -15.854 -21.672 1186 HH22 ARG 98 2HH1 ARG 98 -12.598 -17.120 -21.310 1187 H TRP 99 HN TRP 99 -6.651 -23.534 -21.530 1188 HA TRP 99 HA TRP 99 -4.520 -24.065 -23.421 1189 HD1 TRP 99 1HD TRP 99 -4.514 -23.641 -20.211 1190 HE1 TRP 99 1HE TRP 99 -2.191 -23.924 -19.182 1191 HE3 TRP 99 3HE TRP 99 -3.061 -27.867 -22.697 1192 HZ2 TRP 99 2HZ TRP 99 0.042 -25.747 -19.430 1193 HZ3 TRP 99 3HZ TRP 99 -0.801 -28.822 -22.328 1194 HH2 TRP 99 2HH TRP 99 0.757 -27.770 -20.706 1195 HB2 TRP 99 2HB TRP 99 -6.150 -25.642 -21.442 1196 HB3 TRP 99 3HB TRP 99 -5.245 -26.537 -22.632 1197 HA PRO 100 HA PRO 100 -6.335 -25.288 -27.186 1198 HB2 PRO 100 2HB PRO 100 -5.411 -28.137 -26.575 1199 HB3 PRO 100 3HB PRO 100 -5.300 -27.230 -28.116 1200 HG2 PRO 100 2HG PRO 100 -3.145 -27.383 -26.511 1201 HG3 PRO 100 3HG PRO 100 -3.595 -25.791 -27.206 1202 HD2 PRO 100 2HD PRO 100 -4.112 -26.852 -24.435 1203 HD3 PRO 100 3HD PRO 100 -3.581 -25.215 -24.938 1204 H SER 101 HN SER 101 -8.534 -25.099 -27.062 1205 HA SER 101 HA SER 101 -10.740 -25.761 -27.091 1206 HG SER 101 HG SER 101 -11.936 -28.091 -26.558 1207 HB2 SER 101 2HB SER 101 -9.848 -27.698 -28.420 1208 HB3 SER 101 3HB SER 101 -9.700 -28.636 -26.915 1209 H CYS 102 HN CYS 102 -9.051 -25.575 -24.421 1210 HA CYS 102 HA CYS 102 -10.847 -27.096 -22.609 1211 HB2 CYS 102 2HB CYS 102 -8.364 -26.908 -22.144 1212 HB3 CYS 102 3HB CYS 102 -8.589 -25.164 -21.899 1213 H GLN 103 HN GLN 103 -11.782 -25.899 -20.739 1214 HA GLN 103 HA GLN 103 -12.162 -23.075 -20.849 1215 HB2 GLN 103 2HB GLN 103 -13.789 -24.077 -22.713 1216 HB3 GLN 103 3HB GLN 103 -14.785 -24.531 -21.352 1217 HG2 GLN 103 2HG GLN 103 -15.361 -22.338 -22.452 1218 HG3 GLN 103 3HG GLN 103 -15.071 -22.221 -20.724 1219 HE21 GLN 103 1HE2 GLN 103 -12.329 -22.388 -23.156 1220 HE22 GLN 103 2HE2 GLN 103 -11.888 -20.718 -22.814 1221 H LYS 104 HN LYS 104 -11.379 -25.286 -19.036 1222 HA LYS 104 HA LYS 104 -13.515 -25.674 -17.085 1223 HB2 LYS 104 2HB LYS 104 -10.491 -26.098 -16.948 1224 HB3 LYS 104 3HB LYS 104 -11.633 -26.546 -15.665 1225 HG2 LYS 104 2HG LYS 104 -12.873 -27.987 -17.332 1226 HG3 LYS 104 3HG LYS 104 -11.629 -27.623 -18.520 1227 HD2 LYS 104 2HD LYS 104 -10.137 -28.490 -16.327 1228 HD3 LYS 104 3HD LYS 104 -11.593 -29.459 -16.194 1229 HE2 LYS 104 2HE LYS 104 -10.030 -30.722 -17.494 1230 HE3 LYS 104 3HE LYS 104 -11.283 -30.153 -18.608 1231 HZ1 LYS 104 3HZ LYS 104 -9.784 -28.402 -19.311 1232 HZ2 LYS 104 1HZ LYS 104 -9.050 -29.860 -19.501 1233 HZ3 LYS 104 2HZ LYS 104 -8.644 -28.847 -18.263 1234 H LYS 105 HN LYS 105 -14.113 -24.373 -15.472 1235 HA LYS 105 HA LYS 105 -12.630 -21.815 -15.211 1236 HB2 LYS 105 2HB LYS 105 -15.518 -22.653 -14.788 1237 HB3 LYS 105 3HB LYS 105 -14.887 -21.147 -14.116 1238 HG2 LYS 105 2HG LYS 105 -14.262 -20.292 -16.237 1239 HG3 LYS 105 3HG LYS 105 -14.621 -21.830 -17.050 1240 HD2 LYS 105 2HD LYS 105 -17.004 -21.562 -16.634 1241 HD3 LYS 105 3HD LYS 105 -16.714 -20.151 -15.603 1242 HE2 LYS 105 2HE LYS 105 -17.476 -19.417 -17.801 1243 HE3 LYS 105 3HE LYS 105 -15.809 -18.892 -17.510 1244 HZ1 LYS 105 3HZ LYS 105 -15.060 -20.760 -18.826 1245 HZ2 LYS 105 1HZ LYS 105 -16.059 -19.795 -19.714 1246 HZ3 LYS 105 2HZ LYS 105 -16.608 -21.233 -19.116 1247 H PHE 106 HN PHE 106 -11.943 -20.979 -13.312 1248 HA PHE 106 HA PHE 106 -12.424 -22.605 -10.835 1249 HD1 PHE 106 1HD PHE 106 -10.461 -24.521 -10.150 1250 HD2 PHE 106 2HD PHE 106 -9.464 -22.322 -13.722 1251 HE1 PHE 106 1HE PHE 106 -10.122 -26.652 -11.373 1252 HE2 PHE 106 2HE PHE 106 -9.184 -24.440 -14.961 1253 HZ PHE 106 HZ PHE 106 -9.553 -26.612 -13.797 1254 HB2 PHE 106 2HB PHE 106 -9.858 -21.157 -11.647 1255 HB3 PHE 106 3HB PHE 106 -10.132 -22.019 -10.139 1256 H ALA 107 HN ALA 107 -12.285 -21.407 -8.825 1257 HA ALA 107 HA ALA 107 -13.301 -18.635 -9.189 1258 HB1 ALA 107 1HB ALA 107 -14.735 -20.160 -7.891 1259 HB2 ALA 107 2HB ALA 107 -13.386 -20.545 -6.795 1260 HB3 ALA 107 3HB ALA 107 -14.091 -18.915 -6.830 1261 H ARG 108 HN ARG 108 -10.333 -19.984 -8.800 1262 HA ARG 108 HA ARG 108 -9.361 -17.601 -7.309 1263 HE ARG 108 HE ARG 108 -9.384 -19.400 -2.841 1264 HB2 ARG 108 2HB ARG 108 -8.142 -20.331 -6.792 1265 HB3 ARG 108 3HB ARG 108 -7.976 -18.841 -5.870 1266 HG2 ARG 108 2HG ARG 108 -10.280 -19.037 -5.034 1267 HG3 ARG 108 3HG ARG 108 -10.553 -20.461 -6.027 1268 HD2 ARG 108 2HD ARG 108 -10.173 -21.457 -4.046 1269 HD3 ARG 108 3HD ARG 108 -8.564 -21.530 -4.763 1270 HH11 ARG 108 1HH1 ARG 108 -6.941 -21.855 -3.652 1271 HH12 ARG 108 2HH1 ARG 108 -6.077 -21.499 -2.170 1272 HH21 ARG 108 1HH2 ARG 108 -8.208 -18.965 -1.167 1273 HH22 ARG 108 2HH2 ARG 108 -6.631 -19.693 -0.974 1274 H SER 109 HN SER 109 -7.550 -16.707 -8.153 1275 HA SER 109 HA SER 109 -6.831 -17.290 -10.814 1276 HG SER 109 HG SER 109 -5.821 -14.572 -8.225 1277 HB2 SER 109 2HB SER 109 -4.736 -15.837 -10.160 1278 HB3 SER 109 3HB SER 109 -6.334 -15.110 -10.136 1279 H ASP 110 HN ASP 110 -5.248 -18.248 -7.722 1280 HA ASP 110 HA ASP 110 -3.010 -19.556 -8.977 1281 HB2 ASP 110 2HB ASP 110 -2.596 -20.485 -6.791 1282 HB3 ASP 110 3HB ASP 110 -2.949 -18.769 -6.668 1283 H GLU 111 HN GLU 111 -6.339 -20.598 -8.099 1284 HA GLU 111 HA GLU 111 -5.935 -23.446 -8.385 1285 HB2 GLU 111 2HB GLU 111 -8.344 -21.622 -8.576 1286 HB3 GLU 111 3HB GLU 111 -8.440 -23.249 -9.195 1287 HG2 GLU 111 2HG GLU 111 -7.951 -24.223 -7.067 1288 HG3 GLU 111 3HG GLU 111 -7.708 -22.633 -6.350 1289 H LEU 112 HN LEU 112 -6.760 -20.818 -10.699 1290 HA LEU 112 HA LEU 112 -6.923 -22.525 -13.006 1291 HG LEU 112 HG LEU 112 -5.394 -20.461 -14.913 1292 HB2 LEU 112 2HB LEU 112 -7.777 -20.267 -13.026 1293 HB3 LEU 112 3HB LEU 112 -6.178 -19.576 -12.745 1294 HD11 LEU 112 1HD1 LEU 112 -6.921 -21.403 -16.500 1295 HD12 LEU 112 2HD1 LEU 112 -8.281 -21.354 -15.377 1296 HD13 LEU 112 3HD1 LEU 112 -6.895 -22.460 -15.124 1297 HD21 LEU 112 3HD2 LEU 112 -6.423 -18.197 -14.790 1298 HD22 LEU 112 1HD2 LEU 112 -7.980 -18.917 -15.276 1299 HD23 LEU 112 2HD2 LEU 112 -6.596 -18.977 -16.373 1300 H VAL 113 HN VAL 113 -4.143 -20.551 -11.690 1301 HA VAL 113 HA VAL 113 -2.163 -21.437 -13.435 1302 HB VAL 113 HB VAL 113 -1.879 -20.971 -10.426 1303 HG11 VAL 113 1HG1 VAL 113 0.245 -20.996 -12.599 1304 HG12 VAL 113 2HG1 VAL 113 0.489 -20.409 -10.940 1305 HG13 VAL 113 3HG1 VAL 113 0.122 -22.110 -11.219 1306 HG21 VAL 113 3HG2 VAL 113 -2.763 -18.978 -11.767 1307 HG22 VAL 113 1HG2 VAL 113 -1.247 -18.714 -10.897 1308 HG23 VAL 113 2HG2 VAL 113 -1.250 -19.009 -12.647 1309 H ARG 114 HN ARG 114 -3.279 -23.085 -10.445 1310 HA ARG 114 HA ARG 114 -1.505 -25.320 -10.584 1311 HE ARG 114 HE ARG 114 -2.136 -26.094 -6.760 1312 HB2 ARG 114 2HB ARG 114 -2.805 -24.776 -8.583 1313 HB3 ARG 114 3HB ARG 114 -4.324 -25.091 -9.419 1314 HG2 ARG 114 2HG ARG 114 -3.762 -27.460 -9.679 1315 HG3 ARG 114 3HG ARG 114 -2.165 -27.201 -8.961 1316 HD2 ARG 114 2HD ARG 114 -4.810 -26.688 -7.529 1317 HD3 ARG 114 3HD ARG 114 -3.904 -28.207 -7.437 1318 HH11 ARG 114 1HH1 ARG 114 -4.971 -27.663 -5.340 1319 HH12 ARG 114 2HH1 ARG 114 -4.381 -27.461 -3.719 1320 HH21 ARG 114 2HH2 ARG 114 -1.486 -25.766 -4.636 1321 HH22 ARG 114 1HH2 ARG 114 -2.584 -26.261 -3.347 1322 H HIS 115 HN HIS 115 -4.839 -24.848 -11.886 1323 HA HIS 115 HA HIS 115 -5.209 -27.428 -12.989 1324 HD1 HIS 115 1HD HIS 115 -7.180 -28.462 -14.216 1325 HD2 HIS 115 2HD HIS 115 -6.879 -24.972 -16.542 1326 HE1 HIS 115 1HE HIS 115 -7.828 -29.101 -16.594 1327 HB2 HIS 115 2HB HIS 115 -7.007 -25.802 -12.906 1328 HB3 HIS 115 3HB HIS 115 -6.174 -24.716 -14.017 1329 H HIS 116 HN HIS 116 -3.782 -24.493 -14.535 1330 HA HIS 116 HA HIS 116 -3.078 -25.696 -17.002 1331 HD1 HIS 116 1HD HIS 116 -4.784 -23.970 -17.800 1332 HD2 HIS 116 2HD HIS 116 -2.125 -21.021 -16.307 1333 HE1 HIS 116 1HE HIS 116 -5.692 -21.763 -18.475 1334 HB2 HIS 116 2HB HIS 116 -1.675 -23.512 -15.416 1335 HB3 HIS 116 3HB HIS 116 -1.306 -23.929 -17.075 1336 H ASN 117 HN ASN 117 -1.421 -25.743 -13.808 1337 HA ASN 117 HA ASN 117 1.066 -26.887 -14.825 1338 HB2 ASN 117 2HB ASN 117 0.562 -25.569 -12.599 1339 HB3 ASN 117 3HB ASN 117 0.101 -27.140 -11.953 1340 HD21 ASN 117 1HD2 ASN 117 2.150 -28.786 -13.219 1341 HD22 ASN 117 2HD2 ASN 117 3.680 -28.191 -12.523 1342 H MET 118 HN MET 118 -2.093 -28.152 -14.123 1343 HA MET 118 HA MET 118 -1.024 -30.952 -14.003 1344 HB2 MET 118 2HB MET 118 -3.754 -29.811 -13.250 1345 HB3 MET 118 3HB MET 118 -3.316 -31.522 -13.177 1346 HG2 MET 118 2HG MET 118 -1.612 -31.066 -11.486 1347 HG3 MET 118 3HG MET 118 -1.915 -29.335 -11.601 1348 HE1 MET 118 3HE MET 118 -4.801 -32.401 -9.649 1349 HE2 MET 118 1HE MET 118 -4.549 -32.387 -11.406 1350 HE3 MET 118 2HE MET 118 -3.200 -32.791 -10.315 1351 H HIS 119 HN HIS 119 -1.890 -28.794 -16.311 1352 HA HIS 119 HA HIS 119 -4.050 -30.141 -17.651 1353 HD1 HIS 119 1HD HIS 119 -4.327 -29.922 -20.608 1354 HD2 HIS 119 2HD HIS 119 -5.239 -26.583 -18.228 1355 HE1 HIS 119 1HE HIS 119 -6.757 -29.184 -21.209 1356 HB2 HIS 119 2HB HIS 119 -3.020 -27.666 -17.785 1357 HB3 HIS 119 3HB HIS 119 -2.197 -28.349 -19.186 Start of MODEL 9 1 H5 DC 124 5H C 124 -3.995 -31.367 -5.082 2 H6 DC 124 6H C 124 -5.937 -31.062 -6.551 3 H5' DC 124 H5' C 124 -8.844 -32.374 -9.853 4 H5'' DC 124 H5" C 124 -7.464 -32.387 -8.729 5 H4' DC 124 H4' C 124 -10.376 -32.417 -7.835 6 H3' DC 124 H3' C 124 -9.135 -30.205 -8.930 7 H2' DC 124 H2' C 124 -7.407 -30.006 -7.426 8 H2'' DC 124 H2" C 124 -8.616 -29.004 -6.579 9 H1' DC 124 H1' C 124 -9.417 -30.809 -5.242 10 H41 DC 124 1H4 C 124 -4.460 -32.244 -1.543 11 H42 DC 124 2H4 C 124 -3.321 -31.926 -2.837 12 H8 DG 125 8H G 125 -9.181 -26.922 -5.689 13 H1 DG 125 1H G 125 -6.463 -29.119 -0.296 14 H5' DG 125 H5' G 125 -12.987 -29.622 -6.446 15 H5'' DG 125 H5" G 125 -14.035 -28.244 -6.837 16 H4' DG 125 H4' G 125 -13.821 -28.611 -4.387 17 H3' DG 125 H3' G 125 -13.409 -26.107 -5.693 18 H2' DG 125 H2' G 125 -11.165 -25.908 -5.197 19 H2'' DG 125 H2" G 125 -11.743 -25.324 -3.606 20 H1' DG 125 H1' G 125 -11.564 -27.478 -2.634 21 H21 DG 125 1H2 G 125 -7.928 -29.299 1.269 22 H22 DG 125 2H2 G 125 -9.628 -28.953 0.989 23 H5 DC 126 5H C 126 -8.031 -23.818 -4.304 24 H6 DC 126 6H C 126 -10.006 -23.443 -2.908 25 H5' DC 126 H5' C 126 -13.566 -26.216 -1.192 26 H5'' DC 126 H5" C 126 -14.660 -25.026 -0.456 27 H4' DC 126 H4' C 126 -12.745 -25.124 0.929 28 H3' DC 126 H3' C 126 -13.298 -22.624 -0.268 29 H2' DC 126 H2' C 126 -11.410 -22.745 -1.664 30 H2'' DC 126 H2" C 126 -10.662 -21.934 -0.252 31 H1' DC 126 H1' C 126 -10.040 -24.127 0.758 32 H41 DC 126 1H4 C 126 -5.015 -25.420 -2.924 33 H42 DC 126 2H4 C 126 -5.805 -24.787 -4.348 34 H8 DG 127 8H G 127 -9.589 -21.785 1.640 35 H1 DG 127 1H G 127 -3.385 -22.963 0.714 36 H5' DG 127 H5' G 127 -12.084 -23.693 3.900 37 H5'' DG 127 H5" G 127 -12.609 -22.684 5.255 38 H4' DG 127 H4' G 127 -10.464 -23.719 5.824 39 H3' DG 127 H3' G 127 -10.690 -20.857 5.678 40 H2' DG 127 H2' G 127 -9.146 -20.524 4.032 41 H2'' DG 127 H2" G 127 -7.928 -20.781 5.321 42 H1' DG 127 H1' G 127 -7.622 -23.060 4.728 43 H21 DG 127 1H2 G 127 -2.406 -23.334 2.602 44 H22 DG 127 2H2 G 127 -3.265 -23.210 4.127 45 H8 DG 128 8H G 128 -7.504 -18.639 4.184 46 H1 DG 128 1H G 128 -2.666 -19.676 0.044 47 H5' DG 128 H5' G 128 -6.812 -21.943 7.639 48 H5'' DG 128 H5" G 128 -6.643 -21.074 9.182 49 H4' DG 128 H4' G 128 -4.551 -20.754 8.025 50 H3' DG 128 H3' G 128 -6.152 -18.506 8.561 51 H2' DG 128 H2' G 128 -6.820 -18.110 6.314 52 H2'' DG 128 H2" G 128 -5.336 -17.074 6.395 53 H1' DG 128 H1' G 128 -3.921 -18.980 5.710 54 H21 DG 128 1H2 G 128 -0.767 -19.924 1.113 55 H22 DG 128 2H2 G 128 -0.711 -19.970 2.865 56 H8 DG 129 8H G 129 -3.377 -16.426 5.631 57 H1 DG 129 1H G 129 -1.089 -16.559 -0.342 58 H5' DG 129 H5' G 129 -1.552 -18.301 8.889 59 H5'' DG 129 H5" G 129 -0.966 -17.100 10.026 60 H4' DG 129 H4' G 129 0.619 -17.276 8.215 61 H3' DG 129 H3' G 129 -0.676 -14.785 8.708 62 H2' DG 129 H2' G 129 -1.792 -14.773 6.663 63 H2'' DG 129 H2" G 129 -0.277 -14.068 6.081 64 H1' DG 129 H1' G 129 0.517 -16.220 5.292 65 H21 DG 129 1H2 G 129 1.078 -16.498 -0.307 66 H22 DG 129 2H2 G 129 1.984 -16.440 1.196 67 H8 DG 130 8H G 130 0.649 -13.458 4.217 68 H1 DG 130 1H G 130 -0.605 -12.905 -2.018 69 H5' DG 130 H5' G 130 3.082 -15.524 5.639 70 H5'' DG 130 H5" G 130 4.173 -14.577 6.662 71 H4' DG 130 H4' G 130 5.116 -14.442 4.522 72 H3' DG 130 H3' G 130 4.183 -12.092 5.779 73 H2' DG 130 H2' G 130 2.427 -11.674 4.393 74 H2'' DG 130 H2" G 130 3.643 -10.968 3.329 75 H1' DG 130 H1' G 130 3.710 -12.856 1.906 76 H21 DG 130 1H2 G 130 1.178 -12.441 -3.138 77 H22 DG 130 2H2 G 130 2.702 -12.101 -2.331 78 H8 DG 131 8H G 131 2.619 -9.544 2.411 79 H1 DG 131 1H G 131 -1.911 -9.395 -2.116 80 H5' DG 131 H5' G 131 5.874 -11.731 1.750 81 H5'' DG 131 H5" G 131 7.362 -10.771 1.848 82 H4' DG 131 H4' G 131 6.564 -10.332 -0.329 83 H3' DG 131 H3' G 131 6.587 -8.169 1.482 84 H2' DG 131 H2' G 131 4.280 -8.160 1.708 85 H2'' DG 131 H2" G 131 4.371 -7.094 0.305 86 H1' DG 131 H1' G 131 3.861 -8.901 -1.236 87 H21 DG 131 1H2 G 131 -1.075 -8.961 -4.058 88 H22 DG 131 2H2 G 131 0.642 -8.652 -4.275 89 H5 DC 132 5H C 132 1.256 -6.310 1.631 90 H6 DC 132 6H C 132 2.797 -5.629 -0.162 91 H5' DC 132 H5' C 132 5.223 -7.668 -2.733 92 H5'' DC 132 H5" C 132 6.292 -6.445 -3.461 93 H4' DC 132 H4' C 132 4.208 -6.183 -4.533 94 H3' DC 132 H3' C 132 5.205 -4.037 -2.914 95 H2' DC 132 H2' C 132 3.378 -3.895 -1.520 96 H2'' DC 132 H2" C 132 2.599 -3.115 -2.915 97 H1' DC 132 H1' C 132 1.646 -5.126 -3.684 98 H41 DC 132 1H4 C 132 -2.358 -6.603 0.967 99 H42 DC 132 2H4 C 132 -1.054 -6.867 2.125 100 H8 DG 133 8H G 133 1.228 -1.817 -3.158 101 H1 DG 133 1H G 133 -4.932 -2.743 -1.589 102 H5' DG 133 H5' G 133 2.614 -3.356 -6.531 103 H5'' DG 133 H5" G 133 3.298 -2.042 -7.490 104 H4' DG 133 H4' G 133 0.998 -2.116 -8.038 105 H3' DG 133 H3' G 133 2.073 0.177 -6.871 106 H2' DG 133 H2' G 133 1.243 -0.179 -4.752 107 H2'' DG 133 H2" G 133 -0.099 0.795 -5.364 108 H1' DG 133 H1' G 133 -1.374 -1.153 -5.962 109 H21 DG 133 1H2 G 133 -6.210 -2.309 -3.290 110 H22 DG 133 2H2 G 133 -5.569 -1.801 -4.834 111 H5' DT 134 H5' T 134 -2.536 -0.216 -7.372 112 H5'' DT 134 H5" T 134 -2.881 1.039 -8.588 113 H4' DT 134 H4' T 134 -4.795 1.063 -7.161 114 H3' DT 134 H3' T 134 -3.093 3.323 -7.335 115 H2' DT 134 H2' T 134 -2.180 3.099 -5.197 116 H2'' DT 134 H2" T 134 -3.580 4.118 -4.789 117 H1' DT 134 H1' T 134 -5.002 2.123 -4.364 118 H3 DT 134 3H T 134 -4.274 0.208 -0.330 119 H71 DT 134 1H7 T 134 0.602 1.934 -2.138 120 H72 DT 134 2H7 T 134 0.187 2.005 -0.409 121 H73 DT 134 3H7 T 134 0.521 0.435 -1.180 122 H6 DT 134 6H T 134 -1.288 2.013 -3.666 123 H5 DC 135 5H C 135 -3.604 4.889 -2.742 124 H6 DC 135 6H C 135 -5.461 5.221 -4.323 125 H5' DC 135 H5' C 135 -7.501 3.669 -7.541 126 H5'' DC 135 H5" C 135 -8.338 5.100 -8.172 127 H4' DC 135 H4' C 135 -9.623 4.222 -6.189 128 H3' DC 135 H3' C 135 -8.560 6.886 -6.381 129 H2' DC 135 H2' C 135 -7.000 6.639 -4.720 130 H2'' DC 135 H2" C 135 -8.334 7.128 -3.663 131 H1' DC 135 H1' C 135 -9.018 4.839 -3.298 132 H41 DC 135 1H4 C 135 -4.164 3.451 0.515 133 H42 DC 135 2H4 C 135 -3.021 4.046 -0.657 134 H5' DT 136 H5' T 136 -11.009 5.181 -2.625 135 H5'' DT 136 H5" T 136 -12.479 6.125 -3.015 136 H4' DT 136 H4' T 136 -12.463 5.997 -0.632 137 H3' DT 136 H3' T 136 -12.242 8.577 -1.845 138 H2' DT 136 H2' T 136 -10.133 9.003 -1.337 139 H2'' DT 136 H2" T 136 -10.673 9.520 0.213 140 H1' DT 136 H1' T 136 -10.239 7.486 1.313 141 H3 DT 136 3H T 136 -5.847 6.457 1.795 142 H71 DT 136 1H7 T 136 -6.518 8.630 -3.095 143 H72 DT 136 2H7 T 136 -5.272 9.346 -2.046 144 H73 DT 136 3H7 T 136 -5.065 7.693 -2.672 145 H6 DT 136 6H T 136 -8.422 8.306 -1.784 146 H8 DG 137 8H G 137 -9.633 10.443 1.756 147 H1 DG 137 1H G 137 -3.738 9.362 4.054 148 H5' DG 137 H5' G 137 -12.030 7.446 2.453 149 H5'' DG 137 H5" G 137 -13.521 8.180 3.028 150 H4' DG 137 H4' G 137 -12.277 7.940 4.948 151 H3' DG 137 H3' G 137 -12.944 10.536 4.199 152 H2' DG 137 H2' G 137 -10.893 11.119 3.380 153 H2'' DG 137 H2" G 137 -10.594 11.612 5.033 154 H1' DG 137 H1' G 137 -9.369 9.624 5.537 155 H21 DG 137 1H2 G 137 -3.822 8.873 6.186 156 H22 DG 137 2H2 G 137 -5.344 8.889 7.066 157 H5 DC 138 5H C 138 -8.535 12.916 4.018 158 H6 DC 138 6H C 138 -9.115 12.265 6.295 159 H5' DC 138 H5' C 138 -10.411 9.265 7.750 160 H5'' DC 138 H5" C 138 -11.304 9.883 9.144 161 H4' DC 138 H4' C 138 -9.088 9.601 9.881 162 H3' DC 138 H3' C 138 -10.357 12.105 9.923 163 H2' DC 138 H2' C 138 -9.164 13.058 8.235 164 H2'' DC 138 H2" C 138 -8.012 13.427 9.483 165 H1' DC 138 H1' C 138 -6.572 11.617 8.931 166 H41 DC 138 1H4 C 138 -5.027 13.203 2.966 167 H42 DC 138 2H4 C 138 -6.710 13.220 2.482 168 H8 DG 139 8H G 139 -6.404 14.634 9.688 169 H1 DG 139 1H G 139 -2.123 15.861 5.082 170 H5' DG 139 H5' G 139 -6.128 11.092 11.184 171 H5'' DG 139 H5" G 139 -6.214 11.409 12.923 172 H4' DG 139 H4' G 139 -3.956 11.508 12.380 173 H3' DG 139 H3' G 139 -5.183 13.676 13.562 174 H2' DG 139 H2' G 139 -5.390 14.947 11.646 175 H2'' DG 139 H2" G 139 -3.800 15.526 12.110 176 H1' DG 139 H1' G 139 -2.671 14.072 10.606 177 H21 DG 139 1H2 G 139 -0.126 15.255 5.692 178 H22 DG 139 2H2 G 139 0.195 14.639 7.307 179 H5 DC 140 5H C 140 -4.189 17.596 10.531 180 H6 DC 140 6H C 140 -2.162 16.783 11.638 181 H5' DC 140 H5' C 140 -0.716 13.351 12.150 182 H5'' DC 140 H5" C 140 0.163 13.733 13.635 183 H4' DC 140 H4' C 140 1.572 14.178 11.716 184 H3' DC 140 H3' C 140 1.239 15.999 13.781 185 H2' DC 140 H2' C 140 -0.330 17.376 12.660 186 H2'' DC 140 H2" C 140 1.163 18.181 12.114 187 H1' DC 140 H1' C 140 1.218 17.007 10.060 188 H41 DC 140 1H4 C 140 -4.063 18.986 7.133 189 H42 DC 140 2H4 C 140 -5.059 18.557 8.507 190 H8 DG 141 8H G 141 -3.482 21.554 0.865 191 H1 DG 141 1H G 141 -1.616 18.675 6.300 192 H5' DG 141 H5' G 141 -0.764 24.583 -0.597 193 H5'' DG 141 H5" G 141 -1.019 23.873 -2.195 194 H4' DG 141 H4' G 141 0.893 22.917 -0.863 195 H3' DG 141 H3' G 141 -0.819 21.485 -2.515 196 H2' DG 141 H2' G 141 -2.164 20.654 -0.834 197 H2'' DG 141 H2" G 141 -0.976 19.341 -0.806 198 H1' DG 141 H1' G 141 0.238 20.338 0.996 199 H21 DG 141 1H2 G 141 0.523 18.313 6.303 200 H22 DG 141 2H2 G 141 1.520 18.649 4.894 201 H5 DC 142 5H C 142 -2.649 17.716 0.433 202 H6 DC 142 6H C 142 -0.276 17.321 -0.004 203 H5' DC 142 H5' C 142 2.050 19.641 0.467 204 H5'' DC 142 H5" C 142 3.254 19.293 -0.754 205 H4' DC 142 H4' C 142 3.993 18.039 0.941 206 H3' DC 142 H3' C 142 3.128 16.600 -1.245 207 H2' DC 142 H2' C 142 1.101 15.913 -0.469 208 H2'' DC 142 H2" C 142 1.978 14.600 0.218 209 H1' DC 142 H1' C 142 1.947 15.519 2.397 210 H41 DC 142 1H4 C 142 -4.139 16.851 3.675 211 H42 DC 142 2H4 C 142 -4.373 17.590 2.102 212 H8 DG 143 8H G 143 1.610 13.094 1.382 213 H1 DG 143 1H G 143 -3.695 12.456 4.909 214 H5' DG 143 H5' G 143 4.173 15.407 3.243 215 H5'' DG 143 H5" G 143 5.666 14.547 2.839 216 H4' DG 143 H4' G 143 4.924 13.631 4.890 217 H3' DG 143 H3' G 143 5.349 11.976 2.695 218 H2' DG 143 H2' G 143 3.131 11.763 2.064 219 H2'' DG 143 H2" G 143 3.130 10.404 3.151 220 H1' DG 143 H1' G 143 2.080 11.608 4.916 221 H21 DG 143 1H2 G 143 -3.233 11.748 6.897 222 H22 DG 143 2H2 G 143 -1.588 11.370 7.382 223 H5 DC 144 5H C 144 0.813 9.400 1.950 224 H6 DC 144 6H C 144 1.815 8.705 4.068 225 H5' DC 144 H5' C 144 3.122 10.955 6.466 226 H5'' DC 144 H5" C 144 4.360 9.973 7.203 227 H4' DC 144 H4' C 144 2.500 9.496 8.456 228 H3' DC 144 H3' C 144 3.746 7.457 7.002 229 H2' DC 144 H2' C 144 2.189 7.139 5.358 230 H2'' DC 144 H2" C 144 1.327 6.168 6.518 231 H1' DC 144 H1' C 144 -0.206 7.835 7.085 232 H41 DC 144 1H4 C 144 -2.804 9.911 1.664 233 H42 DC 144 2H4 C 144 -1.238 10.013 0.880 234 H8 DA 145 8H A 145 -0.225 4.917 5.966 235 H2 DA 145 2H A 145 -6.268 6.338 4.427 236 H5' DA 145 H5' A 145 -0.035 7.268 9.657 237 H5'' DA 145 H5" A 145 0.128 5.946 10.828 238 H4' DA 145 H4' A 145 -2.246 6.315 10.395 239 H3' DA 145 H3' A 145 -0.995 3.804 10.148 240 H2' DA 145 H2' A 145 -0.881 3.830 7.770 241 H2'' DA 145 H2" A 145 -2.474 3.089 7.931 242 H1' DA 145 H1' A 145 -3.607 5.190 7.824 243 H61 DA 145 2H6 A 145 -1.968 5.842 1.559 244 H62 DA 145 1H6 A 145 -3.548 6.308 0.963 245 H8 DG 146 8H G 146 -3.773 1.595 7.232 246 H1 DG 146 1H G 146 -5.739 3.321 1.384 247 H5' DG 146 H5' G 146 -5.293 4.699 9.875 248 H5'' DG 146 H5" G 146 -6.463 4.457 11.156 249 H4' DG 146 H4' G 146 -7.852 3.966 9.485 250 H3' DG 146 H3' G 146 -6.830 1.468 10.424 251 H2' DG 146 H2' G 146 -5.579 0.968 8.525 252 H2'' DG 146 H2" G 146 -7.131 0.435 7.879 253 H1' DG 146 H1' G 146 -7.589 2.501 6.861 254 H21 DG 146 1H2 G 146 -7.878 3.735 1.430 255 H22 DG 146 2H2 G 146 -8.783 3.804 2.918 256 H8 DA 147 8H A 147 -6.890 -1.085 6.449 257 H2 DA 147 2H A 147 -6.463 0.378 0.228 258 H5' DA 147 H5' A 147 -10.197 1.925 7.474 259 H5'' DA 147 H5" A 147 -11.483 0.757 7.835 260 H4' DA 147 H4' A 147 -11.271 1.133 5.421 261 H3' DA 147 H3' A 147 -11.307 -1.447 6.611 262 H2' DA 147 H2' A 147 -9.069 -1.868 6.114 263 H2'' DA 147 H2" A 147 -9.754 -2.425 4.562 264 H1' DA 147 H1' A 147 -9.368 -0.260 3.516 265 H61 DA 147 2H6 A 147 -2.774 -0.569 3.811 266 H62 DA 147 1H6 A 147 -2.496 -0.139 2.117 267 H5 DC 148 5H C 148 -7.102 -3.600 3.235 268 H6 DC 148 6H C 148 -9.387 -3.417 2.399 269 H5' DC 148 H5' C 148 -12.214 -0.805 2.054 270 H5'' DC 148 H5" C 148 -13.719 -1.706 1.827 271 H4' DC 148 H4' C 148 -12.720 -1.591 -0.322 272 H3' DC 148 H3' C 148 -13.194 -4.082 0.904 273 H2' DC 148 H2' C 148 -10.967 -4.416 1.466 274 H2'' DC 148 H2" C 148 -10.890 -5.206 -0.096 275 H1' DC 148 H1' C 148 -10.174 -3.162 -1.229 276 H41 DC 148 1H4 C 148 -4.233 -3.249 0.970 277 H42 DC 148 2H4 C 148 -4.788 -3.598 2.598 278 H8 DG 149 8H G 149 -9.164 -6.863 -0.976 279 H1 DG 149 1H G 149 -2.780 -5.893 -1.124 280 H5' DG 149 H5' G 149 -10.805 -3.524 -3.120 281 H5'' DG 149 H5" G 149 -12.058 -4.237 -4.140 282 H4' DG 149 H4' G 149 -10.101 -4.461 -5.381 283 H3' DG 149 H3' G 149 -11.509 -6.734 -4.611 284 H2' DG 149 H2' G 149 -10.038 -7.353 -2.928 285 H2'' DG 149 H2" G 149 -9.253 -8.237 -4.226 286 H1' DG 149 H1' G 149 -7.578 -6.458 -4.545 287 H21 DG 149 1H2 G 149 -2.118 -5.618 -3.187 288 H22 DG 149 2H2 G 149 -3.261 -5.472 -4.508 289 H5 DC 150 5H C 150 -7.007 -9.557 -1.678 290 H6 DC 150 6H C 150 -7.177 -9.800 -4.089 291 H5' DC 150 H5' C 150 -8.247 -9.207 -5.811 292 H5'' DC 150 H5" C 150 -8.012 -7.500 -6.270 293 H4' DC 150 H4' C 150 -6.724 -8.226 -8.245 294 H3' DC 150 H3' C 150 -7.789 -10.746 -7.745 295 H2' DC 150 H2' C 150 -6.804 -11.087 -5.691 296 H2'' DC 150 H2" C 150 -5.512 -11.705 -6.651 297 H1' DC 150 H1' C 150 -4.123 -9.797 -6.319 298 H41 DC 150 1H4 C 150 -3.725 -9.259 -0.034 299 H42 DC 150 2H4 C 150 -5.467 -9.393 0.192 300 H5 DC 151 5H C 151 -5.099 -12.758 -4.357 301 H6 DC 151 6H C 151 -3.914 -12.779 -6.491 302 H5' DC 151 H5' C 151 -3.462 -10.200 -9.083 303 H5'' DC 151 H5" C 151 -3.186 -11.161 -10.550 304 H4' DC 151 H4' C 151 -1.080 -10.962 -9.465 305 H3' DC 151 H3' C 151 -2.199 -13.501 -9.903 306 H2' DC 151 H2' C 151 -2.680 -13.997 -7.725 307 H2'' DC 151 H2" C 151 -1.025 -14.543 -7.643 308 H1' DC 151 H1' C 151 -0.232 -12.482 -6.739 309 H41 DC 151 1H4 C 151 -3.243 -12.741 -1.186 310 H42 DC 151 2H4 C 151 -4.805 -12.638 -1.969 311 H5 DC 152 5H C 152 -3.178 -15.885 -5.001 312 H6 DC 152 6H C 152 -0.997 -15.975 -6.111 313 H5' DC 152 H5' C 152 1.535 -13.256 -7.419 314 H5'' DC 152 H5" C 152 2.825 -13.918 -8.440 315 H4' DC 152 H4' C 152 3.480 -14.651 -6.352 316 H3' DC 152 H3' C 152 2.469 -16.735 -8.041 317 H2' DC 152 H2' C 152 0.629 -17.216 -6.712 318 H2'' DC 152 H2" C 152 1.801 -18.169 -5.777 319 H1' DC 152 H1' C 152 2.205 -16.399 -4.215 320 H41 DC 152 1H4 C 152 -3.468 -16.306 -1.359 321 H42 DC 152 2H4 C 152 -4.302 -16.146 -2.895 322 H5 DC 153 5H C 153 -1.272 -19.645 -4.739 323 H6 DC 153 6H C 153 1.127 -20.016 -4.485 324 H5' DC 153 H5' C 153 4.479 -17.555 -4.092 325 H5'' DC 153 H5" C 153 5.887 -18.576 -4.444 326 H4' DC 153 H4' C 153 5.215 -19.190 -2.275 327 H3' DC 153 H3' C 153 4.887 -21.210 -4.300 328 H2' DC 153 H2' C 153 2.617 -21.439 -4.047 329 H2'' DC 153 H2" C 153 3.015 -22.358 -2.595 330 H1' DC 153 H1' C 153 2.756 -20.467 -1.142 331 H41 DC 153 1H4 C 153 -3.440 -19.197 -1.804 332 H42 DC 153 2H4 C 153 -3.360 -19.424 -3.542 333 H5 DC 154 5H C 154 -0.186 -22.951 -3.171 334 H6 DC 154 6H C 154 1.670 -23.517 -1.669 335 H5' DC 154 H5' C 154 4.657 -21.785 0.168 336 H5'' DC 154 H5" C 154 5.784 -23.081 0.609 337 H4' DC 154 H4' C 154 4.038 -23.107 2.225 338 H3' DC 154 H3' C 154 4.526 -25.366 0.531 339 H2' DC 154 H2' C 154 2.449 -25.342 -0.499 340 H2'' DC 154 H2" C 154 1.937 -26.131 1.019 341 H1' DC 154 H1' C 154 1.195 -24.089 1.992 342 H41 DC 154 1H4 C 154 -3.641 -22.752 -1.881 343 H42 DC 154 2H4 C 154 -2.582 -22.580 -3.266 344 H8 DG 155 8H G 155 0.572 -27.661 0.945 345 H1 DG 155 1H G 155 -5.462 -25.814 -0.283 346 H5' DG 155 H5' G 155 2.324 -25.557 4.566 347 H5'' DG 155 H5" G 155 2.772 -26.948 5.576 348 H4' DG 155 H4' G 155 0.401 -26.464 5.850 349 H3' DG 155 H3' G 155 1.403 -28.982 5.032 350 H2' DG 155 H2' G 155 0.537 -28.896 2.894 351 H2'' DG 155 H2" G 155 -0.919 -29.525 3.722 352 H1' DG 155 H1' G 155 -1.823 -27.342 4.014 353 H21 DG 155 1H2 G 155 -6.675 -25.918 1.534 354 H22 DG 155 2H2 G 155 -5.971 -26.332 3.091 355 H5 DC 156 5H C 156 -1.616 -30.641 1.070 356 H6 DC 156 6H C 156 -2.462 -30.933 3.354 357 H5' DC 156 H5' C 156 -2.732 -28.693 6.946 358 H5'' DC 156 H5" C 156 -3.055 -29.971 8.124 359 H4' DC 156 H4' C 156 -5.139 -29.384 7.015 360 H3' DC 156 H3' C 156 -3.991 -32.015 6.984 361 H2' DC 156 H2' C 156 -3.664 -32.121 4.707 362 H2'' DC 156 H2" C 156 -5.414 -32.470 4.692 363 H1' DC 156 H1' C 156 -6.037 -30.244 4.300 364 H41 DC 156 1H4 C 156 -3.816 -29.284 -1.564 365 H42 DC 156 2H4 C 156 -2.180 -29.700 -1.097 366 H8 DG 157 8H G 157 -6.361 -34.872 4.635 367 H1 DG 157 1H G 157 -6.893 -32.220 -1.172 368 H5' DG 157 H5' G 157 -8.705 -31.495 7.257 369 H5'' DG 157 H5" G 157 -9.546 -32.679 8.276 370 H4' DG 157 H4' G 157 -10.766 -32.298 6.153 371 H3' DG 157 H3' G 157 -10.201 -34.849 7.127 372 H2' DG 157 H2' G 157 -8.288 -35.208 5.718 373 H2'' DG 157 H2" G 157 -9.571 -35.911 4.675 374 H1' DG 157 H1' G 157 -9.930 -33.828 3.543 375 H21 DG 157 1H2 G 157 -8.957 -31.746 -1.567 376 H22 DG 157 2H2 G 157 -10.175 -31.833 -0.310 377 HA ALA 1 HA ALA 1 23.466 23.764 -11.676 378 H1 ALA 1 HN ALA 1 22.573 25.741 -10.445 379 HB1 ALA 1 1HB ALA 1 25.633 22.818 -10.932 380 HB2 ALA 1 2HB ALA 1 25.825 24.485 -11.510 381 HB3 ALA 1 3HB ALA 1 25.817 24.147 -9.766 382 H SER 2 HN SER 2 22.980 24.750 -8.389 383 HA SER 2 HA SER 2 22.744 22.155 -7.140 384 HG SER 2 HG SER 2 21.145 25.587 -6.923 385 HB2 SER 2 2HB SER 2 21.131 23.675 -5.603 386 HB3 SER 2 3HB SER 2 22.891 23.769 -5.541 387 H GLU 3 HN GLU 3 20.767 23.890 -9.394 388 HA GLU 3 HA GLU 3 18.201 22.862 -8.494 389 HB2 GLU 3 2HB GLU 3 19.001 24.213 -11.113 390 HB3 GLU 3 3HB GLU 3 17.352 23.947 -10.558 391 HG2 GLU 3 2HG GLU 3 17.975 26.259 -10.176 392 HG3 GLU 3 3HG GLU 3 17.699 25.437 -8.639 393 H LYS 4 HN LYS 4 20.735 21.323 -10.114 394 HA LYS 4 HA LYS 4 19.339 19.946 -12.219 395 HB2 LYS 4 2HB LYS 4 21.909 19.314 -10.711 396 HB3 LYS 4 3HB LYS 4 21.316 18.346 -12.065 397 HG2 LYS 4 2HG LYS 4 21.282 20.372 -13.508 398 HG3 LYS 4 3HG LYS 4 21.979 21.324 -12.195 399 HD2 LYS 4 2HD LYS 4 23.295 18.905 -13.516 400 HD3 LYS 4 3HD LYS 4 23.646 20.601 -13.886 401 HE2 LYS 4 2HE LYS 4 24.338 20.963 -11.521 402 HE3 LYS 4 3HE LYS 4 24.057 19.246 -11.194 403 HZ1 LYS 4 3HZ LYS 4 26.368 19.698 -11.671 404 HZ2 LYS 4 1HZ LYS 4 25.986 20.315 -13.148 405 HZ3 LYS 4 2HZ LYS 4 25.731 18.720 -12.834 406 H ARG 5 HN ARG 5 19.017 19.619 -8.840 407 HA ARG 5 HA ARG 5 17.268 17.301 -9.302 408 HE ARG 5 HE ARG 5 22.052 16.756 -7.461 409 HB2 ARG 5 2HB ARG 5 18.072 15.900 -7.622 410 HB3 ARG 5 3HB ARG 5 19.445 16.279 -8.618 411 HG2 ARG 5 2HG ARG 5 18.942 17.015 -5.721 412 HG3 ARG 5 3HG ARG 5 20.162 15.982 -6.395 413 HD2 ARG 5 2HD ARG 5 20.091 18.953 -6.967 414 HD3 ARG 5 3HD ARG 5 20.932 18.247 -5.587 415 HH11 ARG 5 1HH1 ARG 5 21.445 20.203 -7.631 416 HH12 ARG 5 2HH1 ARG 5 22.804 20.490 -8.709 417 HH21 ARG 5 2HH2 ARG 5 23.869 17.195 -8.681 418 HH22 ARG 5 1HH2 ARG 5 24.226 18.858 -9.099 419 HA PRO 6 HA PRO 6 15.453 20.750 -6.800 420 HB2 PRO 6 2HB PRO 6 12.984 19.469 -8.012 421 HB3 PRO 6 3HB PRO 6 13.394 21.196 -7.855 422 HG2 PRO 6 2HG PRO 6 13.616 19.935 -10.237 423 HG3 PRO 6 3HG PRO 6 14.897 21.073 -9.703 424 HD2 PRO 6 2HD PRO 6 14.897 18.046 -9.544 425 HD3 PRO 6 3HD PRO 6 16.186 19.152 -10.101 426 H PHE 7 HN PHE 7 13.730 17.590 -7.182 427 HA PHE 7 HA PHE 7 13.440 17.494 -4.188 428 HD1 PHE 7 1HD PHE 7 10.790 18.554 -3.600 429 HD2 PHE 7 2HD PHE 7 10.984 17.751 -7.827 430 HE1 PHE 7 1HE PHE 7 9.491 20.616 -4.060 431 HE2 PHE 7 2HE PHE 7 9.704 19.827 -8.284 432 HZ PHE 7 HZ PHE 7 8.978 21.277 -6.399 433 HB2 PHE 7 2HB PHE 7 11.727 16.120 -6.283 434 HB3 PHE 7 3HB PHE 7 11.392 16.240 -4.564 435 H MET 8 HN MET 8 13.605 15.457 -3.123 436 HA MET 8 HA MET 8 14.461 13.155 -4.765 437 HB2 MET 8 2HB MET 8 16.264 12.507 -3.325 438 HB3 MET 8 3HB MET 8 16.564 14.148 -3.906 439 HG2 MET 8 2HG MET 8 15.866 15.097 -1.782 440 HG3 MET 8 3HG MET 8 15.502 13.493 -1.141 441 HE1 MET 8 3HE MET 8 17.696 11.546 -1.828 442 HE2 MET 8 1HE MET 8 18.911 11.833 -0.564 443 HE3 MET 8 2HE MET 8 17.181 11.852 -0.156 444 H CYS 9 HN CYS 9 14.020 11.141 -3.841 445 HA CYS 9 HA CYS 9 11.839 11.092 -1.888 446 HB2 CYS 9 2HB CYS 9 12.083 9.380 -3.681 447 HB3 CYS 9 3HB CYS 9 13.591 8.822 -2.956 448 H ALA 10 HN ALA 10 12.076 9.663 0.119 449 HA ALA 10 HA ALA 10 14.689 10.230 1.483 450 HB1 ALA 10 1HB ALA 10 13.403 10.490 3.581 451 HB2 ALA 10 2HB ALA 10 12.879 11.666 2.359 452 HB3 ALA 10 3HB ALA 10 11.885 10.229 2.693 453 H TYR 11 HN TYR 11 12.311 7.875 0.541 454 HA TYR 11 HA TYR 11 12.671 5.940 2.572 455 HD1 TYR 11 1HD TYR 11 10.219 4.677 2.793 456 HD2 TYR 11 2HD TYR 11 12.560 3.067 -0.440 457 HE1 TYR 11 1HE TYR 11 9.659 2.366 3.545 458 HE2 TYR 11 2HE TYR 11 11.993 0.747 0.318 459 HH TYR 11 HH TYR 11 9.723 0.045 2.885 460 HB2 TYR 11 2HB TYR 11 10.912 6.029 0.756 461 HB3 TYR 11 3HB TYR 11 12.123 5.397 -0.352 462 HA PRO 12 HA PRO 12 16.934 4.779 2.149 463 HB2 PRO 12 2HB PRO 12 15.805 2.093 3.021 464 HB3 PRO 12 3HB PRO 12 17.271 2.934 3.608 465 HG2 PRO 12 2HG PRO 12 14.991 3.030 5.055 466 HG3 PRO 12 3HG PRO 12 15.962 4.521 4.826 467 HD2 PRO 12 2HD PRO 12 13.413 3.704 3.431 468 HD3 PRO 12 3HD PRO 12 13.964 5.317 4.004 469 H GLY 13 HN GLY 13 14.448 2.498 0.865 470 HA2 GLY 13 2HA GLY 13 16.318 1.200 -0.943 471 HA3 GLY 13 3HA GLY 13 14.562 0.970 -0.891 472 H CYS 14 HN CYS 14 15.322 4.285 -1.153 473 HA CYS 14 HA CYS 14 15.260 4.245 -4.136 474 HB2 CYS 14 2HB CYS 14 12.952 4.404 -3.429 475 HB3 CYS 14 3HB CYS 14 13.319 5.701 -2.291 476 H ASN 15 HN ASN 15 14.662 7.011 -1.973 477 HA ASN 15 HA ASN 15 15.802 8.994 -1.665 478 HB2 ASN 15 2HB ASN 15 18.470 7.769 -2.356 479 HB3 ASN 15 3HB ASN 15 18.065 8.937 -1.120 480 HD21 ASN 15 1HD2 ASN 15 18.105 5.574 -1.992 481 HD22 ASN 15 2HD2 ASN 15 18.011 4.899 -0.353 482 H LYS 16 HN LYS 16 14.952 8.006 -4.453 483 HA LYS 16 HA LYS 16 17.007 8.969 -6.296 484 HB2 LYS 16 2HB LYS 16 14.105 8.128 -6.732 485 HB3 LYS 16 3HB LYS 16 15.243 8.486 -8.028 486 HG2 LYS 16 2HG LYS 16 16.710 6.637 -7.348 487 HG3 LYS 16 3HG LYS 16 15.664 6.275 -5.982 488 HD2 LYS 16 2HD LYS 16 13.767 6.052 -7.838 489 HD3 LYS 16 3HD LYS 16 15.151 5.871 -8.928 490 HE2 LYS 16 2HE LYS 16 14.741 3.648 -8.332 491 HE3 LYS 16 3HE LYS 16 15.972 4.107 -7.140 492 HZ1 LYS 16 3HZ LYS 16 13.056 3.956 -6.742 493 HZ2 LYS 16 1HZ LYS 16 14.047 4.676 -5.664 494 HZ3 LYS 16 2HZ LYS 16 14.220 3.063 -5.979 495 H ARG 17 HN ARG 17 16.510 10.567 -7.999 496 HA ARG 17 HA ARG 17 15.484 12.955 -6.593 497 HE ARG 17 HE ARG 17 19.891 14.375 -5.482 498 HB2 ARG 17 2HB ARG 17 17.107 12.748 -9.181 499 HB3 ARG 17 3HB ARG 17 16.775 14.202 -8.253 500 HG2 ARG 17 2HG ARG 17 18.574 11.863 -7.458 501 HG3 ARG 17 3HG ARG 17 19.041 13.523 -7.835 502 HD2 ARG 17 2HD ARG 17 17.564 14.208 -5.836 503 HD3 ARG 17 3HD ARG 17 17.581 12.495 -5.378 504 HH11 ARG 17 1HH2 ARG 17 18.787 11.174 -4.227 505 HH12 ARG 17 2HH2 ARG 17 20.248 11.073 -3.302 506 HH21 ARG 17 1HH1 ARG 17 21.599 14.075 -4.195 507 HH22 ARG 17 2HH1 ARG 17 21.737 12.612 -3.249 508 H TYR 18 HN TYR 18 13.740 14.025 -7.156 509 HA TYR 18 HA TYR 18 12.373 13.355 -9.731 510 HD1 TYR 18 2HD TYR 18 12.205 12.005 -6.050 511 HD2 TYR 18 1HD TYR 18 9.509 12.046 -9.422 512 HE1 TYR 18 2HE TYR 18 11.919 9.553 -5.890 513 HE2 TYR 18 1HE TYR 18 9.353 9.595 -9.330 514 HH TYR 18 HH TYR 18 10.928 7.708 -6.798 515 HB2 TYR 18 2HB TYR 18 11.320 14.146 -6.999 516 HB3 TYR 18 3HB TYR 18 10.327 14.155 -8.443 517 H PHE 19 HN PHE 19 11.109 15.110 -10.706 518 HA PHE 19 HA PHE 19 12.493 17.748 -10.299 519 HD1 PHE 19 1HD PHE 19 13.223 14.544 -12.407 520 HD2 PHE 19 2HD PHE 19 14.273 18.729 -12.541 521 HE1 PHE 19 1HE PHE 19 15.623 13.942 -12.536 522 HE2 PHE 19 2HE PHE 19 16.674 18.114 -12.683 523 HZ PHE 19 HZ PHE 19 17.354 15.733 -12.672 524 HB2 PHE 19 2HB PHE 19 11.481 16.338 -12.803 525 HB3 PHE 19 3HB PHE 19 11.962 18.033 -12.778 526 H LYS 20 HN LYS 20 9.472 16.174 -10.088 527 HA LYS 20 HA LYS 20 8.067 18.818 -10.182 528 HB2 LYS 20 2HB LYS 20 7.318 16.189 -11.410 529 HB3 LYS 20 3HB LYS 20 6.002 17.171 -10.694 530 HG2 LYS 20 2HG LYS 20 6.700 19.071 -12.104 531 HG3 LYS 20 3HG LYS 20 8.021 18.099 -12.782 532 HD2 LYS 20 2HD LYS 20 6.370 16.493 -13.706 533 HD3 LYS 20 3HD LYS 20 5.044 17.463 -13.028 534 HE2 LYS 20 2HE LYS 20 5.774 19.405 -14.391 535 HE3 LYS 20 3HE LYS 20 7.097 18.440 -15.064 536 HZ1 LYS 20 3HZ LYS 20 5.457 16.952 -15.996 537 HZ2 LYS 20 1HZ LYS 20 5.202 18.489 -16.528 538 HZ3 LYS 20 2HZ LYS 20 4.224 17.847 -15.370 539 H LEU 21 HN LEU 21 6.862 19.319 -8.437 540 HA LEU 21 HA LEU 21 7.367 17.951 -5.984 541 HG LEU 21 HG LEU 21 4.593 18.944 -4.610 542 HB2 LEU 21 2HB LEU 21 6.829 20.346 -6.107 543 HB3 LEU 21 3HB LEU 21 5.222 19.988 -6.723 544 HD11 LEU 21 1HD1 LEU 21 6.016 19.086 -2.604 545 HD12 LEU 21 2HD1 LEU 21 7.365 19.681 -3.589 546 HD13 LEU 21 3HD1 LEU 21 6.738 18.029 -3.815 547 HD21 LEU 21 3HD2 LEU 21 5.916 21.671 -4.238 548 HD22 LEU 21 1HD2 LEU 21 4.640 20.988 -3.209 549 HD23 LEU 21 2HD2 LEU 21 4.290 21.374 -4.899 550 H SER 22 HN SER 22 4.386 18.113 -8.016 551 HA SER 22 HA SER 22 2.831 16.324 -6.392 552 HG SER 22 HG SER 22 1.966 17.658 -10.129 553 HB2 SER 22 2HB SER 22 1.358 16.223 -8.447 554 HB3 SER 22 3HB SER 22 1.709 17.854 -7.844 555 H HIS 23 HN HIS 23 5.101 15.802 -9.005 556 HA HIS 23 HA HIS 23 4.172 13.082 -9.633 557 HD1 HIS 23 1HD HIS 23 7.243 12.666 -12.830 558 HD2 HIS 23 2HD HIS 23 8.460 14.623 -9.349 559 HE1 HIS 23 1HE HIS 23 9.762 13.020 -13.028 560 HB2 HIS 23 2HB HIS 23 5.372 13.297 -11.388 561 HB3 HIS 23 3HB HIS 23 5.666 14.917 -11.019 562 H LEU 24 HN LEU 24 6.947 14.578 -7.871 563 HA LEU 24 HA LEU 24 7.816 12.185 -6.643 564 HG LEU 24 HG LEU 24 10.282 14.040 -4.864 565 HB2 LEU 24 2HB LEU 24 9.034 14.325 -6.683 566 HB3 LEU 24 3HB LEU 24 7.904 15.030 -5.590 567 HD11 LEU 24 1HD1 LEU 24 8.824 15.378 -3.446 568 HD12 LEU 24 2HD1 LEU 24 9.520 14.019 -2.547 569 HD13 LEU 24 3HD1 LEU 24 7.827 13.951 -3.084 570 HD21 LEU 24 3HD2 LEU 24 10.406 11.950 -3.949 571 HD22 LEU 24 1HD2 LEU 24 9.402 11.590 -5.357 572 HD23 LEU 24 2HD2 LEU 24 8.678 11.764 -3.750 573 H GLN 25 HN GLN 25 5.293 14.522 -5.586 574 HA GLN 25 HA GLN 25 4.759 13.436 -3.031 575 HB2 GLN 25 2HB GLN 25 3.769 15.519 -3.664 576 HB3 GLN 25 3HB GLN 25 3.051 14.788 -5.093 577 HG2 GLN 25 2HG GLN 25 1.408 13.576 -3.728 578 HG3 GLN 25 3HG GLN 25 2.073 14.344 -2.279 579 HE21 GLN 25 1HE2 GLN 25 -0.362 15.184 -2.162 580 HE22 GLN 25 2HE2 GLN 25 -0.579 16.656 -3.141 581 H MET 26 HN MET 26 3.360 12.558 -6.243 582 HA MET 26 HA MET 26 1.714 10.421 -5.253 583 HB2 MET 26 2HB MET 26 1.474 11.486 -7.499 584 HB3 MET 26 3HB MET 26 2.994 10.745 -8.015 585 HG2 MET 26 2HG MET 26 1.022 9.449 -8.767 586 HG3 MET 26 3HG MET 26 2.037 8.503 -7.686 587 HE1 MET 26 3HE MET 26 0.251 6.644 -7.199 588 HE2 MET 26 1HE MET 26 -1.449 6.981 -6.816 589 HE3 MET 26 2HE MET 26 -0.797 7.424 -8.407 590 H HIS 27 HN HIS 27 5.116 10.537 -6.477 591 HA HIS 27 HA HIS 27 5.644 7.753 -6.414 592 HD1 HIS 27 1HD HIS 27 7.920 6.384 -6.771 593 HD2 HIS 27 2HD HIS 27 9.384 9.505 -4.335 594 HE1 HIS 27 1HE HIS 27 9.801 5.402 -5.298 595 HB2 HIS 27 2HB HIS 27 7.291 9.211 -7.412 596 HB3 HIS 27 3HB HIS 27 7.471 10.161 -5.937 597 H SER 28 HN SER 28 5.769 10.200 -3.795 598 HA SER 28 HA SER 28 6.936 8.607 -1.792 599 HG SER 28 HG SER 28 4.013 10.969 -1.953 600 HB2 SER 28 2HB SER 28 6.218 10.239 -0.278 601 HB3 SER 28 3HB SER 28 6.270 11.151 -1.797 602 H ARG 29 HN ARG 29 3.575 8.685 -3.001 603 HA ARG 29 HA ARG 29 2.285 7.320 -0.851 604 HE ARG 29 HE ARG 29 -1.025 8.855 -4.238 605 HB2 ARG 29 2HB ARG 29 1.287 8.474 -2.952 606 HB3 ARG 29 3HB ARG 29 1.555 6.930 -3.779 607 HG2 ARG 29 2HG ARG 29 0.189 5.785 -2.013 608 HG3 ARG 29 3HG ARG 29 -0.082 7.339 -1.225 609 HD2 ARG 29 2HD ARG 29 -0.997 6.551 -4.024 610 HD3 ARG 29 3HD ARG 29 -2.022 6.648 -2.592 611 HH11 ARG 29 1HH2 ARG 29 -2.645 8.138 -1.136 612 HH12 ARG 29 2HH2 ARG 29 -3.031 9.808 -0.906 613 HH21 ARG 29 2HH1 ARG 29 -1.669 10.911 -3.862 614 HH22 ARG 29 1HH1 ARG 29 -2.514 11.319 -2.383 615 H LYS 30 HN LYS 30 4.229 6.132 -3.614 616 HA LYS 30 HA LYS 30 3.547 3.346 -3.394 617 HB2 LYS 30 2HB LYS 30 4.759 4.381 -5.309 618 HB3 LYS 30 3HB LYS 30 6.192 4.607 -4.301 619 HG2 LYS 30 2HG LYS 30 5.019 1.837 -4.500 620 HG3 LYS 30 3HG LYS 30 5.858 2.488 -5.904 621 HD2 LYS 30 2HD LYS 30 7.939 2.704 -4.740 622 HD3 LYS 30 3HD LYS 30 7.195 2.453 -3.168 623 HE2 LYS 30 2HE LYS 30 8.316 0.422 -3.753 624 HE3 LYS 30 3HE LYS 30 6.581 0.135 -3.788 625 HZ1 LYS 30 3HZ LYS 30 6.678 0.429 -6.200 626 HZ2 LYS 30 1HZ LYS 30 7.618 -0.820 -5.699 627 HZ3 LYS 30 2HZ LYS 30 8.316 0.613 -6.130 628 H HIS 31 HN HIS 31 5.914 5.414 -1.660 629 HA HIS 31 HA HIS 31 7.184 3.087 -0.411 630 HD1 HIS 31 1HD HIS 31 9.267 2.647 -0.890 631 HD2 HIS 31 2HD HIS 31 9.501 6.735 -1.843 632 HE1 HIS 31 1HE HIS 31 11.127 2.879 -2.620 633 HB2 HIS 31 2HB HIS 31 7.556 6.090 -0.170 634 HB3 HIS 31 3HB HIS 31 8.349 4.954 0.935 635 H THR 32 HN THR 32 4.775 5.613 0.640 636 HA THR 32 HA THR 32 4.369 4.773 3.210 637 HB THR 32 HB THR 32 2.087 5.386 3.075 638 HG1 THR 32 1HG THR 32 2.161 4.992 0.250 639 HG21 THR 32 3HG2 THR 32 3.571 7.105 1.076 640 HG22 THR 32 1HG2 THR 32 3.483 7.304 2.833 641 HG23 THR 32 2HG2 THR 32 2.034 7.493 1.826 642 H GLY 33 HN GLY 33 3.509 2.958 0.272 643 HA2 GLY 33 2HA GLY 33 2.199 0.804 1.777 644 HA3 GLY 33 3HA GLY 33 2.521 0.841 0.042 645 H GLU 34 HN GLU 34 5.320 1.719 1.713 646 HA GLU 34 HA GLU 34 6.355 -1.088 1.723 647 HB2 GLU 34 2HB GLU 34 7.020 0.752 -0.187 648 HB3 GLU 34 3HB GLU 34 8.202 1.175 1.032 649 HG2 GLU 34 2HG GLU 34 9.291 -0.401 -0.328 650 HG3 GLU 34 3HG GLU 34 8.780 -1.382 1.050 651 H LYS 35 HN LYS 35 5.413 1.132 3.821 652 HA LYS 35 HA LYS 35 7.695 1.966 5.317 653 HB2 LYS 35 2HB LYS 35 5.296 2.819 5.464 654 HB3 LYS 35 3HB LYS 35 4.903 1.370 6.350 655 HG2 LYS 35 2HG LYS 35 5.225 2.995 8.024 656 HG3 LYS 35 3HG LYS 35 6.687 2.027 8.056 657 HD2 LYS 35 2HD LYS 35 7.519 4.164 8.239 658 HD3 LYS 35 3HD LYS 35 7.703 3.909 6.510 659 HE2 LYS 35 2HE LYS 35 5.356 5.356 7.837 660 HE3 LYS 35 3HE LYS 35 6.800 6.166 7.213 661 HZ1 LYS 35 3HZ LYS 35 6.266 5.283 5.031 662 HZ2 LYS 35 1HZ LYS 35 5.065 6.251 5.614 663 HZ3 LYS 35 2HZ LYS 35 4.881 4.612 5.623 664 HA PRO 36 HA PRO 36 8.669 -2.162 6.770 665 HB2 PRO 36 2HB PRO 36 11.117 -1.644 7.900 666 HB3 PRO 36 3HB PRO 36 10.837 -1.615 6.140 667 HG2 PRO 36 2HG PRO 36 10.884 0.757 8.034 668 HG3 PRO 36 3HG PRO 36 11.747 0.562 6.474 669 HD2 PRO 36 2HD PRO 36 9.358 1.873 6.683 670 HD3 PRO 36 3HD PRO 36 9.790 0.903 5.239 671 H TYR 37 HN TYR 37 7.030 -2.474 8.319 672 HA TYR 37 HA TYR 37 7.627 -1.563 11.130 673 HD1 TYR 37 2HD TYR 37 4.670 -1.239 8.360 674 HD2 TYR 37 1HD TYR 37 5.090 -0.497 12.587 675 HE1 TYR 37 2HE TYR 37 3.398 0.907 8.129 676 HE2 TYR 37 1HE TYR 37 3.774 1.596 12.363 677 HH TYR 37 HH TYR 37 2.894 3.152 10.750 678 HB2 TYR 37 2HB TYR 37 5.223 -3.070 9.980 679 HB3 TYR 37 3HB TYR 37 5.494 -2.646 11.665 680 H GLN 38 HN GLN 38 7.460 -3.269 12.843 681 HA GLN 38 HA GLN 38 8.011 -6.031 11.895 682 HB2 GLN 38 2HB GLN 38 9.707 -6.419 13.457 683 HB3 GLN 38 3HB GLN 38 10.211 -5.014 12.539 684 HG2 GLN 38 2HG GLN 38 10.210 -3.637 14.393 685 HG3 GLN 38 3HG GLN 38 8.846 -4.434 15.171 686 HE21 GLN 38 1HE2 GLN 38 9.190 -6.531 16.356 687 HE22 GLN 38 2HE2 GLN 38 10.881 -6.902 16.782 688 H CYS 39 HN CYS 39 7.295 -7.660 13.319 689 HA CYS 39 HA CYS 39 4.957 -7.169 14.723 690 HB2 CYS 39 2HB CYS 39 6.376 -9.428 14.109 691 HB3 CYS 39 3HB CYS 39 6.569 -9.377 15.880 692 H ASP 40 HN ASP 40 4.342 -7.045 16.914 693 HA ASP 40 HA ASP 40 6.324 -5.477 18.484 694 HB2 ASP 40 2HB ASP 40 4.339 -4.565 19.629 695 HB3 ASP 40 3HB ASP 40 4.219 -4.379 17.887 696 H PHE 41 HN PHE 41 5.302 -8.666 18.437 697 HA PHE 41 HA PHE 41 4.713 -9.064 21.242 698 HD1 PHE 41 1HD PHE 41 2.526 -10.997 21.351 699 HD2 PHE 41 2HD PHE 41 4.077 -10.275 17.448 700 HE1 PHE 41 1HE PHE 41 0.212 -10.562 20.532 701 HE2 PHE 41 2HE PHE 41 1.804 -9.686 16.612 702 HZ PHE 41 HZ PHE 41 -0.149 -9.833 18.176 703 HB2 PHE 41 2HB PHE 41 5.508 -11.027 19.045 704 HB3 PHE 41 3HB PHE 41 4.934 -11.482 20.640 705 H LYS 42 HN LYS 42 5.963 -10.245 22.772 706 HA LYS 42 HA LYS 42 8.837 -9.726 22.765 707 HB2 LYS 42 2HB LYS 42 8.800 -11.010 24.889 708 HB3 LYS 42 3HB LYS 42 7.562 -9.751 24.873 709 HG2 LYS 42 2HG LYS 42 5.807 -11.379 24.394 710 HG3 LYS 42 3HG LYS 42 7.003 -12.661 24.149 711 HD2 LYS 42 2HD LYS 42 7.616 -12.628 26.504 712 HD3 LYS 42 3HD LYS 42 6.538 -11.251 26.796 713 HE2 LYS 42 2HE LYS 42 5.475 -13.352 27.505 714 HE3 LYS 42 3HE LYS 42 4.580 -12.597 26.178 715 HZ1 LYS 42 3HZ LYS 42 4.849 -14.970 25.870 716 HZ2 LYS 42 1HZ LYS 42 6.490 -14.821 25.866 717 HZ3 LYS 42 2HZ LYS 42 5.595 -14.139 24.661 718 H ASP 43 HN ASP 43 7.041 -11.888 21.003 719 HA ASP 43 HA ASP 43 9.207 -13.936 20.956 720 HB2 ASP 43 2HB ASP 43 7.352 -15.699 20.872 721 HB3 ASP 43 3HB ASP 43 7.609 -14.903 22.410 722 H CYS 44 HN CYS 44 8.016 -11.644 19.129 723 HA CYS 44 HA CYS 44 8.184 -13.321 16.691 724 HB2 CYS 44 2HB CYS 44 5.773 -12.779 17.125 725 HB3 CYS 44 3HB CYS 44 6.150 -11.066 16.920 726 H GLU 45 HN GLU 45 8.917 -12.178 14.817 727 HA GLU 45 HA GLU 45 10.023 -9.468 15.201 728 HB2 GLU 45 2HB GLU 45 11.755 -11.908 14.599 729 HB3 GLU 45 3HB GLU 45 12.306 -10.262 14.363 730 HG2 GLU 45 2HG GLU 45 11.573 -11.498 17.038 731 HG3 GLU 45 3HG GLU 45 13.185 -11.221 16.410 732 H ARG 46 HN ARG 46 7.945 -10.944 13.522 733 HA ARG 46 HA ARG 46 9.055 -11.113 10.813 734 HE ARG 46 HE ARG 46 7.152 -13.392 13.245 735 HB2 ARG 46 2HB ARG 46 6.392 -11.569 12.131 736 HB3 ARG 46 3HB ARG 46 6.340 -11.016 10.473 737 HG2 ARG 46 2HG ARG 46 6.268 -13.457 10.611 738 HG3 ARG 46 3HG ARG 46 7.597 -12.839 9.640 739 HD2 ARG 46 2HD ARG 46 8.328 -14.757 10.904 740 HD3 ARG 46 3HD ARG 46 9.193 -13.323 11.473 741 HH11 ARG 46 1HH1 ARG 46 9.259 -16.068 12.322 742 HH12 ARG 46 2HH1 ARG 46 9.078 -16.798 13.909 743 HH21 ARG 46 2HH2 ARG 46 7.053 -14.274 15.101 744 HH22 ARG 46 1HH2 ARG 46 7.855 -15.789 15.519 745 H ARG 47 HN ARG 47 9.098 -9.567 9.285 746 HA ARG 47 HA ARG 47 8.283 -6.853 10.127 747 HE ARG 47 HE ARG 47 12.962 -5.976 10.839 748 HB2 ARG 47 2HB ARG 47 10.182 -7.986 8.056 749 HB3 ARG 47 3HB ARG 47 9.522 -6.377 7.823 750 HG2 ARG 47 2HG ARG 47 11.661 -6.169 8.831 751 HG3 ARG 47 3HG ARG 47 10.428 -5.607 9.955 752 HD2 ARG 47 2HD ARG 47 10.607 -7.710 11.221 753 HD3 ARG 47 3HD ARG 47 11.850 -8.301 10.097 754 HH11 ARG 47 2HH2 ARG 47 11.596 -8.433 12.965 755 HH12 ARG 47 1HH2 ARG 47 12.249 -7.651 14.406 756 HH21 ARG 47 1HH1 ARG 47 13.804 -5.093 12.684 757 HH22 ARG 47 2HH1 ARG 47 13.235 -5.725 14.221 758 H PHE 48 HN PHE 48 7.070 -5.462 8.785 759 HA PHE 48 HA PHE 48 5.550 -6.738 6.556 760 HD1 PHE 48 1HD PHE 48 3.093 -7.906 6.692 761 HD2 PHE 48 2HD PHE 48 4.764 -6.967 10.566 762 HE1 PHE 48 1HE PHE 48 2.977 -10.285 7.327 763 HE2 PHE 48 2HE PHE 48 4.639 -9.353 11.201 764 HZ PHE 48 HZ PHE 48 3.885 -11.026 9.515 765 HB2 PHE 48 2HB PHE 48 4.359 -5.200 8.907 766 HB3 PHE 48 3HB PHE 48 3.477 -5.558 7.423 767 H SER 49 HN SER 49 4.515 -5.113 5.147 768 HA SER 49 HA SER 49 6.349 -2.792 4.918 769 HG SER 49 HG SER 49 6.496 -4.820 2.035 770 HB2 SER 49 2HB SER 49 4.415 -3.998 2.876 771 HB3 SER 49 3HB SER 49 5.660 -2.782 2.555 772 H ARG 50 HN ARG 50 3.345 -3.271 6.261 773 HA ARG 50 HA ARG 50 2.757 -0.409 6.122 774 HE ARG 50 HE ARG 50 -1.212 -2.017 2.880 775 HB2 ARG 50 2HB ARG 50 0.957 -2.442 4.780 776 HB3 ARG 50 3HB ARG 50 0.272 -1.024 5.575 777 HG2 ARG 50 2HG ARG 50 1.765 0.422 4.159 778 HG3 ARG 50 3HG ARG 50 2.135 -1.030 3.205 779 HD2 ARG 50 2HD ARG 50 -0.656 0.057 3.721 780 HD3 ARG 50 3HD ARG 50 0.250 0.379 2.259 781 HH11 ARG 50 1HH1 ARG 50 1.757 -1.116 1.126 782 HH12 ARG 50 2HH1 ARG 50 1.362 -2.241 -0.152 783 HH21 ARG 50 1HH2 ARG 50 -1.446 -3.487 1.163 784 HH22 ARG 50 2HH2 ARG 50 -0.268 -3.451 -0.090 785 H SER 51 HN SER 51 1.064 0.234 7.635 786 HA SER 51 HA SER 51 1.221 -1.097 10.142 787 HG SER 51 HG SER 51 1.243 1.957 9.461 788 HB2 SER 51 2HB SER 51 -1.198 0.554 9.714 789 HB3 SER 51 3HB SER 51 0.088 0.738 10.903 790 H ASP 52 HN ASP 52 -1.368 -1.034 7.645 791 HA ASP 52 HA ASP 52 -3.209 -2.665 9.049 792 HB2 ASP 52 2HB ASP 52 -4.383 -2.863 6.999 793 HB3 ASP 52 3HB ASP 52 -3.679 -1.251 7.047 794 H GLN 53 HN GLN 53 -0.422 -3.529 7.005 795 HA GLN 53 HA GLN 53 -1.104 -6.339 6.743 796 HB2 GLN 53 2HB GLN 53 1.545 -4.854 6.440 797 HB3 GLN 53 3HB GLN 53 1.289 -6.556 6.021 798 HG2 GLN 53 2HG GLN 53 -0.269 -4.218 4.801 799 HG3 GLN 53 3HG GLN 53 1.122 -5.013 4.059 800 HE21 GLN 53 1HE2 GLN 53 -2.367 -5.187 4.533 801 HE22 GLN 53 2HE2 GLN 53 -2.502 -6.772 3.752 802 H LEU 54 HN LEU 54 0.970 -4.421 8.952 803 HA LEU 54 HA LEU 54 1.836 -6.660 10.555 804 HG LEU 54 HG LEU 54 1.527 -4.552 13.288 805 HB2 LEU 54 2HB LEU 54 3.014 -4.565 10.646 806 HB3 LEU 54 3HB LEU 54 1.563 -3.674 11.046 807 HD11 LEU 54 1HD1 LEU 54 2.486 -6.836 12.907 808 HD12 LEU 54 2HD1 LEU 54 3.304 -5.951 14.188 809 HD13 LEU 54 3HD1 LEU 54 4.073 -6.106 12.592 810 HD21 LEU 54 3HD2 LEU 54 3.176 -2.638 12.477 811 HD22 LEU 54 1HD2 LEU 54 4.425 -3.872 12.870 812 HD23 LEU 54 2HD2 LEU 54 3.326 -3.315 14.109 813 H LYS 55 HN LYS 55 -0.985 -4.393 10.748 814 HA LYS 55 HA LYS 55 -2.122 -5.487 13.159 815 HB2 LYS 55 2HB LYS 55 -3.019 -3.680 10.960 816 HB3 LYS 55 3HB LYS 55 -4.305 -4.587 11.733 817 HG2 LYS 55 2HG LYS 55 -4.066 -2.487 12.874 818 HG3 LYS 55 3HG LYS 55 -3.610 -3.808 13.948 819 HD2 LYS 55 2HD LYS 55 -1.172 -3.293 13.419 820 HD3 LYS 55 3HD LYS 55 -1.743 -1.877 12.506 821 HE2 LYS 55 2HE LYS 55 -2.871 -1.041 14.563 822 HE3 LYS 55 3HE LYS 55 -2.271 -2.457 15.450 823 HZ1 LYS 55 3HZ LYS 55 -0.602 -0.394 14.162 824 HZ2 LYS 55 1HZ LYS 55 -0.026 -1.718 14.953 825 HZ3 LYS 55 2HZ LYS 55 -0.852 -0.554 15.781 826 H ARG 56 HN ARG 56 -2.490 -6.372 9.701 827 HA ARG 56 HA ARG 56 -4.437 -8.453 10.067 828 HE ARG 56 HE ARG 56 -3.978 -8.884 5.170 829 HB2 ARG 56 2HB ARG 56 -3.859 -7.602 7.840 830 HB3 ARG 56 3HB ARG 56 -2.197 -8.084 8.042 831 HG2 ARG 56 2HG ARG 56 -3.351 -10.533 8.303 832 HG3 ARG 56 3HG ARG 56 -4.570 -9.754 7.309 833 HD2 ARG 56 2HD ARG 56 -1.596 -9.636 6.616 834 HD3 ARG 56 3HD ARG 56 -2.558 -11.059 6.245 835 HH11 ARG 56 1HH1 ARG 56 -0.789 -10.256 4.646 836 HH12 ARG 56 2HH1 ARG 56 -0.796 -9.876 2.944 837 HH21 ARG 56 1HH2 ARG 56 -3.995 -8.582 2.900 838 HH22 ARG 56 2HH2 ARG 56 -2.580 -9.107 2.008 839 H HIS 57 HN HIS 57 -0.833 -8.490 10.075 840 HA HIS 57 HA HIS 57 -0.524 -11.264 10.535 841 HD1 HIS 57 1HD HIS 57 1.820 -12.625 10.230 842 HD2 HIS 57 2HD HIS 57 2.690 -9.895 13.267 843 HE1 HIS 57 1HE HIS 57 3.330 -13.868 11.899 844 HB2 HIS 57 2HB HIS 57 1.287 -9.793 9.849 845 HB3 HIS 57 3HB HIS 57 1.262 -8.942 11.398 846 H GLN 58 HN GLN 58 -0.977 -8.565 12.865 847 HA GLN 58 HA GLN 58 -0.579 -9.947 15.285 848 HB2 GLN 58 2HB GLN 58 -2.479 -7.716 14.521 849 HB3 GLN 58 3HB GLN 58 -2.405 -8.350 16.165 850 HG2 GLN 58 2HG GLN 58 -0.075 -7.789 16.383 851 HG3 GLN 58 3HG GLN 58 0.057 -7.325 14.693 852 HE21 GLN 58 1HE2 GLN 58 0.816 -5.608 16.855 853 HE22 GLN 58 2HE2 GLN 58 -0.340 -4.260 16.812 854 H ARG 59 HN ARG 59 -3.405 -10.048 13.059 855 HA ARG 59 HA ARG 59 -5.276 -11.349 14.795 856 HE ARG 59 HE ARG 59 -5.048 -7.953 13.499 857 HB2 ARG 59 2HB ARG 59 -4.981 -11.793 11.795 858 HB3 ARG 59 3HB ARG 59 -6.370 -12.113 12.781 859 HG2 ARG 59 2HG ARG 59 -5.350 -9.416 11.890 860 HG3 ARG 59 3HG ARG 59 -6.902 -10.177 11.611 861 HD2 ARG 59 2HD ARG 59 -7.566 -8.716 13.207 862 HD3 ARG 59 3HD ARG 59 -7.058 -10.014 14.288 863 HH11 ARG 59 2HH2 ARG 59 -7.063 -9.128 16.141 864 HH12 ARG 59 1HH2 ARG 59 -6.353 -7.994 17.271 865 HH21 ARG 59 1HH1 ARG 59 -4.191 -6.584 14.999 866 HH22 ARG 59 2HH1 ARG 59 -4.770 -6.614 16.642 867 H ARG 60 HN ARG 60 -2.486 -12.597 12.957 868 HA ARG 60 HA ARG 60 -3.113 -15.419 13.200 869 HE ARG 60 HE ARG 60 0.966 -18.176 12.120 870 HB2 ARG 60 2HB ARG 60 -1.440 -14.432 11.595 871 HB3 ARG 60 3HB ARG 60 -0.378 -14.080 12.970 872 HG2 ARG 60 2HG ARG 60 -0.215 -16.479 13.502 873 HG3 ARG 60 3HG ARG 60 -1.263 -16.854 12.128 874 HD2 ARG 60 2HD ARG 60 0.473 -15.709 10.637 875 HD3 ARG 60 3HD ARG 60 1.474 -15.490 12.072 876 HH11 ARG 60 1HH2 ARG 60 2.377 -16.167 9.558 877 HH12 ARG 60 2HH2 ARG 60 3.412 -17.476 9.043 878 HH21 ARG 60 1HH1 ARG 60 2.265 -19.762 11.329 879 HH22 ARG 60 2HH1 ARG 60 3.322 -19.443 9.973 880 H HIS 61 HN HIS 61 -1.546 -13.039 15.344 881 HA HIS 61 HA HIS 61 -0.576 -15.113 17.216 882 HD1 HIS 61 1HD HIS 61 2.048 -14.498 18.666 883 HD2 HIS 61 2HD HIS 61 1.537 -11.849 15.428 884 HE1 HIS 61 1HE HIS 61 4.337 -14.140 17.647 885 HB2 HIS 61 2HB HIS 61 -0.510 -12.084 17.119 886 HB3 HIS 61 3HB HIS 61 -0.158 -12.937 18.612 887 H THR 62 HN THR 62 -3.205 -12.715 16.973 888 HA THR 62 HA THR 62 -4.124 -13.236 19.716 889 HB THR 62 HB THR 62 -5.912 -11.589 19.133 890 HG1 THR 62 1HG THR 62 -4.533 -11.212 16.729 891 HG21 THR 62 3HG2 THR 62 -4.491 -9.620 18.707 892 HG22 THR 62 1HG2 THR 62 -3.120 -10.665 18.280 893 HG23 THR 62 2HG2 THR 62 -3.767 -10.679 19.928 894 H GLY 63 HN GLY 63 -4.803 -14.500 16.530 895 HA2 GLY 63 2HA GLY 63 -6.232 -16.246 15.921 896 HA3 GLY 63 3HA GLY 63 -6.821 -16.343 17.590 897 H VAL 64 HN VAL 64 -7.007 -13.118 16.653 898 HA VAL 64 HA VAL 64 -9.892 -13.168 16.653 899 HB VAL 64 HB VAL 64 -7.852 -10.966 16.109 900 HG11 VAL 64 1HG1 VAL 64 -10.883 -10.710 16.383 901 HG12 VAL 64 2HG1 VAL 64 -9.741 -9.359 16.535 902 HG13 VAL 64 3HG1 VAL 64 -9.886 -10.201 15.001 903 HG21 VAL 64 3HG2 VAL 64 -8.450 -10.223 18.358 904 HG22 VAL 64 1HG2 VAL 64 -9.703 -11.478 18.483 905 HG23 VAL 64 2HG2 VAL 64 -7.996 -11.929 18.438 906 H LYS 65 HN LYS 65 -11.003 -14.005 14.993 907 HA LYS 65 HA LYS 65 -10.280 -13.157 12.208 908 HB2 LYS 65 2HB LYS 65 -11.746 -15.604 13.257 909 HB3 LYS 65 3HB LYS 65 -11.685 -15.191 11.544 910 HG2 LYS 65 2HG LYS 65 -9.275 -15.392 11.508 911 HG3 LYS 65 3HG LYS 65 -9.191 -15.634 13.249 912 HD2 LYS 65 2HD LYS 65 -10.459 -17.518 11.222 913 HD3 LYS 65 3HD LYS 65 -8.893 -17.733 11.988 914 HE2 LYS 65 2HE LYS 65 -11.556 -17.675 13.469 915 HE3 LYS 65 3HE LYS 65 -10.679 -19.134 13.002 916 HZ1 LYS 65 3HZ LYS 65 -9.636 -17.055 14.830 917 HZ2 LYS 65 1HZ LYS 65 -8.849 -18.426 14.379 918 HZ3 LYS 65 2HZ LYS 65 -10.224 -18.524 15.276 919 HA PRO 66 HA PRO 66 -14.094 -10.969 13.397 920 HB2 PRO 66 2HB PRO 66 -13.614 -8.560 12.208 921 HB3 PRO 66 3HB PRO 66 -12.718 -9.101 13.659 922 HG2 PRO 66 2HG PRO 66 -11.841 -9.281 10.759 923 HG3 PRO 66 3HG PRO 66 -10.917 -8.640 12.153 924 HD2 PRO 66 2HD PRO 66 -10.623 -11.204 11.236 925 HD3 PRO 66 3HD PRO 66 -10.473 -10.782 12.967 926 H PHE 67 HN PHE 67 -12.895 -11.672 10.150 927 HA PHE 67 HA PHE 67 -15.258 -10.522 8.796 928 HD1 PHE 67 2HD PHE 67 -14.521 -9.186 6.325 929 HD2 PHE 67 1HD PHE 67 -11.173 -10.694 8.569 930 HE1 PHE 67 2HE PHE 67 -13.355 -7.007 6.063 931 HE2 PHE 67 1HE PHE 67 -9.974 -8.548 8.245 932 HZ PHE 67 HZ PHE 67 -11.077 -6.690 6.997 933 HB2 PHE 67 2HB PHE 67 -12.905 -12.197 7.814 934 HB3 PHE 67 3HB PHE 67 -14.161 -11.645 6.764 935 H GLN 68 HN GLN 68 -16.796 -11.836 10.184 936 HA GLN 68 HA GLN 68 -16.922 -14.668 9.650 937 HB2 GLN 68 2HB GLN 68 -17.545 -13.522 11.788 938 HB3 GLN 68 3HB GLN 68 -18.961 -12.831 10.995 939 HG2 GLN 68 2HG GLN 68 -19.966 -14.973 10.693 940 HG3 GLN 68 3HG GLN 68 -18.429 -15.797 11.012 941 HE21 GLN 68 1HE2 GLN 68 -19.261 -17.132 12.673 942 HE22 GLN 68 2HE2 GLN 68 -19.785 -16.404 14.224 943 H CYS 69 HN CYS 69 -18.083 -15.830 8.249 944 HA CYS 69 HA CYS 69 -19.270 -14.591 5.996 945 HB2 CYS 69 2HB CYS 69 -18.355 -16.895 5.975 946 HB3 CYS 69 3HB CYS 69 -19.663 -17.440 7.033 947 H LYS 70 HN LYS 70 -21.146 -13.599 5.730 948 HA LYS 70 HA LYS 70 -23.314 -13.540 7.544 949 HB2 LYS 70 2HB LYS 70 -24.517 -12.408 5.825 950 HB3 LYS 70 3HB LYS 70 -22.842 -11.908 5.672 951 HG2 LYS 70 2HG LYS 70 -24.315 -13.911 3.890 952 HG3 LYS 70 3HG LYS 70 -23.912 -12.252 3.488 953 HD2 LYS 70 2HD LYS 70 -21.497 -12.791 3.486 954 HD3 LYS 70 3HD LYS 70 -21.871 -14.463 3.949 955 HE2 LYS 70 2HE LYS 70 -23.233 -14.729 1.905 956 HE3 LYS 70 3HE LYS 70 -22.631 -13.151 1.342 957 HZ1 LYS 70 3HZ LYS 70 -21.319 -15.032 0.541 958 HZ2 LYS 70 1HZ LYS 70 -20.976 -15.478 2.089 959 HZ3 LYS 70 2HZ LYS 70 -20.391 -14.054 1.497 960 H THR 71 HN THR 71 -22.334 -16.159 5.561 961 HA THR 71 HA THR 71 -25.119 -17.196 5.232 962 HB THR 71 HB THR 71 -22.998 -18.806 4.001 963 HG1 THR 71 1HG THR 71 -21.880 -16.976 3.724 964 HG21 THR 71 3HG2 THR 71 -24.341 -18.545 2.003 965 HG22 THR 71 1HG2 THR 71 -25.312 -17.281 2.789 966 HG23 THR 71 2HG2 THR 71 -25.366 -18.958 3.393 967 H CYS 72 HN CYS 72 -21.847 -18.651 5.872 968 HA CYS 72 HA CYS 72 -23.228 -20.730 7.522 969 HB2 CYS 72 2HB CYS 72 -21.197 -22.063 7.119 970 HB3 CYS 72 3HB CYS 72 -21.882 -21.489 5.578 971 H GLN 73 HN GLN 73 -21.748 -17.831 8.092 972 HA GLN 73 HA GLN 73 -20.884 -16.846 9.980 973 HB2 GLN 73 2HB GLN 73 -21.700 -19.434 11.405 974 HB3 GLN 73 3HB GLN 73 -21.267 -17.938 12.179 975 HG2 GLN 73 2HG GLN 73 -23.602 -18.117 10.226 976 HG3 GLN 73 3HG GLN 73 -23.733 -18.369 11.958 977 HE21 GLN 73 1HE2 GLN 73 -22.588 -15.741 9.559 978 HE22 GLN 73 2HE2 GLN 73 -23.096 -14.536 10.753 979 H ARG 74 HN ARG 74 -19.270 -19.072 8.330 980 HA ARG 74 HA ARG 74 -17.085 -19.798 10.000 981 HE ARG 74 HE ARG 74 -14.508 -21.022 6.306 982 HB2 ARG 74 2HB ARG 74 -17.406 -19.364 7.012 983 HB3 ARG 74 3HB ARG 74 -15.822 -19.605 7.717 984 HG2 ARG 74 2HG ARG 74 -16.658 -21.737 8.811 985 HG3 ARG 74 3HG ARG 74 -18.137 -21.577 7.870 986 HD2 ARG 74 2HD ARG 74 -16.619 -23.040 6.653 987 HD3 ARG 74 3HD ARG 74 -16.728 -21.512 5.774 988 HH11 ARG 74 2HH1 ARG 74 -15.391 -23.876 8.150 989 HH12 ARG 74 1HH1 ARG 74 -13.804 -23.997 8.886 990 HH21 ARG 74 1HH2 ARG 74 -12.551 -21.180 7.357 991 HH22 ARG 74 2HH2 ARG 74 -12.239 -22.542 8.406 992 H LYS 75 HN LYS 75 -15.704 -18.546 11.087 993 HA LYS 75 HA LYS 75 -15.443 -15.733 10.409 994 HB2 LYS 75 2HB LYS 75 -14.283 -17.501 12.611 995 HB3 LYS 75 3HB LYS 75 -13.887 -15.794 12.425 996 HG2 LYS 75 2HG LYS 75 -16.292 -15.206 12.570 997 HG3 LYS 75 3HG LYS 75 -16.672 -16.909 12.898 998 HD2 LYS 75 2HD LYS 75 -15.312 -16.825 14.953 999 HD3 LYS 75 3HD LYS 75 -14.834 -15.151 14.592 1000 HE2 LYS 75 2HE LYS 75 -17.220 -14.453 14.687 1001 HE3 LYS 75 3HE LYS 75 -17.682 -16.114 15.078 1002 HZ1 LYS 75 3HZ LYS 75 -16.366 -15.952 17.081 1003 HZ2 LYS 75 1HZ LYS 75 -17.495 -14.753 17.046 1004 HZ3 LYS 75 2HZ LYS 75 -15.921 -14.408 16.714 1005 H PHE 76 HN PHE 76 -13.987 -14.853 9.120 1006 HA PHE 76 HA PHE 76 -11.420 -16.313 8.611 1007 HD1 PHE 76 1HD PHE 76 -11.372 -17.640 6.196 1008 HD2 PHE 76 2HD PHE 76 -14.975 -15.263 6.314 1009 HE1 PHE 76 1HE PHE 76 -12.651 -19.514 5.180 1010 HE2 PHE 76 2HE PHE 76 -16.247 -17.150 5.360 1011 HZ PHE 76 HZ PHE 76 -15.101 -19.282 4.809 1012 HB2 PHE 76 2HB PHE 76 -12.873 -14.267 6.863 1013 HB3 PHE 76 3HB PHE 76 -11.369 -15.071 6.461 1014 H SER 77 HN SER 77 -9.525 -14.903 8.201 1015 HA SER 77 HA SER 77 -9.540 -12.647 10.133 1016 HG SER 77 HG SER 77 -6.416 -14.962 8.879 1017 HB2 SER 77 2HB SER 77 -7.002 -12.880 9.852 1018 HB3 SER 77 3HB SER 77 -7.810 -14.286 10.546 1019 H ARG 78 HN ARG 78 -9.747 -13.110 6.745 1020 HA ARG 78 HA ARG 78 -8.744 -10.332 6.263 1021 HE ARG 78 HE ARG 78 -6.020 -13.021 3.276 1022 HB2 ARG 78 2HB ARG 78 -8.222 -12.702 4.407 1023 HB3 ARG 78 3HB ARG 78 -7.660 -11.033 4.236 1024 HG2 ARG 78 2HG ARG 78 -6.587 -11.521 6.644 1025 HG3 ARG 78 3HG ARG 78 -6.686 -13.200 6.093 1026 HD2 ARG 78 2HD ARG 78 -5.300 -10.874 4.702 1027 HD3 ARG 78 3HD ARG 78 -4.526 -12.125 5.691 1028 HH11 ARG 78 1HH2 ARG 78 -2.915 -12.027 4.556 1029 HH12 ARG 78 2HH2 ARG 78 -2.058 -12.804 3.231 1030 HH21 ARG 78 2HH1 ARG 78 -4.808 -14.147 1.753 1031 HH22 ARG 78 1HH1 ARG 78 -3.127 -13.688 1.525 1032 H SER 79 HN SER 79 -9.716 -9.189 4.597 1033 HA SER 79 HA SER 79 -12.492 -9.836 4.053 1034 HG SER 79 HG SER 79 -10.351 -6.614 2.785 1035 HB2 SER 79 2HB SER 79 -12.349 -7.794 2.583 1036 HB3 SER 79 3HB SER 79 -11.835 -7.510 4.253 1037 H ASP 80 HN ASP 80 -9.434 -9.904 2.178 1038 HA ASP 80 HA ASP 80 -10.541 -10.593 -0.337 1039 HB2 ASP 80 2HB ASP 80 -8.215 -11.524 -0.796 1040 HB3 ASP 80 3HB ASP 80 -8.376 -9.855 -0.227 1041 H HIS 81 HN HIS 81 -9.689 -12.659 2.440 1042 HA HIS 81 HA HIS 81 -10.205 -15.194 1.033 1043 HD1 HIS 81 1HD HIS 81 -7.627 -15.644 4.918 1044 HD2 HIS 81 2HD HIS 81 -7.979 -15.174 0.750 1045 HE1 HIS 81 1HE HIS 81 -5.372 -15.653 4.049 1046 HB2 HIS 81 2HB HIS 81 -9.886 -14.503 3.986 1047 HB3 HIS 81 3HB HIS 81 -10.200 -16.133 3.389 1048 H LEU 82 HN LEU 82 -12.044 -13.019 3.251 1049 HA LEU 82 HA LEU 82 -14.378 -14.706 3.399 1050 HG LEU 82 HG LEU 82 -16.447 -13.491 3.869 1051 HB2 LEU 82 2HB LEU 82 -13.987 -12.916 4.955 1052 HB3 LEU 82 3HB LEU 82 -14.051 -11.681 3.700 1053 HD11 LEU 82 1HD1 LEU 82 -16.064 -11.368 5.988 1054 HD12 LEU 82 2HD1 LEU 82 -15.912 -13.162 6.202 1055 HD13 LEU 82 3HD1 LEU 82 -17.436 -12.442 5.752 1056 HD21 LEU 82 3HD2 LEU 82 -16.198 -10.452 3.687 1057 HD22 LEU 82 1HD2 LEU 82 -17.693 -11.396 3.530 1058 HD23 LEU 82 2HD2 LEU 82 -16.435 -11.538 2.306 1059 H LYS 83 HN LYS 83 -13.410 -12.060 1.160 1060 HA LYS 83 HA LYS 83 -15.813 -12.102 -0.447 1061 HB2 LYS 83 2HB LYS 83 -14.106 -10.271 -0.384 1062 HB3 LYS 83 3HB LYS 83 -12.964 -11.311 -1.240 1063 HG2 LYS 83 2HG LYS 83 -14.434 -11.345 -3.213 1064 HG3 LYS 83 3HG LYS 83 -15.689 -10.457 -2.324 1065 HD2 LYS 83 2HD LYS 83 -14.143 -8.541 -2.045 1066 HD3 LYS 83 3HD LYS 83 -12.892 -9.390 -2.961 1067 HE2 LYS 83 2HE LYS 83 -15.650 -8.665 -4.052 1068 HE3 LYS 83 3HE LYS 83 -14.211 -7.654 -4.248 1069 HZ1 LYS 83 3HZ LYS 83 -13.153 -9.464 -5.416 1070 HZ2 LYS 83 1HZ LYS 83 -14.565 -9.051 -6.157 1071 HZ3 LYS 83 2HZ LYS 83 -14.491 -10.412 -5.240 1072 H THR 84 HN THR 84 -12.722 -13.896 -0.543 1073 HA THR 84 HA THR 84 -13.212 -15.277 -3.014 1074 HB THR 84 HB THR 84 -11.527 -15.928 -0.584 1075 HG1 THR 84 1HG THR 84 -10.759 -14.227 -1.582 1076 HG21 THR 84 3HG2 THR 84 -10.222 -17.451 -1.836 1077 HG22 THR 84 1HG2 THR 84 -11.343 -17.358 -3.235 1078 HG23 THR 84 2HG2 THR 84 -11.864 -18.080 -1.684 1079 H HIS 85 HN HIS 85 -13.719 -16.224 0.414 1080 HA HIS 85 HA HIS 85 -15.033 -18.699 -0.122 1081 HD1 HIS 85 1HD HIS 85 -15.711 -20.615 2.030 1082 HD2 HIS 85 2HD HIS 85 -17.532 -16.989 3.229 1083 HE1 HIS 85 1HE HIS 85 -17.984 -21.207 3.081 1084 HB2 HIS 85 2HB HIS 85 -14.168 -18.196 2.081 1085 HB3 HIS 85 3HB HIS 85 -15.169 -16.749 2.209 1086 H THR 86 HN THR 86 -16.207 -15.332 0.087 1087 HA THR 86 HA THR 86 -18.992 -15.829 -0.019 1088 HB THR 86 HB THR 86 -17.330 -13.547 -1.151 1089 HG1 THR 86 1HG THR 86 -17.321 -13.780 1.045 1090 HG21 THR 86 3HG2 THR 86 -20.341 -13.629 -0.911 1091 HG22 THR 86 1HG2 THR 86 -19.389 -13.432 -2.405 1092 HG23 THR 86 2HG2 THR 86 -19.329 -12.182 -1.157 1093 H ARG 87 HN ARG 87 -16.505 -15.763 -2.639 1094 HA ARG 87 HA ARG 87 -18.437 -16.042 -4.817 1095 HE ARG 87 HE ARG 87 -13.384 -15.858 -6.726 1096 HB2 ARG 87 2HB ARG 87 -15.448 -16.678 -4.683 1097 HB3 ARG 87 3HB ARG 87 -16.441 -16.797 -6.114 1098 HG2 ARG 87 2HG ARG 87 -17.050 -14.338 -5.807 1099 HG3 ARG 87 3HG ARG 87 -15.799 -14.258 -4.586 1100 HD2 ARG 87 2HD ARG 87 -15.401 -15.034 -7.502 1101 HD3 ARG 87 3HD ARG 87 -15.011 -13.468 -6.793 1102 HH11 ARG 87 1HH2 ARG 87 -13.989 -12.981 -4.797 1103 HH12 ARG 87 2HH2 ARG 87 -12.387 -13.077 -4.068 1104 HH21 ARG 87 1HH1 ARG 87 -11.527 -15.927 -5.785 1105 HH22 ARG 87 2HH1 ARG 87 -11.100 -14.860 -4.429 1106 H THR 88 HN THR 88 -17.041 -18.202 -2.454 1107 HA THR 88 HA THR 88 -17.559 -20.699 -3.907 1108 HB THR 88 HB THR 88 -17.234 -20.305 -0.882 1109 HG1 THR 88 1HG THR 88 -15.485 -19.609 -2.408 1110 HG21 THR 88 3HG2 THR 88 -18.129 -22.460 -1.256 1111 HG22 THR 88 1HG2 THR 88 -16.386 -22.632 -0.979 1112 HG23 THR 88 2HG2 THR 88 -17.041 -22.725 -2.633 1113 H HIS 89 HN HIS 89 -19.415 -18.468 -1.868 1114 HA HIS 89 HA HIS 89 -21.726 -20.359 -1.752 1115 HD1 HIS 89 1HD HIS 89 -22.909 -21.025 0.367 1116 HD2 HIS 89 2HD HIS 89 -20.309 -18.120 1.956 1117 HE1 HIS 89 1HE HIS 89 -22.381 -21.733 2.780 1118 HB2 HIS 89 2HB HIS 89 -21.096 -17.667 -0.496 1119 HB3 HIS 89 3HB HIS 89 -22.759 -18.210 -0.626 1120 H THR 90 HN THR 90 -20.429 -17.774 -3.660 1121 HA THR 90 HA THR 90 -23.078 -16.987 -4.750 1122 HB THR 90 HB THR 90 -20.331 -15.875 -5.438 1123 HG1 THR 90 1HG THR 90 -20.711 -15.665 -3.220 1124 HG21 THR 90 3HG2 THR 90 -23.080 -14.618 -5.681 1125 HG22 THR 90 1HG2 THR 90 -21.971 -15.018 -7.015 1126 HG23 THR 90 2HG2 THR 90 -21.540 -13.752 -5.869 1127 H GLY 91 HN GLY 91 -20.585 -19.228 -5.527 1128 HA2 GLY 91 2HA GLY 91 -20.346 -20.623 -7.373 1129 HA3 GLY 91 3HA GLY 91 -21.855 -19.973 -8.040 1130 H GLU 92 HN GLU 92 -19.546 -17.553 -7.176 1131 HA GLU 92 HA GLU 92 -19.359 -16.709 -9.951 1132 HB2 GLU 92 2HB GLU 92 -19.634 -15.168 -8.008 1133 HB3 GLU 92 3HB GLU 92 -18.018 -15.575 -7.455 1134 HG2 GLU 92 2HG GLU 92 -17.078 -14.650 -9.581 1135 HG3 GLU 92 3HG GLU 92 -18.716 -14.287 -10.135 1136 H LYS 93 HN LYS 93 -18.124 -18.125 -11.157 1137 HA LYS 93 HA LYS 93 -15.258 -18.427 -10.333 1138 HB2 LYS 93 2HB LYS 93 -17.069 -20.373 -11.814 1139 HB3 LYS 93 3HB LYS 93 -15.334 -20.616 -11.601 1140 HG2 LYS 93 2HG LYS 93 -15.528 -21.008 -9.285 1141 HG3 LYS 93 3HG LYS 93 -17.062 -20.162 -9.150 1142 HD2 LYS 93 2HD LYS 93 -17.572 -22.448 -8.871 1143 HD3 LYS 93 3HD LYS 93 -18.189 -21.961 -10.446 1144 HE2 LYS 93 2HE LYS 93 -17.175 -24.105 -10.750 1145 HE3 LYS 93 3HE LYS 93 -16.073 -22.927 -11.474 1146 HZ1 LYS 93 3HZ LYS 93 -14.834 -22.995 -9.360 1147 HZ2 LYS 93 1HZ LYS 93 -14.826 -24.416 -10.181 1148 HZ3 LYS 93 2HZ LYS 93 -15.791 -24.236 -8.847 1149 HA PRO 94 HA PRO 94 -15.425 -16.247 -14.362 1150 HB2 PRO 94 2HB PRO 94 -13.758 -14.162 -13.834 1151 HB3 PRO 94 3HB PRO 94 -15.406 -14.249 -13.140 1152 HG2 PRO 94 2HG PRO 94 -12.788 -15.029 -11.819 1153 HG3 PRO 94 3HG PRO 94 -14.099 -14.006 -11.154 1154 HD2 PRO 94 2HD PRO 94 -13.842 -16.691 -10.629 1155 HD3 PRO 94 3HD PRO 94 -15.427 -15.861 -10.666 1156 H PHE 95 HN PHE 95 -12.701 -17.604 -12.564 1157 HA PHE 95 HA PHE 95 -10.725 -17.053 -14.685 1158 HD1 PHE 95 2HD PHE 95 -8.461 -16.000 -13.444 1159 HD2 PHE 95 1HD PHE 95 -11.260 -17.376 -10.486 1160 HE1 PHE 95 2HE PHE 95 -7.992 -13.983 -12.069 1161 HE2 PHE 95 1HE PHE 95 -10.789 -15.359 -9.099 1162 HZ PHE 95 HZ PHE 95 -9.153 -13.668 -9.892 1163 HB2 PHE 95 2HB PHE 95 -10.556 -18.844 -12.220 1164 HB3 PHE 95 3HB PHE 95 -9.223 -18.401 -13.268 1165 H SER 96 HN SER 96 -11.896 -18.064 -16.491 1166 HA SER 96 HA SER 96 -12.259 -20.980 -16.474 1167 HG SER 96 HG SER 96 -11.368 -18.859 -19.027 1168 HB2 SER 96 2HB SER 96 -13.003 -20.645 -18.795 1169 HB3 SER 96 3HB SER 96 -13.796 -19.472 -17.719 1170 H CYS 97 HN CYS 97 -11.049 -22.539 -17.475 1171 HA CYS 97 HA CYS 97 -8.316 -21.981 -18.208 1172 HB2 CYS 97 2HB CYS 97 -9.230 -24.187 -17.304 1173 HB3 CYS 97 3HB CYS 97 -9.957 -24.452 -18.885 1174 H ARG 98 HN ARG 98 -7.377 -22.526 -20.309 1175 HA ARG 98 HA ARG 98 -9.142 -21.759 -22.595 1176 HE ARG 98 HE ARG 98 -5.431 -17.764 -21.270 1177 HB2 ARG 98 2HB ARG 98 -6.465 -20.533 -21.834 1178 HB3 ARG 98 3HB ARG 98 -7.292 -20.213 -23.360 1179 HG2 ARG 98 2HG ARG 98 -9.148 -19.136 -22.307 1180 HG3 ARG 98 3HG ARG 98 -8.672 -19.640 -20.706 1181 HD2 ARG 98 2HD ARG 98 -7.364 -17.544 -22.428 1182 HD3 ARG 98 3HD ARG 98 -8.153 -17.338 -20.863 1183 HH11 ARG 98 1HH1 ARG 98 -7.781 -19.345 -19.022 1184 HH12 ARG 98 2HH1 ARG 98 -6.405 -19.991 -18.142 1185 HH21 ARG 98 1HH2 ARG 98 -3.912 -18.635 -19.946 1186 HH22 ARG 98 2HH2 ARG 98 -4.446 -19.673 -18.625 1187 H TRP 99 HN TRP 99 -7.516 -24.201 -21.426 1188 HA TRP 99 HA TRP 99 -5.463 -24.799 -23.336 1189 HD1 TRP 99 1HD TRP 99 -5.317 -24.295 -20.214 1190 HE1 TRP 99 1HE TRP 99 -2.949 -24.613 -19.278 1191 HE3 TRP 99 3HE TRP 99 -4.135 -28.695 -22.530 1192 HZ2 TRP 99 2HZ TRP 99 -0.787 -26.499 -19.565 1193 HZ3 TRP 99 3HZ TRP 99 -1.891 -29.712 -22.214 1194 HH2 TRP 99 2HH TRP 99 -0.211 -28.620 -20.750 1195 HB2 TRP 99 2HB TRP 99 -7.066 -26.325 -21.289 1196 HB3 TRP 99 3HB TRP 99 -6.221 -27.252 -22.510 1197 HA PRO 100 HA PRO 100 -7.637 -25.793 -26.954 1198 HB2 PRO 100 2HB PRO 100 -6.157 -27.862 -28.079 1199 HB3 PRO 100 3HB PRO 100 -5.570 -26.191 -27.899 1200 HG2 PRO 100 2HG PRO 100 -5.078 -28.531 -26.030 1201 HG3 PRO 100 3HG PRO 100 -3.869 -27.418 -26.754 1202 HD2 PRO 100 2HD PRO 100 -4.789 -27.011 -24.258 1203 HD3 PRO 100 3HD PRO 100 -4.565 -25.620 -25.362 1204 H SER 101 HN SER 101 -8.394 -27.488 -24.403 1205 HA SER 101 HA SER 101 -10.463 -29.001 -25.735 1206 HG SER 101 HG SER 101 -8.619 -29.955 -26.837 1207 HB2 SER 101 2HB SER 101 -8.219 -30.547 -24.357 1208 HB3 SER 101 3HB SER 101 -9.817 -31.244 -24.695 1209 H CYS 102 HN CYS 102 -9.978 -26.870 -23.621 1210 HA CYS 102 HA CYS 102 -11.738 -28.036 -21.542 1211 HB2 CYS 102 2HB CYS 102 -9.390 -28.416 -20.751 1212 HB3 CYS 102 3HB CYS 102 -9.103 -26.668 -20.880 1213 H GLN 103 HN GLN 103 -12.614 -26.420 -20.090 1214 HA GLN 103 HA GLN 103 -12.124 -23.615 -20.572 1215 HB2 GLN 103 2HB GLN 103 -13.970 -24.458 -22.327 1216 HB3 GLN 103 3HB GLN 103 -15.029 -24.378 -20.930 1217 HG2 GLN 103 2HG GLN 103 -15.299 -22.244 -21.748 1218 HG3 GLN 103 3HG GLN 103 -13.929 -21.914 -20.692 1219 HE21 GLN 103 1HE2 GLN 103 -11.628 -21.819 -21.836 1220 HE22 GLN 103 2HE2 GLN 103 -11.762 -21.430 -23.561 1221 H LYS 104 HN LYS 104 -12.007 -25.726 -18.433 1222 HA LYS 104 HA LYS 104 -14.264 -25.524 -16.651 1223 HB2 LYS 104 2HB LYS 104 -11.358 -26.335 -16.220 1224 HB3 LYS 104 3HB LYS 104 -12.593 -26.448 -14.958 1225 HG2 LYS 104 2HG LYS 104 -13.928 -28.000 -16.310 1226 HG3 LYS 104 3HG LYS 104 -12.811 -27.843 -17.659 1227 HD2 LYS 104 2HD LYS 104 -11.004 -28.628 -15.858 1228 HD3 LYS 104 3HD LYS 104 -12.427 -29.237 -15.008 1229 HE2 LYS 104 2HE LYS 104 -11.761 -31.080 -16.305 1230 HE3 LYS 104 3HE LYS 104 -13.036 -30.346 -17.295 1231 HZ1 LYS 104 3HZ LYS 104 -11.201 -29.166 -18.477 1232 HZ2 LYS 104 1HZ LYS 104 -11.159 -30.808 -18.671 1233 HZ3 LYS 104 2HZ LYS 104 -10.117 -30.040 -17.649 1234 H LYS 105 HN LYS 105 -14.682 -24.217 -14.932 1235 HA LYS 105 HA LYS 105 -13.057 -21.735 -14.895 1236 HB2 LYS 105 2HB LYS 105 -15.955 -22.142 -14.033 1237 HB3 LYS 105 3HB LYS 105 -15.051 -20.629 -14.197 1238 HG2 LYS 105 2HG LYS 105 -14.715 -21.273 -16.671 1239 HG3 LYS 105 3HG LYS 105 -15.969 -22.491 -16.408 1240 HD2 LYS 105 2HD LYS 105 -17.544 -20.689 -15.701 1241 HD3 LYS 105 3HD LYS 105 -16.270 -19.482 -15.993 1242 HE2 LYS 105 2HE LYS 105 -16.133 -20.208 -18.367 1243 HE3 LYS 105 3HE LYS 105 -17.425 -21.385 -18.079 1244 HZ1 LYS 105 3HZ LYS 105 -18.267 -19.352 -19.034 1245 HZ2 LYS 105 1HZ LYS 105 -17.672 -18.461 -17.784 1246 HZ3 LYS 105 2HZ LYS 105 -18.878 -19.551 -17.517 1247 H PHE 106 HN PHE 106 -12.341 -20.786 -13.075 1248 HA PHE 106 HA PHE 106 -12.913 -22.179 -10.476 1249 HD1 PHE 106 1HD PHE 106 -10.968 -24.172 -9.711 1250 HD2 PHE 106 2HD PHE 106 -9.928 -22.183 -13.390 1251 HE1 PHE 106 1HE PHE 106 -10.637 -26.368 -10.828 1252 HE2 PHE 106 2HE PHE 106 -9.635 -24.371 -14.508 1253 HZ PHE 106 HZ PHE 106 -10.024 -26.467 -13.229 1254 HB2 PHE 106 2HB PHE 106 -10.275 -20.899 -11.345 1255 HB3 PHE 106 3HB PHE 106 -10.600 -21.693 -9.808 1256 H ALA 107 HN ALA 107 -12.571 -20.780 -8.558 1257 HA ALA 107 HA ALA 107 -13.540 -18.025 -9.165 1258 HB1 ALA 107 1HB ALA 107 -14.283 -18.023 -6.795 1259 HB2 ALA 107 2HB ALA 107 -14.954 -19.405 -7.662 1260 HB3 ALA 107 3HB ALA 107 -13.579 -19.638 -6.560 1261 H ARG 108 HN ARG 108 -10.634 -19.494 -8.767 1262 HA ARG 108 HA ARG 108 -9.456 -17.049 -7.544 1263 HE ARG 108 HE ARG 108 -7.225 -19.606 -4.668 1264 HB2 ARG 108 2HB ARG 108 -8.956 -19.928 -6.787 1265 HB3 ARG 108 3HB ARG 108 -7.744 -18.688 -6.505 1266 HG2 ARG 108 2HG ARG 108 -9.105 -17.540 -4.936 1267 HG3 ARG 108 3HG ARG 108 -10.576 -18.375 -5.463 1268 HD2 ARG 108 2HD ARG 108 -9.808 -19.240 -3.323 1269 HD3 ARG 108 3HD ARG 108 -9.824 -20.484 -4.576 1270 HH11 ARG 108 1HH2 ARG 108 -9.200 -20.529 -1.942 1271 HH12 ARG 108 2HH2 ARG 108 -7.851 -21.264 -1.098 1272 HH21 ARG 108 1HH1 ARG 108 -5.557 -20.576 -3.620 1273 HH22 ARG 108 2HH1 ARG 108 -5.831 -21.321 -2.042 1274 H SER 109 HN SER 109 -7.680 -16.304 -8.560 1275 HA SER 109 HA SER 109 -7.020 -17.152 -11.174 1276 HG SER 109 HG SER 109 -5.720 -14.525 -8.599 1277 HB2 SER 109 2HB SER 109 -4.972 -15.693 -10.830 1278 HB3 SER 109 3HB SER 109 -6.507 -14.899 -10.464 1279 H ASP 110 HN ASP 110 -5.411 -17.808 -8.023 1280 HA ASP 110 HA ASP 110 -3.250 -19.324 -9.160 1281 HB2 ASP 110 2HB ASP 110 -2.900 -20.106 -6.836 1282 HB3 ASP 110 3HB ASP 110 -2.951 -18.368 -7.025 1283 H GLU 111 HN GLU 111 -6.572 -20.210 -8.123 1284 HA GLU 111 HA GLU 111 -6.217 -23.092 -8.156 1285 HB2 GLU 111 2HB GLU 111 -8.617 -21.254 -8.462 1286 HB3 GLU 111 3HB GLU 111 -8.744 -22.944 -8.875 1287 HG2 GLU 111 2HG GLU 111 -8.015 -23.624 -6.642 1288 HG3 GLU 111 3HG GLU 111 -7.973 -21.934 -6.133 1289 H LEU 112 HN LEU 112 -7.072 -20.642 -10.659 1290 HA LEU 112 HA LEU 112 -7.325 -22.532 -12.823 1291 HG LEU 112 HG LEU 112 -5.867 -20.544 -14.928 1292 HB2 LEU 112 2HB LEU 112 -8.206 -20.304 -12.996 1293 HB3 LEU 112 3HB LEU 112 -6.619 -19.568 -12.791 1294 HD11 LEU 112 1HD1 LEU 112 -7.474 -21.520 -16.462 1295 HD12 LEU 112 2HD1 LEU 112 -8.756 -21.496 -15.246 1296 HD13 LEU 112 3HD1 LEU 112 -7.329 -22.553 -15.057 1297 HD21 LEU 112 3HD2 LEU 112 -6.955 -18.280 -14.772 1298 HD22 LEU 112 1HD2 LEU 112 -8.473 -19.046 -15.314 1299 HD23 LEU 112 2HD2 LEU 112 -7.050 -19.050 -16.355 1300 H VAL 113 HN VAL 113 -4.517 -20.486 -11.726 1301 HA VAL 113 HA VAL 113 -2.584 -21.445 -13.525 1302 HB VAL 113 HB VAL 113 -2.236 -20.761 -10.570 1303 HG11 VAL 113 1HG1 VAL 113 -0.132 -20.963 -12.751 1304 HG12 VAL 113 2HG1 VAL 113 0.127 -20.234 -11.153 1305 HG13 VAL 113 3HG1 VAL 113 -0.243 -21.951 -11.275 1306 HG21 VAL 113 3HG2 VAL 113 -1.672 -18.544 -11.167 1307 HG22 VAL 113 1HG2 VAL 113 -1.559 -18.946 -12.891 1308 HG23 VAL 113 2HG2 VAL 113 -3.126 -18.883 -12.120 1309 H ARG 114 HN ARG 114 -3.597 -22.847 -10.412 1310 HA ARG 114 HA ARG 114 -1.812 -25.093 -10.422 1311 HE ARG 114 HE ARG 114 -2.265 -25.713 -6.664 1312 HB2 ARG 114 2HB ARG 114 -3.005 -24.478 -8.408 1313 HB3 ARG 114 3HB ARG 114 -4.578 -24.742 -9.165 1314 HG2 ARG 114 2HG ARG 114 -4.169 -27.135 -9.385 1315 HG3 ARG 114 3HG ARG 114 -2.498 -26.951 -8.828 1316 HD2 ARG 114 2HD ARG 114 -4.961 -26.290 -7.164 1317 HD3 ARG 114 3HD ARG 114 -4.132 -27.857 -7.148 1318 HH11 ARG 114 2HH1 ARG 114 -4.763 -27.607 -5.039 1319 HH12 ARG 114 1HH1 ARG 114 -4.074 -27.337 -3.469 1320 HH21 ARG 114 1HH2 ARG 114 -1.438 -25.374 -4.571 1321 HH22 ARG 114 2HH2 ARG 114 -2.378 -26.029 -3.226 1322 H HIS 115 HN HIS 115 -5.234 -24.796 -11.563 1323 HA HIS 115 HA HIS 115 -5.578 -27.390 -12.525 1324 HD1 HIS 115 1HD HIS 115 -7.900 -28.427 -13.505 1325 HD2 HIS 115 2HD HIS 115 -7.254 -25.258 -16.208 1326 HE1 HIS 115 1HE HIS 115 -8.760 -29.197 -15.801 1327 HB2 HIS 115 2HB HIS 115 -7.388 -25.772 -12.477 1328 HB3 HIS 115 3HB HIS 115 -6.614 -24.765 -13.697 1329 H HIS 116 HN HIS 116 -4.261 -24.571 -14.356 1330 HA HIS 116 HA HIS 116 -3.712 -25.940 -16.766 1331 HD1 HIS 116 1HD HIS 116 -5.302 -24.396 -17.834 1332 HD2 HIS 116 2HD HIS 116 -2.953 -21.232 -16.275 1333 HE1 HIS 116 1HE HIS 116 -6.323 -22.283 -18.634 1334 HB2 HIS 116 2HB HIS 116 -2.256 -23.632 -15.423 1335 HB3 HIS 116 3HB HIS 116 -1.933 -24.178 -17.059 1336 H ASN 117 HN ASN 117 -1.830 -25.796 -13.701 1337 HA ASN 117 HA ASN 117 0.572 -27.016 -14.879 1338 HB2 ASN 117 2HB ASN 117 -0.314 -26.249 -12.072 1339 HB3 ASN 117 3HB ASN 117 1.054 -27.335 -12.303 1340 HD21 ASN 117 1HD2 ASN 117 -0.119 -24.024 -13.120 1341 HD22 ASN 117 2HD2 ASN 117 1.548 -23.463 -13.400 1342 H MET 118 HN MET 118 -2.496 -28.166 -13.771 1343 HA MET 118 HA MET 118 -1.427 -30.949 -13.464 1344 HB2 MET 118 2HB MET 118 -4.098 -29.700 -12.665 1345 HB3 MET 118 3HB MET 118 -3.714 -31.420 -12.510 1346 HG2 MET 118 2HG MET 118 -1.870 -30.920 -10.990 1347 HG3 MET 118 3HG MET 118 -2.177 -29.187 -11.136 1348 HE1 MET 118 3HE MET 118 -2.047 -29.285 -8.443 1349 HE2 MET 118 1HE MET 118 -3.190 -30.204 -7.435 1350 HE3 MET 118 2HE MET 118 -1.986 -31.061 -8.423 1351 H HIS 119 HN HIS 119 -2.469 -28.965 -15.891 1352 HA HIS 119 HA HIS 119 -4.649 -30.466 -17.008 1353 HD1 HIS 119 1HD HIS 119 -5.074 -30.537 -19.908 1354 HD2 HIS 119 2HD HIS 119 -5.962 -26.989 -17.853 1355 HE1 HIS 119 1HE HIS 119 -7.561 -29.950 -20.424 1356 HB2 HIS 119 2HB HIS 119 -3.711 -27.985 -17.389 1357 HB3 HIS 119 3HB HIS 119 -2.921 -28.755 -18.768 Start of MODEL 10 1 H5 DC 124 5H C 124 -4.002 -31.565 -5.119 2 H6 DC 124 6H C 124 -5.946 -31.214 -6.570 3 H5' DC 124 H5' C 124 -8.924 -32.494 -9.807 4 H5'' DC 124 H5" C 124 -7.511 -32.367 -8.732 5 H4' DC 124 H4' C 124 -10.412 -32.496 -7.756 6 H3' DC 124 H3' C 124 -9.162 -30.261 -8.924 7 H2' DC 124 H2' C 124 -7.472 -29.964 -7.355 8 H2'' DC 124 H2" C 124 -8.747 -29.051 -6.504 9 H1' DC 124 H1' C 124 -9.431 -30.905 -5.221 10 H41 DC 124 1H4 C 124 -4.467 -32.267 -1.538 11 H42 DC 124 2H4 C 124 -3.340 -32.120 -2.873 12 H8 DG 125 8H G 125 -9.139 -26.904 -5.677 13 H1 DG 125 1H G 125 -6.414 -29.034 -0.254 14 H5' DG 125 H5' G 125 -12.965 -29.636 -6.378 15 H5'' DG 125 H5" G 125 -13.988 -28.248 -6.820 16 H4' DG 125 H4' G 125 -13.819 -28.566 -4.356 17 H3' DG 125 H3' G 125 -13.412 -26.114 -5.727 18 H2' DG 125 H2' G 125 -11.148 -26.026 -5.335 19 H2'' DG 125 H2" G 125 -11.644 -25.278 -3.789 20 H1' DG 125 H1' G 125 -11.542 -27.384 -2.642 21 H21 DG 125 1H2 G 125 -7.904 -29.332 1.279 22 H22 DG 125 2H2 G 125 -9.615 -29.098 0.962 23 H5 DC 126 5H C 126 -8.009 -24.029 -4.318 24 H6 DC 126 6H C 126 -9.974 -23.576 -2.950 25 H5' DC 126 H5' C 126 -13.555 -26.204 -1.109 26 H5'' DC 126 H5" C 126 -14.595 -24.921 -0.449 27 H4' DC 126 H4' C 126 -12.631 -25.134 0.950 28 H3' DC 126 H3' C 126 -13.256 -22.650 -0.267 29 H2' DC 126 H2' C 126 -11.383 -22.762 -1.688 30 H2'' DC 126 H2" C 126 -10.618 -21.933 -0.296 31 H1' DC 126 H1' C 126 -10.056 -24.129 0.741 32 H41 DC 126 1H4 C 126 -4.995 -25.517 -2.863 33 H42 DC 126 2H4 C 126 -5.834 -25.059 -4.329 34 H8 DG 127 8H G 127 -9.642 -21.756 1.599 35 H1 DG 127 1H G 127 -3.363 -22.864 0.763 36 H5' DG 127 H5' G 127 -12.006 -23.661 3.824 37 H5'' DG 127 H5" G 127 -12.579 -22.629 5.133 38 H4' DG 127 H4' G 127 -10.533 -23.731 5.851 39 H3' DG 127 H3' G 127 -10.752 -20.942 5.775 40 H2' DG 127 H2' G 127 -9.365 -20.552 3.955 41 H2'' DG 127 H2" G 127 -8.084 -20.630 5.213 42 H1' DG 127 H1' G 127 -7.590 -22.874 4.749 43 H21 DG 127 1H2 G 127 -2.451 -23.382 2.655 44 H22 DG 127 2H2 G 127 -3.359 -23.338 4.156 45 H8 DG 128 8H G 128 -7.461 -18.586 4.295 46 H1 DG 128 1H G 128 -2.744 -19.736 0.037 47 H5' DG 128 H5' G 128 -6.746 -21.923 7.676 48 H5'' DG 128 H5" G 128 -6.599 -21.053 9.217 49 H4' DG 128 H4' G 128 -4.541 -20.675 8.062 50 H3' DG 128 H3' G 128 -6.250 -18.485 8.605 51 H2' DG 128 H2' G 128 -6.736 -18.021 6.329 52 H2'' DG 128 H2" G 128 -5.226 -17.056 6.510 53 H1' DG 128 H1' G 128 -3.872 -18.936 5.743 54 H21 DG 128 1H2 G 128 -0.877 -20.085 1.077 55 H22 DG 128 2H2 G 128 -0.806 -20.199 2.823 56 H8 DG 129 8H G 129 -3.468 -16.403 5.547 57 H1 DG 129 1H G 129 -1.008 -16.478 -0.359 58 H5' DG 129 H5' G 129 -1.554 -18.377 8.796 59 H5'' DG 129 H5" G 129 -0.967 -17.213 9.972 60 H4' DG 129 H4' G 129 0.589 -17.260 8.124 61 H3' DG 129 H3' G 129 -0.793 -14.791 8.667 62 H2' DG 129 H2' G 129 -1.930 -14.794 6.634 63 H2'' DG 129 H2" G 129 -0.438 -14.044 6.026 64 H1' DG 129 H1' G 129 0.434 -16.192 5.309 65 H21 DG 129 1H2 G 129 1.154 -16.465 -0.303 66 H22 DG 129 2H2 G 129 2.042 -16.432 1.213 67 H8 DG 130 8H G 130 0.577 -13.445 4.178 68 H1 DG 130 1H G 130 -0.480 -12.843 -2.090 69 H5' DG 130 H5' G 130 2.889 -15.492 5.506 70 H5'' DG 130 H5" G 130 3.945 -14.651 6.637 71 H4' DG 130 H4' G 130 5.112 -14.436 4.631 72 H3' DG 130 H3' G 130 4.149 -12.089 5.773 73 H2' DG 130 H2' G 130 2.253 -11.807 4.458 74 H2'' DG 130 H2" G 130 3.402 -10.962 3.404 75 H1' DG 130 H1' G 130 3.716 -12.786 2.007 76 H21 DG 130 1H2 G 130 1.374 -12.398 -3.163 77 H22 DG 130 2H2 G 130 2.896 -12.156 -2.320 78 H8 DG 131 8H G 131 2.553 -9.369 2.355 79 H1 DG 131 1H G 131 -1.903 -9.353 -2.249 80 H5' DG 131 H5' G 131 5.920 -11.752 1.605 81 H5'' DG 131 H5" G 131 7.358 -10.731 1.768 82 H4' DG 131 H4' G 131 6.578 -10.338 -0.431 83 H3' DG 131 H3' G 131 6.667 -8.231 1.446 84 H2' DG 131 H2' G 131 4.377 -8.187 1.755 85 H2'' DG 131 H2" G 131 4.481 -7.012 0.442 86 H1' DG 131 H1' G 131 3.923 -8.701 -1.239 87 H21 DG 131 1H2 G 131 -1.083 -8.809 -4.157 88 H22 DG 131 2H2 G 131 0.620 -8.422 -4.348 89 H5 DC 132 5H C 132 1.286 -6.402 1.625 90 H6 DC 132 6H C 132 2.790 -5.697 -0.163 91 H5' DC 132 H5' C 132 5.144 -7.704 -2.745 92 H5'' DC 132 H5" C 132 6.254 -6.528 -3.471 93 H4' DC 132 H4' C 132 4.255 -6.138 -4.599 94 H3' DC 132 H3' C 132 5.206 -4.086 -2.887 95 H2' DC 132 H2' C 132 3.525 -4.182 -1.354 96 H2'' DC 132 H2" C 132 2.673 -3.160 -2.530 97 H1' DC 132 H1' C 132 1.629 -5.039 -3.624 98 H41 DC 132 1H4 C 132 -2.299 -6.798 1.030 99 H42 DC 132 2H4 C 132 -0.968 -6.974 2.180 100 H8 DG 133 8H G 133 1.243 -1.860 -3.139 101 H1 DG 133 1H G 133 -4.910 -2.754 -1.500 102 H5' DG 133 H5' G 133 2.762 -3.257 -6.773 103 H5'' DG 133 H5" G 133 3.323 -1.751 -7.522 104 H4' DG 133 H4' G 133 0.977 -2.108 -8.029 105 H3' DG 133 H3' G 133 2.054 0.187 -6.965 106 H2' DG 133 H2' G 133 1.255 -0.218 -4.788 107 H2'' DG 133 H2" G 133 -0.050 0.806 -5.359 108 H1' DG 133 H1' G 133 -1.416 -1.167 -5.936 109 H21 DG 133 1H2 G 133 -6.221 -2.397 -3.219 110 H22 DG 133 2H2 G 133 -5.591 -1.906 -4.775 111 H5' DT 134 H5' T 134 -2.334 -0.104 -7.212 112 H5'' DT 134 H5" T 134 -2.713 1.059 -8.452 113 H4' DT 134 H4' T 134 -4.628 1.110 -7.218 114 H3' DT 134 H3' T 134 -3.069 3.384 -7.190 115 H2' DT 134 H2' T 134 -2.249 3.073 -5.098 116 H2'' DT 134 H2" T 134 -3.651 4.089 -4.773 117 H1' DT 134 H1' T 134 -5.065 2.104 -4.271 118 H3 DT 134 3H T 134 -4.227 0.296 -0.174 119 H71 DT 134 1H7 T 134 0.523 0.737 -2.283 120 H72 DT 134 2H7 T 134 0.371 2.343 -1.533 121 H73 DT 134 3H7 T 134 0.286 0.883 -0.528 122 H6 DT 134 6H T 134 -1.372 1.928 -3.697 123 H5 DC 135 5H C 135 -3.629 4.896 -2.882 124 H6 DC 135 6H C 135 -5.523 5.215 -4.403 125 H5' DC 135 H5' C 135 -7.620 3.438 -7.404 126 H5'' DC 135 H5" C 135 -8.347 4.866 -8.187 127 H4' DC 135 H4' C 135 -9.705 4.240 -6.239 128 H3' DC 135 H3' C 135 -8.534 6.823 -6.515 129 H2' DC 135 H2' C 135 -7.062 6.613 -4.771 130 H2'' DC 135 H2" C 135 -8.399 7.154 -3.780 131 H1' DC 135 H1' C 135 -9.066 4.868 -3.247 132 H41 DC 135 1H4 C 135 -4.106 3.397 0.432 133 H42 DC 135 2H4 C 135 -2.982 3.989 -0.763 134 H5' DT 136 H5' T 136 -11.011 5.379 -2.613 135 H5'' DT 136 H5" T 136 -12.462 6.305 -2.979 136 H4' DT 136 H4' T 136 -12.526 6.075 -0.681 137 H3' DT 136 H3' T 136 -12.272 8.602 -1.808 138 H2' DT 136 H2' T 136 -10.165 8.989 -1.303 139 H2'' DT 136 H2" T 136 -10.714 9.535 0.220 140 H1' DT 136 H1' T 136 -10.166 7.492 1.381 141 H3 DT 136 3H T 136 -5.726 6.448 1.665 142 H71 DT 136 1H7 T 136 -5.222 7.837 -2.910 143 H72 DT 136 2H7 T 136 -6.554 9.012 -3.025 144 H73 DT 136 3H7 T 136 -5.123 9.381 -2.031 145 H6 DT 136 6H T 136 -8.425 8.397 -1.776 146 H8 DG 137 8H G 137 -9.659 10.280 1.754 147 H1 DG 137 1H G 137 -3.741 9.451 3.995 148 H5' DG 137 H5' G 137 -11.801 7.603 2.317 149 H5'' DG 137 H5" G 137 -13.390 8.070 2.858 150 H4' DG 137 H4' G 137 -12.383 8.027 4.833 151 H3' DG 137 H3' G 137 -12.989 10.644 4.097 152 H2' DG 137 H2' G 137 -10.836 11.135 3.340 153 H2'' DG 137 H2" G 137 -10.619 11.674 4.971 154 H1' DG 137 H1' G 137 -9.358 9.715 5.576 155 H21 DG 137 1H2 G 137 -3.790 9.013 6.129 156 H22 DG 137 2H2 G 137 -5.294 9.058 7.037 157 H5 DC 138 5H C 138 -8.597 13.073 4.002 158 H6 DC 138 6H C 138 -9.164 12.373 6.268 159 H5' DC 138 H5' C 138 -10.218 9.291 7.455 160 H5'' DC 138 H5" C 138 -11.200 9.754 8.834 161 H4' DC 138 H4' C 138 -9.077 9.550 9.713 162 H3' DC 138 H3' C 138 -10.352 12.011 9.851 163 H2' DC 138 H2' C 138 -9.219 13.121 8.220 164 H2'' DC 138 H2" C 138 -8.065 13.485 9.484 165 H1' DC 138 H1' C 138 -6.583 11.757 8.882 166 H41 DC 138 1H4 C 138 -5.111 13.220 2.915 167 H42 DC 138 2H4 C 138 -6.798 13.350 2.469 168 H8 DG 139 8H G 139 -6.396 14.699 9.609 169 H1 DG 139 1H G 139 -2.118 15.897 5.009 170 H5' DG 139 H5' G 139 -6.167 11.124 11.099 171 H5'' DG 139 H5" G 139 -6.231 11.409 12.836 172 H4' DG 139 H4' G 139 -3.960 11.472 12.296 173 H3' DG 139 H3' G 139 -5.192 13.667 13.496 174 H2' DG 139 H2' G 139 -5.388 14.933 11.564 175 H2'' DG 139 H2" G 139 -3.798 15.514 12.027 176 H1' DG 139 H1' G 139 -2.671 14.055 10.535 177 H21 DG 139 1H2 G 139 -0.118 15.364 5.672 178 H22 DG 139 2H2 G 139 0.195 14.830 7.318 179 H5 DC 140 5H C 140 -4.155 17.636 10.492 180 H6 DC 140 6H C 140 -2.148 16.785 11.596 181 H5' DC 140 H5' C 140 -0.772 13.373 12.119 182 H5'' DC 140 H5" C 140 0.162 13.718 13.581 183 H4' DC 140 H4' C 140 1.557 14.147 11.670 184 H3' DC 140 H3' C 140 1.220 15.989 13.694 185 H2' DC 140 H2' C 140 -0.335 17.355 12.607 186 H2'' DC 140 H2" C 140 1.153 18.164 12.051 187 H1' DC 140 H1' C 140 1.230 16.983 10.019 188 H41 DC 140 1H4 C 140 -3.966 19.067 7.138 189 H42 DC 140 2H4 C 140 -4.975 18.629 8.497 190 H8 DG 141 8H G 141 -3.506 21.593 0.838 191 H1 DG 141 1H G 141 -1.605 18.749 6.268 192 H5' DG 141 H5' G 141 -0.859 24.582 -0.736 193 H5'' DG 141 H5" G 141 -1.148 23.883 -2.339 194 H4' DG 141 H4' G 141 0.780 22.876 -1.025 195 H3' DG 141 H3' G 141 -0.973 21.405 -2.625 196 H2' DG 141 H2' G 141 -2.274 20.611 -0.876 197 H2'' DG 141 H2" G 141 -1.092 19.297 -0.886 198 H1' DG 141 H1' G 141 0.180 20.294 0.915 199 H21 DG 141 1H2 G 141 0.517 18.318 6.197 200 H22 DG 141 2H2 G 141 1.463 18.560 4.737 201 H5 DC 142 5H C 142 -2.663 17.736 0.340 202 H6 DC 142 6H C 142 -0.282 17.367 -0.065 203 H5' DC 142 H5' C 142 1.965 19.569 0.322 204 H5'' DC 142 H5" C 142 3.189 19.255 -0.891 205 H4' DC 142 H4' C 142 3.959 18.006 0.803 206 H3' DC 142 H3' C 142 3.069 16.548 -1.374 207 H2' DC 142 H2' C 142 1.039 15.908 -0.575 208 H2'' DC 142 H2" C 142 1.937 14.584 0.108 209 H1' DC 142 H1' C 142 1.905 15.488 2.300 210 H41 DC 142 1H4 C 142 -4.196 16.769 3.538 211 H42 DC 142 2H4 C 142 -4.407 17.579 1.999 212 H8 DG 143 8H G 143 1.502 12.980 1.250 213 H1 DG 143 1H G 143 -3.763 12.372 4.845 214 H5' DG 143 H5' G 143 4.134 15.388 3.210 215 H5'' DG 143 H5" G 143 5.650 14.559 2.815 216 H4' DG 143 H4' G 143 4.896 13.566 4.834 217 H3' DG 143 H3' G 143 5.257 11.953 2.584 218 H2' DG 143 H2' G 143 3.067 11.751 1.984 219 H2'' DG 143 H2" G 143 3.032 10.387 3.070 220 H1' DG 143 H1' G 143 2.062 11.625 4.838 221 H21 DG 143 1H2 G 143 -3.263 11.781 6.859 222 H22 DG 143 2H2 G 143 -1.600 11.493 7.353 223 H5 DC 144 5H C 144 0.792 9.485 1.883 224 H6 DC 144 6H C 144 1.776 8.734 3.984 225 H5' DC 144 H5' C 144 3.078 10.975 6.427 226 H5'' DC 144 H5" C 144 4.333 9.979 7.141 227 H4' DC 144 H4' C 144 2.461 9.407 8.356 228 H3' DC 144 H3' C 144 3.671 7.377 6.865 229 H2' DC 144 H2' C 144 2.080 7.117 5.224 230 H2'' DC 144 H2" C 144 1.223 6.167 6.412 231 H1' DC 144 H1' C 144 -0.293 7.839 6.960 232 H41 DC 144 1H4 C 144 -2.833 9.849 1.554 233 H42 DC 144 2H4 C 144 -1.257 10.128 0.837 234 H8 DA 145 8H A 145 -0.243 4.868 5.914 235 H2 DA 145 2H A 145 -6.287 6.205 4.338 236 H5' DA 145 H5' A 145 0.093 7.211 9.724 237 H5'' DA 145 H5" A 145 0.234 5.814 10.814 238 H4' DA 145 H4' A 145 -2.147 6.339 10.368 239 H3' DA 145 H3' A 145 -1.064 3.776 10.183 240 H2' DA 145 H2' A 145 -0.845 3.911 7.812 241 H2'' DA 145 H2" A 145 -2.394 3.107 7.933 242 H1' DA 145 H1' A 145 -3.628 5.238 7.791 243 H61 DA 145 2H6 A 145 -1.948 5.809 1.536 244 H62 DA 145 1H6 A 145 -3.524 6.225 0.897 245 H8 DG 146 8H G 146 -3.853 1.894 7.231 246 H1 DG 146 1H G 146 -5.752 3.328 1.273 247 H5' DG 146 H5' G 146 -5.319 4.714 9.778 248 H5'' DG 146 H5" G 146 -6.492 4.513 11.049 249 H4' DG 146 H4' G 146 -7.907 4.002 9.422 250 H3' DG 146 H3' G 146 -6.768 1.496 10.325 251 H2' DG 146 H2' G 146 -5.704 0.973 8.366 252 H2'' DG 146 H2" G 146 -7.310 0.520 7.785 253 H1' DG 146 H1' G 146 -7.684 2.573 6.737 254 H21 DG 146 1H2 G 146 -7.888 3.643 1.238 255 H22 DG 146 2H2 G 146 -8.863 3.572 2.683 256 H8 DA 147 8H A 147 -6.877 -1.084 6.470 257 H2 DA 147 2H A 147 -6.543 0.335 0.234 258 H5' DA 147 H5' A 147 -10.199 1.864 7.502 259 H5'' DA 147 H5" A 147 -11.572 0.774 7.808 260 H4' DA 147 H4' A 147 -11.308 1.087 5.415 261 H3' DA 147 H3' A 147 -11.297 -1.492 6.617 262 H2' DA 147 H2' A 147 -9.064 -1.927 6.120 263 H2'' DA 147 H2" A 147 -9.754 -2.447 4.548 264 H1' DA 147 H1' A 147 -9.406 -0.273 3.569 265 H61 DA 147 2H6 A 147 -2.804 -0.509 3.783 266 H62 DA 147 1H6 A 147 -2.551 -0.234 2.057 267 H5 DC 148 5H C 148 -7.133 -3.634 3.262 268 H6 DC 148 6H C 148 -9.413 -3.519 2.389 269 H5' DC 148 H5' C 148 -12.315 -0.724 1.889 270 H5'' DC 148 H5" C 148 -13.783 -1.703 1.685 271 H4' DC 148 H4' C 148 -12.707 -1.620 -0.472 272 H3' DC 148 H3' C 148 -13.159 -4.109 0.786 273 H2' DC 148 H2' C 148 -10.956 -4.481 1.390 274 H2'' DC 148 H2" C 148 -10.862 -5.232 -0.210 275 H1' DC 148 H1' C 148 -10.132 -3.215 -1.267 276 H41 DC 148 1H4 C 148 -4.228 -3.112 1.055 277 H42 DC 148 2H4 C 148 -4.797 -3.442 2.679 278 H8 DG 149 8H G 149 -9.160 -6.963 -0.942 279 H1 DG 149 1H G 149 -2.822 -5.859 -1.158 280 H5' DG 149 H5' G 149 -10.945 -3.487 -3.273 281 H5'' DG 149 H5" G 149 -12.111 -4.279 -4.345 282 H4' DG 149 H4' G 149 -10.020 -4.471 -5.455 283 H3' DG 149 H3' G 149 -11.496 -6.747 -4.599 284 H2' DG 149 H2' G 149 -10.046 -7.397 -2.925 285 H2'' DG 149 H2" G 149 -9.197 -8.235 -4.223 286 H1' DG 149 H1' G 149 -7.662 -6.361 -4.508 287 H21 DG 149 1H2 G 149 -2.171 -5.643 -3.219 288 H22 DG 149 2H2 G 149 -3.322 -5.543 -4.538 289 H5 DC 150 5H C 150 -6.973 -9.724 -1.652 290 H6 DC 150 6H C 150 -7.167 -9.876 -4.060 291 H5' DC 150 H5' C 150 -8.146 -9.141 -5.746 292 H5'' DC 150 H5" C 150 -7.956 -7.443 -6.248 293 H4' DC 150 H4' C 150 -6.666 -8.203 -8.234 294 H3' DC 150 H3' C 150 -7.746 -10.704 -7.679 295 H2' DC 150 H2' C 150 -6.768 -11.132 -5.660 296 H2'' DC 150 H2" C 150 -5.412 -11.650 -6.623 297 H1' DC 150 H1' C 150 -4.172 -9.725 -6.310 298 H41 DC 150 1H4 C 150 -3.709 -9.465 -0.040 299 H42 DC 150 2H4 C 150 -5.445 -9.455 0.181 300 H5 DC 151 5H C 151 -5.116 -13.004 -4.385 301 H6 DC 151 6H C 151 -3.908 -12.884 -6.515 302 H5' DC 151 H5' C 151 -3.455 -10.237 -9.002 303 H5'' DC 151 H5" C 151 -3.246 -11.155 -10.498 304 H4' DC 151 H4' C 151 -1.079 -10.916 -9.529 305 H3' DC 151 H3' C 151 -2.054 -13.468 -10.044 306 H2' DC 151 H2' C 151 -2.719 -13.913 -7.849 307 H2'' DC 151 H2" C 151 -1.094 -14.556 -7.733 308 H1' DC 151 H1' C 151 -0.192 -12.569 -6.735 309 H41 DC 151 1H4 C 151 -3.322 -12.849 -1.200 310 H42 DC 151 2H4 C 151 -4.875 -12.903 -2.002 311 H5 DC 152 5H C 152 -3.105 -15.942 -5.026 312 H6 DC 152 6H C 152 -0.911 -15.940 -6.110 313 H5' DC 152 H5' C 152 1.715 -13.274 -7.523 314 H5'' DC 152 H5" C 152 2.974 -14.038 -8.517 315 H4' DC 152 H4' C 152 3.582 -14.673 -6.341 316 H3' DC 152 H3' C 152 2.577 -16.772 -8.006 317 H2' DC 152 H2' C 152 0.720 -17.218 -6.698 318 H2'' DC 152 H2" C 152 1.856 -18.160 -5.707 319 H1' DC 152 H1' C 152 2.280 -16.322 -4.215 320 H41 DC 152 1H4 C 152 -3.397 -16.164 -1.355 321 H42 DC 152 2H4 C 152 -4.235 -16.060 -2.894 322 H5 DC 153 5H C 153 -1.342 -19.537 -4.660 323 H6 DC 153 6H C 153 1.059 -19.943 -4.449 324 H5' DC 153 H5' C 153 4.516 -17.515 -4.098 325 H5'' DC 153 H5" C 153 5.888 -18.599 -4.417 326 H4' DC 153 H4' C 153 5.166 -19.155 -2.246 327 H3' DC 153 H3' C 153 4.839 -21.112 -4.325 328 H2' DC 153 H2' C 153 2.603 -21.278 -4.129 329 H2'' DC 153 H2" C 153 2.939 -22.329 -2.756 330 H1' DC 153 H1' C 153 2.735 -20.527 -1.146 331 H41 DC 153 1H4 C 153 -3.478 -19.167 -1.698 332 H42 DC 153 2H4 C 153 -3.378 -19.071 -3.442 333 H5 DC 154 5H C 154 -0.197 -22.920 -3.098 334 H6 DC 154 6H C 154 1.653 -23.522 -1.612 335 H5' DC 154 H5' C 154 4.579 -21.768 0.064 336 H5'' DC 154 H5" C 154 5.740 -23.046 0.451 337 H4' DC 154 H4' C 154 4.099 -23.058 2.164 338 H3' DC 154 H3' C 154 4.549 -25.353 0.495 339 H2' DC 154 H2' C 154 2.401 -25.422 -0.381 340 H2'' DC 154 H2" C 154 1.982 -26.124 1.204 341 H1' DC 154 H1' C 154 1.186 -24.058 2.066 342 H41 DC 154 1H4 C 154 -3.644 -22.709 -1.823 343 H42 DC 154 2H4 C 154 -2.581 -22.594 -3.214 344 H8 DG 155 8H G 155 0.551 -27.580 0.991 345 H1 DG 155 1H G 155 -5.499 -25.882 -0.354 346 H5' DG 155 H5' G 155 2.264 -25.524 4.480 347 H5'' DG 155 H5" G 155 2.781 -26.824 5.569 348 H4' DG 155 H4' G 155 0.414 -26.497 5.880 349 H3' DG 155 H3' G 155 1.456 -28.975 4.995 350 H2' DG 155 H2' G 155 0.498 -28.892 2.896 351 H2'' DG 155 H2" G 155 -0.911 -29.549 3.778 352 H1' DG 155 H1' G 155 -1.894 -27.360 4.048 353 H21 DG 155 1H2 G 155 -6.691 -25.838 1.474 354 H22 DG 155 2H2 G 155 -5.984 -26.172 3.047 355 H5 DC 156 5H C 156 -1.611 -30.579 1.159 356 H6 DC 156 6H C 156 -2.483 -30.940 3.417 357 H5' DC 156 H5' C 156 -2.658 -28.717 6.854 358 H5'' DC 156 H5" C 156 -2.984 -29.926 8.103 359 H4' DC 156 H4' C 156 -5.078 -29.384 7.008 360 H3' DC 156 H3' C 156 -3.993 -32.016 7.015 361 H2' DC 156 H2' C 156 -3.626 -32.117 4.758 362 H2'' DC 156 H2" C 156 -5.354 -32.522 4.740 363 H1' DC 156 H1' C 156 -6.054 -30.284 4.309 364 H41 DC 156 1H4 C 156 -3.813 -29.366 -1.534 365 H42 DC 156 2H4 C 156 -2.179 -29.776 -1.056 366 H8 DG 157 8H G 157 -6.387 -34.786 4.671 367 H1 DG 157 1H G 157 -6.866 -32.137 -1.158 368 H5' DG 157 H5' G 157 -8.670 -31.558 7.271 369 H5'' DG 157 H5" G 157 -9.492 -32.749 8.292 370 H4' DG 157 H4' G 157 -10.765 -32.341 6.240 371 H3' DG 157 H3' G 157 -10.131 -34.908 7.093 372 H2' DG 157 H2' G 157 -8.294 -35.217 5.647 373 H2'' DG 157 H2" G 157 -9.593 -35.863 4.589 374 H1' DG 157 H1' G 157 -9.943 -33.762 3.542 375 H21 DG 157 1H2 G 157 -8.951 -31.725 -1.603 376 H22 DG 157 2H2 G 157 -10.209 -31.962 -0.411 377 HA ALA 1 HA ALA 1 10.072 26.721 -13.778 378 H1 ALA 1 HN ALA 1 8.480 24.860 -14.233 379 HB1 ALA 1 1HB ALA 1 9.329 28.535 -12.261 380 HB2 ALA 1 2HB ALA 1 8.322 28.466 -13.724 381 HB3 ALA 1 3HB ALA 1 7.703 27.816 -12.190 382 H SER 2 HN SER 2 7.914 24.703 -11.923 383 HA SER 2 HA SER 2 9.258 24.722 -9.381 384 HG SER 2 HG SER 2 8.284 21.466 -10.804 385 HB2 SER 2 2HB SER 2 8.070 22.630 -8.976 386 HB3 SER 2 3HB SER 2 6.989 23.777 -9.782 387 H GLU 3 HN GLU 3 10.136 23.443 -12.488 388 HA GLU 3 HA GLU 3 11.790 21.250 -11.793 389 HB2 GLU 3 2HB GLU 3 12.053 23.321 -14.008 390 HB3 GLU 3 3HB GLU 3 13.025 21.864 -13.915 391 HG2 GLU 3 2HG GLU 3 11.206 21.677 -15.546 392 HG3 GLU 3 3HG GLU 3 11.136 20.440 -14.313 393 H LYS 4 HN LYS 4 12.230 24.685 -11.250 394 HA LYS 4 HA LYS 4 15.104 24.753 -11.032 395 HB2 LYS 4 2HB LYS 4 13.511 26.708 -11.223 396 HB3 LYS 4 3HB LYS 4 13.062 26.457 -9.535 397 HG2 LYS 4 2HG LYS 4 15.410 26.890 -8.848 398 HG3 LYS 4 3HG LYS 4 15.885 27.083 -10.540 399 HD2 LYS 4 2HD LYS 4 13.861 28.830 -9.064 400 HD3 LYS 4 3HD LYS 4 15.569 29.231 -9.307 401 HE2 LYS 4 2HE LYS 4 15.238 29.154 -11.771 402 HE3 LYS 4 3HE LYS 4 13.516 28.815 -11.522 403 HZ1 LYS 4 3HZ LYS 4 13.909 31.147 -11.901 404 HZ2 LYS 4 1HZ LYS 4 14.926 31.236 -10.610 405 HZ3 LYS 4 2HZ LYS 4 13.327 30.915 -10.377 406 H ARG 5 HN ARG 5 12.607 23.399 -8.986 407 HA ARG 5 HA ARG 5 14.500 23.236 -6.671 408 HE ARG 5 HE ARG 5 11.856 21.771 -2.549 409 HB2 ARG 5 2HB ARG 5 12.153 24.229 -6.404 410 HB3 ARG 5 3HB ARG 5 11.511 22.619 -6.662 411 HG2 ARG 5 2HG ARG 5 13.347 23.543 -4.401 412 HG3 ARG 5 3HG ARG 5 11.622 23.199 -4.303 413 HD2 ARG 5 2HD ARG 5 12.219 20.781 -4.962 414 HD3 ARG 5 3HD ARG 5 13.902 21.227 -4.611 415 HH11 ARG 5 1HH2 ARG 5 14.529 19.519 -3.414 416 HH12 ARG 5 2HH2 ARG 5 14.596 18.973 -1.769 417 HH21 ARG 5 1HH1 ARG 5 12.055 20.914 -0.555 418 HH22 ARG 5 2HH1 ARG 5 13.254 19.678 -0.246 419 HA PRO 6 HA PRO 6 14.789 18.910 -8.076 420 HB2 PRO 6 2HB PRO 6 17.052 18.264 -6.651 421 HB3 PRO 6 3HB PRO 6 17.088 19.221 -8.155 422 HG2 PRO 6 2HG PRO 6 17.180 20.244 -5.307 423 HG3 PRO 6 3HG PRO 6 18.215 20.711 -6.693 424 HD2 PRO 6 2HD PRO 6 16.026 22.143 -5.889 425 HD3 PRO 6 3HD PRO 6 16.536 22.068 -7.609 426 H PHE 7 HN PHE 7 12.784 18.500 -6.960 427 HA PHE 7 HA PHE 7 12.656 18.237 -4.079 428 HD1 PHE 7 1HD PHE 7 10.016 18.960 -3.110 429 HD2 PHE 7 2HD PHE 7 10.174 19.333 -7.398 430 HE1 PHE 7 1HE PHE 7 8.585 20.986 -2.999 431 HE2 PHE 7 2HE PHE 7 8.680 21.300 -7.285 432 HZ PHE 7 HZ PHE 7 7.897 22.153 -5.080 433 HB2 PHE 7 2HB PHE 7 10.849 17.323 -6.346 434 HB3 PHE 7 3HB PHE 7 10.460 17.039 -4.664 435 H MET 8 HN MET 8 14.820 16.717 -4.310 436 HA MET 8 HA MET 8 14.322 14.083 -4.998 437 HB2 MET 8 2HB MET 8 16.487 13.599 -4.208 438 HB3 MET 8 3HB MET 8 16.539 15.260 -4.791 439 HG2 MET 8 2HG MET 8 16.376 14.436 -1.871 440 HG3 MET 8 3HG MET 8 17.840 14.866 -2.733 441 HE1 MET 8 3HE MET 8 18.329 16.449 -0.650 442 HE2 MET 8 1HE MET 8 17.246 17.764 -0.138 443 HE3 MET 8 2HE MET 8 16.739 16.069 0.056 444 H CYS 9 HN CYS 9 13.937 12.206 -4.062 445 HA CYS 9 HA CYS 9 12.356 12.146 -1.662 446 HB2 CYS 9 2HB CYS 9 12.175 10.481 -3.487 447 HB3 CYS 9 3HB CYS 9 13.813 9.918 -3.173 448 H ALA 10 HN ALA 10 12.971 10.644 0.220 449 HA ALA 10 HA ALA 10 15.832 11.074 1.019 450 HB1 ALA 10 1HB ALA 10 14.324 12.562 2.294 451 HB2 ALA 10 2HB ALA 10 13.361 11.157 2.809 452 HB3 ALA 10 3HB ALA 10 15.047 11.329 3.348 453 H TYR 11 HN TYR 11 13.370 8.835 0.308 454 HA TYR 11 HA TYR 11 13.896 6.808 2.260 455 HD1 TYR 11 1HD TYR 11 10.974 6.178 2.564 456 HD2 TYR 11 2HD TYR 11 13.234 3.826 -0.250 457 HE1 TYR 11 1HE TYR 11 10.259 4.103 3.743 458 HE2 TYR 11 2HE TYR 11 12.567 1.750 0.972 459 HH TYR 11 HH TYR 11 10.257 1.781 3.608 460 HB2 TYR 11 2HB TYR 11 11.929 7.146 0.547 461 HB3 TYR 11 3HB TYR 11 12.958 6.240 -0.552 462 HA PRO 12 HA PRO 12 17.806 5.175 0.865 463 HB2 PRO 12 2HB PRO 12 17.554 2.551 1.773 464 HB3 PRO 12 3HB PRO 12 17.919 3.955 2.813 465 HG2 PRO 12 2HG PRO 12 15.223 2.668 2.309 466 HG3 PRO 12 3HG PRO 12 15.960 3.121 3.881 467 HD2 PRO 12 2HD PRO 12 14.168 4.720 2.692 468 HD3 PRO 12 3HD PRO 12 15.607 5.439 3.470 469 H GLY 13 HN GLY 13 18.693 3.856 -0.816 470 HA2 GLY 13 2HA GLY 13 18.637 2.575 -2.763 471 HA3 GLY 13 3HA GLY 13 16.970 2.100 -2.384 472 H CYS 14 HN CYS 14 16.015 4.910 -2.145 473 HA CYS 14 HA CYS 14 15.753 5.481 -5.042 474 HB2 CYS 14 2HB CYS 14 13.666 5.260 -3.769 475 HB3 CYS 14 3HB CYS 14 14.183 6.475 -2.595 476 H ASN 15 HN ASN 15 15.283 7.978 -2.601 477 HA ASN 15 HA ASN 15 16.187 10.070 -2.342 478 HB2 ASN 15 2HB ASN 15 18.174 8.661 -1.631 479 HB3 ASN 15 3HB ASN 15 18.838 8.871 -3.246 480 HD21 ASN 15 1HD2 ASN 15 17.193 11.589 -1.343 481 HD22 ASN 15 2HD2 ASN 15 18.773 12.376 -1.215 482 H LYS 16 HN LYS 16 15.342 8.956 -5.167 483 HA LYS 16 HA LYS 16 16.902 10.392 -7.100 484 HB2 LYS 16 2HB LYS 16 14.062 9.278 -7.220 485 HB3 LYS 16 3HB LYS 16 14.959 9.892 -8.616 486 HG2 LYS 16 2HG LYS 16 16.757 8.200 -8.167 487 HG3 LYS 16 3HG LYS 16 15.759 7.501 -6.892 488 HD2 LYS 16 2HD LYS 16 14.987 7.732 -9.833 489 HD3 LYS 16 3HD LYS 16 15.611 6.276 -9.058 490 HE2 LYS 16 2HE LYS 16 13.005 7.665 -8.288 491 HE3 LYS 16 3HE LYS 16 13.135 6.272 -9.373 492 HZ1 LYS 16 3HZ LYS 16 14.199 5.083 -7.501 493 HZ2 LYS 16 1HZ LYS 16 12.629 5.506 -7.208 494 HZ3 LYS 16 2HZ LYS 16 13.841 6.358 -6.516 495 H ARG 17 HN ARG 17 16.320 12.231 -8.378 496 HA ARG 17 HA ARG 17 15.029 14.256 -6.670 497 HE ARG 17 HE ARG 17 18.992 14.954 -9.796 498 HB2 ARG 17 2HB ARG 17 16.592 14.741 -9.220 499 HB3 ARG 17 3HB ARG 17 16.247 15.874 -7.916 500 HG2 ARG 17 2HG ARG 17 17.729 14.370 -6.423 501 HG3 ARG 17 3HG ARG 17 18.209 13.539 -7.902 502 HD2 ARG 17 2HD ARG 17 18.531 16.512 -7.331 503 HD3 ARG 17 3HD ARG 17 19.819 15.301 -7.259 504 HH11 ARG 17 2HH1 ARG 17 19.762 17.981 -8.167 505 HH12 ARG 17 1HH1 ARG 17 20.191 18.761 -9.674 506 HH21 ARG 17 2HH2 ARG 17 19.575 16.009 -11.643 507 HH22 ARG 17 1HH2 ARG 17 20.103 17.673 -11.567 508 H TYR 18 HN TYR 18 13.031 14.962 -7.023 509 HA TYR 18 HA TYR 18 11.843 14.594 -9.711 510 HD1 TYR 18 2HD TYR 18 11.881 13.154 -6.140 511 HD2 TYR 18 1HD TYR 18 9.098 13.081 -9.451 512 HE1 TYR 18 2HE TYR 18 12.011 10.716 -6.197 513 HE2 TYR 18 1HE TYR 18 9.315 10.630 -9.555 514 HH TYR 18 HH TYR 18 11.162 8.828 -7.181 515 HB2 TYR 18 2HB TYR 18 10.678 15.271 -6.985 516 HB3 TYR 18 3HB TYR 18 9.732 15.206 -8.433 517 H PHE 19 HN PHE 19 10.242 16.349 -10.418 518 HA PHE 19 HA PHE 19 11.561 19.034 -10.067 519 HD1 PHE 19 1HD PHE 19 13.383 19.617 -11.466 520 HD2 PHE 19 2HD PHE 19 11.654 16.267 -13.573 521 HE1 PHE 19 1HE PHE 19 15.633 18.891 -12.158 522 HE2 PHE 19 2HE PHE 19 13.924 15.535 -14.253 523 HZ PHE 19 HZ PHE 19 15.918 16.843 -13.550 524 HB2 PHE 19 2HB PHE 19 10.211 17.791 -12.499 525 HB3 PHE 19 3HB PHE 19 10.781 19.444 -12.409 526 H LYS 20 HN LYS 20 8.758 17.282 -9.432 527 HA LYS 20 HA LYS 20 7.228 19.804 -9.045 528 HB2 LYS 20 2HB LYS 20 6.419 17.411 -10.669 529 HB3 LYS 20 3HB LYS 20 5.143 18.252 -9.717 530 HG2 LYS 20 2HG LYS 20 5.823 20.369 -10.774 531 HG3 LYS 20 3HG LYS 20 7.103 19.525 -11.670 532 HD2 LYS 20 2HD LYS 20 5.251 18.161 -12.775 533 HD3 LYS 20 3HD LYS 20 4.118 19.357 -12.110 534 HE2 LYS 20 2HE LYS 20 6.512 19.886 -13.945 535 HE3 LYS 20 3HE LYS 20 4.804 19.974 -14.410 536 HZ1 LYS 20 3HZ LYS 20 6.176 21.717 -12.460 537 HZ2 LYS 20 1HZ LYS 20 4.575 21.822 -12.861 538 HZ3 LYS 20 2HZ LYS 20 5.743 22.135 -13.986 539 H LEU 21 HN LEU 21 5.737 19.715 -7.296 540 HA LEU 21 HA LEU 21 6.745 18.006 -5.152 541 HG LEU 21 HG LEU 21 6.838 19.463 -3.188 542 HB2 LEU 21 2HB LEU 21 5.853 20.517 -5.123 543 HB3 LEU 21 3HB LEU 21 4.299 19.759 -4.854 544 HD11 LEU 21 1HD1 LEU 21 4.191 20.773 -2.507 545 HD12 LEU 21 2HD1 LEU 21 5.694 21.613 -2.932 546 HD13 LEU 21 3HD1 LEU 21 5.610 20.655 -1.447 547 HD21 LEU 21 3HD2 LEU 21 5.468 18.286 -1.471 548 HD22 LEU 21 1HD2 LEU 21 5.888 17.354 -2.898 549 HD23 LEU 21 2HD2 LEU 21 4.252 18.002 -2.734 550 H SER 22 HN SER 22 3.566 18.412 -6.843 551 HA SER 22 HA SER 22 2.244 16.222 -5.491 552 HG SER 22 HG SER 22 0.991 18.221 -8.800 553 HB2 SER 22 2HB SER 22 0.611 16.429 -7.419 554 HB3 SER 22 3HB SER 22 0.907 17.923 -6.509 555 H HIS 23 HN HIS 23 4.204 16.452 -8.397 556 HA HIS 23 HA HIS 23 3.603 13.769 -9.390 557 HD1 HIS 23 1HD HIS 23 6.414 14.140 -12.745 558 HD2 HIS 23 2HD HIS 23 7.724 15.489 -9.024 559 HE1 HIS 23 1HE HIS 23 8.919 14.585 -12.964 560 HB2 HIS 23 2HB HIS 23 4.585 14.546 -11.132 561 HB3 HIS 23 3HB HIS 23 4.928 16.015 -10.384 562 H LEU 24 HN LEU 24 6.405 15.215 -7.593 563 HA LEU 24 HA LEU 24 7.540 12.829 -6.719 564 HG LEU 24 HG LEU 24 9.707 14.878 -4.571 565 HB2 LEU 24 2HB LEU 24 8.539 14.992 -6.430 566 HB3 LEU 24 3HB LEU 24 7.303 15.519 -5.351 567 HD11 LEU 24 1HD1 LEU 24 8.017 15.848 -3.141 568 HD12 LEU 24 2HD1 LEU 24 8.873 14.547 -2.296 569 HD13 LEU 24 3HD1 LEU 24 7.240 14.264 -2.926 570 HD21 LEU 24 3HD2 LEU 24 9.213 12.373 -5.320 571 HD22 LEU 24 1HD2 LEU 24 8.545 12.308 -3.665 572 HD23 LEU 24 2HD2 LEU 24 10.217 12.784 -3.922 573 H GLN 25 HN GLN 25 4.629 14.473 -5.372 574 HA GLN 25 HA GLN 25 4.341 12.843 -3.036 575 HB2 GLN 25 2HB GLN 25 3.048 14.885 -3.308 576 HB3 GLN 25 3HB GLN 25 2.232 14.240 -4.727 577 HG2 GLN 25 2HG GLN 25 1.086 12.542 -3.438 578 HG3 GLN 25 3HG GLN 25 1.905 13.071 -1.968 579 HE21 GLN 25 1HE2 GLN 25 -0.574 13.206 -1.334 580 HE22 GLN 25 2HE2 GLN 25 -1.278 14.774 -1.721 581 H MET 26 HN MET 26 3.268 12.364 -6.433 582 HA MET 26 HA MET 26 1.901 9.876 -5.947 583 HB2 MET 26 2HB MET 26 1.717 11.276 -8.049 584 HB3 MET 26 3HB MET 26 3.335 10.715 -8.512 585 HG2 MET 26 2HG MET 26 1.616 9.319 -9.568 586 HG3 MET 26 3HG MET 26 2.564 8.373 -8.429 587 HE1 MET 26 3HE MET 26 -0.555 6.364 -7.554 588 HE2 MET 26 1HE MET 26 0.351 6.630 -9.060 589 HE3 MET 26 2HE MET 26 1.218 6.398 -7.520 590 H HIS 27 HN HIS 27 5.321 10.692 -6.815 591 HA HIS 27 HA HIS 27 6.329 8.011 -6.917 592 HD1 HIS 27 1HD HIS 27 8.964 7.097 -6.815 593 HD2 HIS 27 2HD HIS 27 9.368 10.414 -4.258 594 HE1 HIS 27 1HE HIS 27 10.861 6.573 -5.142 595 HB2 HIS 27 2HB HIS 27 7.822 9.687 -7.632 596 HB3 HIS 27 3HB HIS 27 7.589 10.691 -6.210 597 H SER 28 HN SER 28 5.834 10.256 -4.170 598 HA SER 28 HA SER 28 7.057 8.773 -2.163 599 HG SER 28 HG SER 28 6.360 11.563 -2.947 600 HB2 SER 28 2HB SER 28 4.532 10.467 -1.850 601 HB3 SER 28 3HB SER 28 5.691 10.045 -0.602 602 H ARG 29 HN ARG 29 3.971 8.169 -3.784 603 HA ARG 29 HA ARG 29 2.625 6.642 -1.792 604 HE ARG 29 HE ARG 29 1.883 3.224 -2.712 605 HB2 ARG 29 2HB ARG 29 1.695 7.404 -3.974 606 HB3 ARG 29 3HB ARG 29 2.663 6.203 -4.814 607 HG2 ARG 29 2HG ARG 29 0.742 5.214 -2.709 608 HG3 ARG 29 3HG ARG 29 0.095 5.880 -4.202 609 HD2 ARG 29 2HD ARG 29 0.217 3.665 -4.772 610 HD3 ARG 29 3HD ARG 29 1.719 4.285 -5.455 611 HH11 ARG 29 1HH1 ARG 29 2.573 2.473 -6.085 612 HH12 ARG 29 2HH1 ARG 29 3.669 1.180 -5.616 613 HH21 ARG 29 1HH2 ARG 29 3.103 1.522 -2.239 614 HH22 ARG 29 2HH2 ARG 29 3.848 0.556 -3.490 615 H LYS 30 HN LYS 30 5.250 5.730 -4.072 616 HA LYS 30 HA LYS 30 5.245 2.885 -3.606 617 HB2 LYS 30 2HB LYS 30 6.558 3.856 -5.411 618 HB3 LYS 30 3HB LYS 30 7.486 4.838 -4.268 619 HG2 LYS 30 2HG LYS 30 8.498 2.839 -3.281 620 HG3 LYS 30 3HG LYS 30 7.548 1.797 -4.357 621 HD2 LYS 30 2HD LYS 30 8.766 2.609 -6.290 622 HD3 LYS 30 3HD LYS 30 9.489 3.928 -5.348 623 HE2 LYS 30 2HE LYS 30 11.137 2.165 -5.700 624 HE3 LYS 30 3HE LYS 30 10.751 2.339 -3.981 625 HZ1 LYS 30 3HZ LYS 30 9.577 0.279 -5.729 626 HZ2 LYS 30 1HZ LYS 30 9.389 0.426 -4.089 627 HZ3 LYS 30 2HZ LYS 30 10.856 0.037 -4.714 628 H HIS 31 HN HIS 31 6.661 5.628 -1.840 629 HA HIS 31 HA HIS 31 8.014 3.826 0.067 630 HD1 HIS 31 1HD HIS 31 9.939 3.544 -0.956 631 HD2 HIS 31 2HD HIS 31 10.056 7.698 -1.712 632 HE1 HIS 31 1HE HIS 31 11.777 3.919 -2.645 633 HB2 HIS 31 2HB HIS 31 7.979 6.856 -0.215 634 HB3 HIS 31 3HB HIS 31 8.914 5.962 0.993 635 H THR 32 HN THR 32 4.876 4.731 -0.194 636 HA THR 32 HA THR 32 4.487 5.598 2.645 637 HB THR 32 HB THR 32 3.205 6.626 0.493 638 HG1 THR 32 1HG THR 32 1.864 6.073 2.889 639 HG21 THR 32 3HG2 THR 32 0.933 5.895 0.311 640 HG22 THR 32 1HG2 THR 32 1.140 4.625 1.528 641 HG23 THR 32 2HG2 THR 32 1.912 4.468 -0.054 642 H GLY 33 HN GLY 33 4.371 2.951 0.376 643 HA2 GLY 33 2HA GLY 33 2.974 1.224 2.380 644 HA3 GLY 33 3HA GLY 33 3.222 0.823 0.673 645 H GLU 34 HN GLU 34 5.991 2.315 1.986 646 HA GLU 34 HA GLU 34 7.287 -0.330 2.509 647 HB2 GLU 34 2HB GLU 34 8.443 2.211 1.299 648 HB3 GLU 34 3HB GLU 34 9.410 0.799 1.795 649 HG2 GLU 34 2HG GLU 34 8.392 -0.685 0.301 650 HG3 GLU 34 3HG GLU 34 7.139 0.448 -0.156 651 H LYS 35 HN LYS 35 6.104 0.342 4.664 652 HA LYS 35 HA LYS 35 7.915 2.105 6.273 653 HB2 LYS 35 2HB LYS 35 5.032 1.315 6.825 654 HB3 LYS 35 3HB LYS 35 5.982 2.481 7.744 655 HG2 LYS 35 2HG LYS 35 5.119 2.754 4.813 656 HG3 LYS 35 3HG LYS 35 4.303 3.486 6.161 657 HD2 LYS 35 2HD LYS 35 7.170 4.122 5.333 658 HD3 LYS 35 3HD LYS 35 5.739 5.062 4.898 659 HE2 LYS 35 2HE LYS 35 5.251 5.471 7.292 660 HE3 LYS 35 3HE LYS 35 6.700 4.559 7.743 661 HZ1 LYS 35 3HZ LYS 35 7.150 6.903 7.707 662 HZ2 LYS 35 1HZ LYS 35 6.656 7.040 6.143 663 HZ3 LYS 35 2HZ LYS 35 8.005 6.170 6.505 664 HA PRO 36 HA PRO 36 8.971 -1.978 7.804 665 HB2 PRO 36 2HB PRO 36 11.193 -1.286 9.300 666 HB3 PRO 36 3HB PRO 36 11.171 -1.334 7.522 667 HG2 PRO 36 2HG PRO 36 10.805 1.094 9.297 668 HG3 PRO 36 3HG PRO 36 11.896 0.902 7.884 669 HD2 PRO 36 2HD PRO 36 9.463 2.086 7.679 670 HD3 PRO 36 3HD PRO 36 10.093 1.043 6.361 671 H TYR 37 HN TYR 37 7.074 -2.312 9.065 672 HA TYR 37 HA TYR 37 7.127 -1.388 11.915 673 HD1 TYR 37 1HD TYR 37 4.476 -0.572 12.988 674 HD2 TYR 37 2HD TYR 37 4.604 -1.235 8.732 675 HE1 TYR 37 1HE TYR 37 3.153 1.501 12.636 676 HE2 TYR 37 2HE TYR 37 3.312 0.882 8.378 677 HH TYR 37 HH TYR 37 2.542 3.119 10.884 678 HB2 TYR 37 2HB TYR 37 5.132 -3.044 10.300 679 HB3 TYR 37 3HB TYR 37 5.023 -2.763 12.023 680 H GLN 38 HN GLN 38 6.556 -3.194 13.556 681 HA GLN 38 HA GLN 38 7.760 -5.815 12.901 682 HB2 GLN 38 2HB GLN 38 9.521 -4.427 14.095 683 HB3 GLN 38 3HB GLN 38 8.434 -4.331 15.478 684 HG2 GLN 38 2HG GLN 38 8.577 -6.818 15.734 685 HG3 GLN 38 3HG GLN 38 9.641 -6.887 14.320 686 HE21 GLN 38 1HE2 GLN 38 11.732 -7.557 15.306 687 HE22 GLN 38 2HE2 GLN 38 12.318 -6.536 16.622 688 H CYS 39 HN CYS 39 6.930 -7.514 14.294 689 HA CYS 39 HA CYS 39 4.150 -7.081 15.038 690 HB2 CYS 39 2HB CYS 39 5.119 -9.268 14.168 691 HB3 CYS 39 3HB CYS 39 5.890 -9.408 15.774 692 H ASP 40 HN ASP 40 3.245 -6.699 17.001 693 HA ASP 40 HA ASP 40 4.951 -5.835 19.195 694 HB2 ASP 40 2HB ASP 40 2.835 -5.463 20.387 695 HB3 ASP 40 3HB ASP 40 2.812 -4.746 18.785 696 H PHE 41 HN PHE 41 3.993 -8.917 18.094 697 HA PHE 41 HA PHE 41 3.745 -10.287 20.650 698 HD1 PHE 41 1HD PHE 41 1.572 -11.734 19.923 699 HD2 PHE 41 2HD PHE 41 5.329 -13.750 19.315 700 HE1 PHE 41 1HE PHE 41 0.652 -13.764 21.012 701 HE2 PHE 41 2HE PHE 41 4.391 -15.796 20.354 702 HZ PHE 41 HZ PHE 41 2.055 -15.810 21.212 703 HB2 PHE 41 2HB PHE 41 3.217 -11.048 18.166 704 HB3 PHE 41 3HB PHE 41 4.879 -11.610 18.182 705 H LYS 42 HN LYS 42 6.372 -8.864 18.847 706 HA LYS 42 HA LYS 42 8.579 -8.502 19.414 707 HB2 LYS 42 2HB LYS 42 7.579 -8.110 21.693 708 HB3 LYS 42 3HB LYS 42 7.898 -9.784 22.118 709 HG2 LYS 42 2HG LYS 42 10.385 -9.293 21.516 710 HG3 LYS 42 3HG LYS 42 9.899 -7.597 21.510 711 HD2 LYS 42 2HD LYS 42 10.798 -8.084 23.676 712 HD3 LYS 42 3HD LYS 42 9.044 -7.930 23.886 713 HE2 LYS 42 2HE LYS 42 8.831 -10.415 23.843 714 HE3 LYS 42 3HE LYS 42 10.569 -10.567 23.570 715 HZ1 LYS 42 3HZ LYS 42 9.308 -9.387 25.956 716 HZ2 LYS 42 1HZ LYS 42 10.932 -9.529 25.704 717 HZ3 LYS 42 2HZ LYS 42 10.000 -10.879 25.860 718 H ASP 43 HN ASP 43 7.888 -11.630 21.084 719 HA ASP 43 HA ASP 43 10.511 -12.662 20.470 720 HB2 ASP 43 2HB ASP 43 7.981 -14.089 21.408 721 HB3 ASP 43 3HB ASP 43 9.614 -14.775 21.426 722 H CYS 44 HN CYS 44 7.595 -12.509 18.594 723 HA CYS 44 HA CYS 44 8.108 -14.820 16.906 724 HB2 CYS 44 2HB CYS 44 6.258 -14.157 15.719 725 HB3 CYS 44 3HB CYS 44 5.880 -13.396 17.253 726 H GLU 45 HN GLU 45 9.063 -11.373 16.971 727 HA GLU 45 HA GLU 45 10.646 -10.198 15.822 728 HB2 GLU 45 2HB GLU 45 11.854 -12.554 16.497 729 HB3 GLU 45 3HB GLU 45 12.063 -12.637 14.761 730 HG2 GLU 45 2HG GLU 45 12.934 -10.407 16.654 731 HG3 GLU 45 3HG GLU 45 13.980 -11.582 15.870 732 H ARG 46 HN ARG 46 8.181 -10.761 14.421 733 HA ARG 46 HA ARG 46 9.092 -11.060 11.591 734 HE ARG 46 HE ARG 46 9.012 -13.821 13.178 735 HB2 ARG 46 2HB ARG 46 6.288 -10.856 12.786 736 HB3 ARG 46 3HB ARG 46 6.659 -10.976 11.074 737 HG2 ARG 46 2HG ARG 46 6.965 -13.136 13.170 738 HG3 ARG 46 3HG ARG 46 5.962 -13.097 11.733 739 HD2 ARG 46 2HD ARG 46 7.582 -14.492 10.982 740 HD3 ARG 46 3HD ARG 46 8.288 -12.950 10.458 741 HH11 ARG 46 2HH1 ARG 46 10.159 -13.925 9.849 742 HH12 ARG 46 1HH1 ARG 46 11.791 -14.292 10.386 743 HH21 ARG 46 1HH2 ARG 46 10.926 -14.246 13.728 744 HH22 ARG 46 2HH2 ARG 46 12.254 -14.472 12.581 745 H ARG 47 HN ARG 47 8.680 -9.424 10.065 746 HA ARG 47 HA ARG 47 7.983 -6.755 11.190 747 HE ARG 47 HE ARG 47 12.984 -6.478 9.239 748 HB2 ARG 47 2HB ARG 47 10.334 -7.454 9.386 749 HB3 ARG 47 3HB ARG 47 9.727 -5.807 9.578 750 HG2 ARG 47 2HG ARG 47 10.108 -5.943 12.033 751 HG3 ARG 47 3HG ARG 47 10.814 -7.551 11.832 752 HD2 ARG 47 2HD ARG 47 11.842 -4.968 10.568 753 HD3 ARG 47 3HD ARG 47 12.519 -5.731 12.004 754 HH11 ARG 47 1HH1 ARG 47 12.909 -7.867 12.475 755 HH12 ARG 47 2HH1 ARG 47 13.984 -9.156 12.079 756 HH21 ARG 47 1HH2 ARG 47 14.375 -8.161 8.753 757 HH22 ARG 47 2HH2 ARG 47 14.800 -9.300 10.019 758 H PHE 48 HN PHE 48 7.152 -5.247 9.645 759 HA PHE 48 HA PHE 48 6.009 -6.546 7.195 760 HD1 PHE 48 1HD PHE 48 3.819 -7.768 6.943 761 HD2 PHE 48 2HD PHE 48 4.732 -6.865 11.060 762 HE1 PHE 48 1HE PHE 48 3.736 -10.176 7.479 763 HE2 PHE 48 2HE PHE 48 4.756 -9.287 11.572 764 HZ PHE 48 HZ PHE 48 4.346 -10.938 9.756 765 HB2 PHE 48 2HB PHE 48 4.524 -5.074 9.407 766 HB3 PHE 48 3HB PHE 48 3.812 -5.408 7.825 767 H SER 49 HN SER 49 4.982 -4.957 5.712 768 HA SER 49 HA SER 49 6.750 -2.566 5.581 769 HG SER 49 HG SER 49 5.842 -1.828 2.666 770 HB2 SER 49 2HB SER 49 6.621 -4.335 3.736 771 HB3 SER 49 3HB SER 49 4.992 -3.751 3.378 772 H ARG 50 HN ARG 50 3.564 -3.333 6.487 773 HA ARG 50 HA ARG 50 2.811 -0.486 6.366 774 HE ARG 50 HE ARG 50 -0.729 -2.277 3.238 775 HB2 ARG 50 2HB ARG 50 1.334 -2.668 4.854 776 HB3 ARG 50 3HB ARG 50 0.448 -1.345 5.596 777 HG2 ARG 50 2HG ARG 50 2.050 0.253 4.356 778 HG3 ARG 50 3HG ARG 50 2.453 -1.154 3.353 779 HD2 ARG 50 2HD ARG 50 -0.338 0.003 3.837 780 HD3 ARG 50 3HD ARG 50 0.614 0.252 2.391 781 HH11 ARG 50 1HH1 ARG 50 1.132 -0.624 0.771 782 HH12 ARG 50 2HH1 ARG 50 0.716 -1.862 -0.418 783 HH21 ARG 50 1HH2 ARG 50 -1.069 -3.808 1.678 784 HH22 ARG 50 2HH2 ARG 50 -0.422 -3.553 0.079 785 H SER 51 HN SER 51 1.020 0.038 7.759 786 HA SER 51 HA SER 51 1.014 -1.347 10.246 787 HG SER 51 HG SER 51 0.949 1.746 9.590 788 HB2 SER 51 2HB SER 51 -1.427 0.209 9.671 789 HB3 SER 51 3HB SER 51 -0.229 0.432 10.942 790 H ASP 52 HN ASP 52 -1.320 -1.333 7.517 791 HA ASP 52 HA ASP 52 -3.222 -3.060 8.718 792 HB2 ASP 52 2HB ASP 52 -3.965 -3.446 6.320 793 HB3 ASP 52 3HB ASP 52 -3.868 -1.780 6.885 794 H GLN 53 HN GLN 53 -0.268 -3.810 6.819 795 HA GLN 53 HA GLN 53 -0.816 -6.644 6.549 796 HB2 GLN 53 2HB GLN 53 0.868 -5.193 5.217 797 HB3 GLN 53 3HB GLN 53 1.936 -5.343 6.603 798 HG2 GLN 53 2HG GLN 53 2.556 -7.054 5.051 799 HG3 GLN 53 3HG GLN 53 1.710 -7.870 6.376 800 HE21 GLN 53 1HE2 GLN 53 1.140 -9.735 5.137 801 HE22 GLN 53 2HE2 GLN 53 -0.006 -9.532 3.783 802 H LEU 54 HN LEU 54 0.996 -4.637 8.909 803 HA LEU 54 HA LEU 54 1.864 -6.792 10.606 804 HG LEU 54 HG LEU 54 0.945 -4.536 13.185 805 HB2 LEU 54 2HB LEU 54 2.914 -4.694 10.885 806 HB3 LEU 54 3HB LEU 54 1.402 -3.822 10.927 807 HD11 LEU 54 1HD1 LEU 54 3.618 -6.013 13.053 808 HD12 LEU 54 2HD1 LEU 54 2.034 -6.785 13.211 809 HD13 LEU 54 3HD1 LEU 54 2.617 -5.744 14.503 810 HD21 LEU 54 3HD2 LEU 54 3.826 -3.722 13.329 811 HD22 LEU 54 1HD2 LEU 54 2.447 -3.110 14.205 812 HD23 LEU 54 2HD2 LEU 54 2.662 -2.610 12.522 813 H LYS 55 HN LYS 55 -1.079 -4.684 10.640 814 HA LYS 55 HA LYS 55 -2.329 -5.847 12.926 815 HB2 LYS 55 2HB LYS 55 -3.381 -4.422 10.462 816 HB3 LYS 55 3HB LYS 55 -4.487 -5.062 11.681 817 HG2 LYS 55 2HG LYS 55 -3.568 -3.713 13.420 818 HG3 LYS 55 3HG LYS 55 -2.186 -3.225 12.433 819 HD2 LYS 55 2HD LYS 55 -3.645 -1.937 10.933 820 HD3 LYS 55 3HD LYS 55 -5.082 -2.520 11.788 821 HE2 LYS 55 2HE LYS 55 -4.560 -0.253 12.513 822 HE3 LYS 55 3HE LYS 55 -4.345 -1.390 13.853 823 HZ1 LYS 55 3HZ LYS 55 -2.535 0.167 13.722 824 HZ2 LYS 55 1HZ LYS 55 -2.195 -0.271 12.178 825 HZ3 LYS 55 2HZ LYS 55 -1.973 -1.353 13.402 826 H ARG 56 HN ARG 56 -2.519 -6.731 9.429 827 HA ARG 56 HA ARG 56 -4.299 -8.954 9.700 828 HE ARG 56 HE ARG 56 -3.818 -8.845 5.038 829 HB2 ARG 56 2HB ARG 56 -3.590 -7.982 7.512 830 HB3 ARG 56 3HB ARG 56 -1.955 -8.553 7.786 831 HG2 ARG 56 2HG ARG 56 -3.075 -10.939 7.940 832 HG3 ARG 56 3HG ARG 56 -4.422 -10.163 7.117 833 HD2 ARG 56 2HD ARG 56 -1.530 -10.082 6.126 834 HD3 ARG 56 3HD ARG 56 -2.643 -11.379 5.716 835 HH11 ARG 56 1HH1 ARG 56 -1.529 -11.238 3.785 836 HH12 ARG 56 2HH1 ARG 56 -1.492 -10.457 2.218 837 HH21 ARG 56 1HH2 ARG 56 -3.849 -8.114 2.837 838 HH22 ARG 56 2HH2 ARG 56 -2.738 -8.927 1.738 839 H HIS 57 HN HIS 57 -0.700 -8.789 9.874 840 HA HIS 57 HA HIS 57 -0.255 -11.548 10.306 841 HD1 HIS 57 1HD HIS 57 2.455 -12.718 10.356 842 HD2 HIS 57 2HD HIS 57 2.563 -9.781 13.381 843 HE1 HIS 57 1HE HIS 57 3.806 -13.692 12.310 844 HB2 HIS 57 2HB HIS 57 1.557 -10.071 9.748 845 HB3 HIS 57 3HB HIS 57 1.321 -9.084 11.189 846 H GLN 58 HN GLN 58 -0.845 -8.904 12.666 847 HA GLN 58 HA GLN 58 -0.488 -10.324 15.052 848 HB2 GLN 58 2HB GLN 58 -2.000 -7.905 14.207 849 HB3 GLN 58 3HB GLN 58 -2.605 -8.688 15.674 850 HG2 GLN 58 2HG GLN 58 0.328 -7.981 15.217 851 HG3 GLN 58 3HG GLN 58 -0.827 -6.960 16.079 852 HE21 GLN 58 1HE2 GLN 58 1.639 -9.316 16.726 853 HE22 GLN 58 2HE2 GLN 58 0.874 -9.779 18.249 854 H ARG 59 HN ARG 59 -3.312 -10.433 12.804 855 HA ARG 59 HA ARG 59 -5.179 -11.709 14.588 856 HE ARG 59 HE ARG 59 -6.499 -10.035 15.123 857 HB2 ARG 59 2HB ARG 59 -4.926 -11.526 11.587 858 HB3 ARG 59 3HB ARG 59 -5.936 -12.763 12.262 859 HG2 ARG 59 2HG ARG 59 -7.169 -10.724 11.679 860 HG3 ARG 59 3HG ARG 59 -7.365 -11.215 13.352 861 HD2 ARG 59 2HD ARG 59 -5.441 -9.056 12.547 862 HD3 ARG 59 3HD ARG 59 -7.146 -8.728 12.847 863 HH11 ARG 59 1HH2 ARG 59 -4.642 -7.457 13.635 864 HH12 ARG 59 2HH2 ARG 59 -4.319 -6.704 15.190 865 HH21 ARG 59 1HH1 ARG 59 -5.758 -9.255 16.989 866 HH22 ARG 59 2HH1 ARG 59 -4.869 -7.744 17.051 867 H ARG 60 HN ARG 60 -2.420 -12.972 12.727 868 HA ARG 60 HA ARG 60 -3.011 -15.788 12.950 869 HE ARG 60 HE ARG 60 0.949 -18.585 11.863 870 HB2 ARG 60 2HB ARG 60 -1.254 -14.781 11.470 871 HB3 ARG 60 3HB ARG 60 -0.282 -14.417 12.910 872 HG2 ARG 60 2HG ARG 60 -0.065 -16.786 13.450 873 HG3 ARG 60 3HG ARG 60 -1.114 -17.211 12.093 874 HD2 ARG 60 2HD ARG 60 0.624 -15.985 10.597 875 HD3 ARG 60 3HD ARG 60 1.652 -15.923 12.028 876 HH11 ARG 60 1HH1 ARG 60 2.543 -16.430 9.559 877 HH12 ARG 60 2HH1 ARG 60 3.430 -17.758 8.844 878 HH21 ARG 60 2HH2 ARG 60 2.087 -20.191 10.861 879 HH22 ARG 60 1HH2 ARG 60 3.158 -19.809 9.533 880 H HIS 61 HN HIS 61 -1.517 -13.434 15.195 881 HA HIS 61 HA HIS 61 -0.726 -15.556 17.099 882 HD1 HIS 61 1HD HIS 61 1.821 -15.568 17.638 883 HD2 HIS 61 2HD HIS 61 1.619 -11.716 15.944 884 HE1 HIS 61 1HE HIS 61 4.136 -15.051 16.670 885 HB2 HIS 61 2HB HIS 61 -0.547 -12.512 17.145 886 HB3 HIS 61 3HB HIS 61 -0.097 -13.521 18.503 887 H THR 62 HN THR 62 -3.301 -13.162 16.651 888 HA THR 62 HA THR 62 -4.250 -13.527 19.433 889 HB THR 62 HB THR 62 -5.827 -11.674 18.848 890 HG1 THR 62 1HG THR 62 -4.319 -11.441 16.493 891 HG21 THR 62 3HG2 THR 62 -2.920 -11.087 18.092 892 HG22 THR 62 1HG2 THR 62 -3.585 -11.127 19.731 893 HG23 THR 62 2HG2 THR 62 -4.144 -9.902 18.587 894 H GLY 63 HN GLY 63 -4.914 -14.915 16.354 895 HA2 GLY 63 2HA GLY 63 -6.521 -16.460 15.719 896 HA3 GLY 63 3HA GLY 63 -7.064 -16.515 17.405 897 H VAL 64 HN VAL 64 -7.130 -13.314 16.245 898 HA VAL 64 HA VAL 64 -9.988 -13.193 16.508 899 HB VAL 64 HB VAL 64 -7.891 -11.189 15.578 900 HG11 VAL 64 1HG1 VAL 64 -10.857 -10.667 16.084 901 HG12 VAL 64 2HG1 VAL 64 -9.605 -9.411 15.981 902 HG13 VAL 64 3HG1 VAL 64 -9.962 -10.389 14.570 903 HG21 VAL 64 3HG2 VAL 64 -8.254 -10.197 17.782 904 HG22 VAL 64 1HG2 VAL 64 -9.550 -11.360 18.134 905 HG23 VAL 64 2HG2 VAL 64 -7.878 -11.911 17.982 906 H LYS 65 HN LYS 65 -11.612 -13.155 15.044 907 HA LYS 65 HA LYS 65 -10.936 -13.000 12.140 908 HB2 LYS 65 2HB LYS 65 -12.780 -15.007 13.497 909 HB3 LYS 65 3HB LYS 65 -12.767 -14.668 11.758 910 HG2 LYS 65 2HG LYS 65 -10.541 -15.473 11.508 911 HG3 LYS 65 3HG LYS 65 -10.329 -15.698 13.259 912 HD2 LYS 65 2HD LYS 65 -11.949 -17.496 13.277 913 HD3 LYS 65 3HD LYS 65 -12.466 -17.111 11.629 914 HE2 LYS 65 2HE LYS 65 -10.073 -17.602 10.878 915 HE3 LYS 65 3HE LYS 65 -9.800 -18.281 12.491 916 HZ1 LYS 65 3HZ LYS 65 -10.465 -19.966 10.902 917 HZ2 LYS 65 1HZ LYS 65 -11.863 -19.156 10.564 918 HZ3 LYS 65 2HZ LYS 65 -11.628 -19.806 12.059 919 HA PRO 66 HA PRO 66 -14.191 -10.035 13.281 920 HB2 PRO 66 2HB PRO 66 -13.268 -7.838 11.947 921 HB3 PRO 66 3HB PRO 66 -12.501 -8.448 13.441 922 HG2 PRO 66 2HG PRO 66 -11.608 -8.832 10.593 923 HG3 PRO 66 3HG PRO 66 -10.613 -8.488 12.039 924 HD2 PRO 66 2HD PRO 66 -11.114 -10.989 10.896 925 HD3 PRO 66 3HD PRO 66 -10.501 -10.755 12.561 926 H PHE 67 HN PHE 67 -13.266 -11.341 10.178 927 HA PHE 67 HA PHE 67 -15.608 -10.040 8.816 928 HD1 PHE 67 2HD PHE 67 -14.588 -8.561 6.534 929 HD2 PHE 67 1HD PHE 67 -11.471 -10.824 8.446 930 HE1 PHE 67 2HE PHE 67 -13.051 -6.618 6.330 931 HE2 PHE 67 1HE PHE 67 -9.918 -8.890 8.214 932 HZ PHE 67 HZ PHE 67 -10.718 -6.785 7.155 933 HB2 PHE 67 2HB PHE 67 -13.503 -11.938 7.665 934 HB3 PHE 67 3HB PHE 67 -14.692 -11.009 6.771 935 H GLN 68 HN GLN 68 -17.532 -11.098 8.674 936 HA GLN 68 HA GLN 68 -17.510 -14.080 9.066 937 HB2 GLN 68 2HB GLN 68 -18.312 -12.859 11.100 938 HB3 GLN 68 3HB GLN 68 -19.628 -12.149 10.158 939 HG2 GLN 68 2HG GLN 68 -20.699 -14.253 9.867 940 HG3 GLN 68 3HG GLN 68 -19.219 -15.154 10.221 941 HE21 GLN 68 1HE2 GLN 68 -20.292 -16.478 11.814 942 HE22 GLN 68 2HE2 GLN 68 -20.727 -15.726 13.370 943 H CYS 69 HN CYS 69 -18.747 -15.259 7.690 944 HA CYS 69 HA CYS 69 -19.640 -14.068 5.262 945 HB2 CYS 69 2HB CYS 69 -18.972 -16.433 5.420 946 HB3 CYS 69 3HB CYS 69 -20.333 -16.770 6.491 947 H LYS 70 HN LYS 70 -21.737 -13.795 4.395 948 HA LYS 70 HA LYS 70 -23.815 -13.121 6.439 949 HB2 LYS 70 2HB LYS 70 -24.882 -11.968 4.327 950 HB3 LYS 70 3HB LYS 70 -23.551 -11.232 5.165 951 HG2 LYS 70 2HG LYS 70 -23.382 -11.009 2.732 952 HG3 LYS 70 3HG LYS 70 -21.979 -11.745 3.474 953 HD2 LYS 70 2HD LYS 70 -22.481 -12.803 1.340 954 HD3 LYS 70 3HD LYS 70 -22.614 -13.946 2.654 955 HE2 LYS 70 2HE LYS 70 -24.422 -14.379 1.170 956 HE3 LYS 70 3HE LYS 70 -25.128 -13.634 2.605 957 HZ1 LYS 70 3HZ LYS 70 -24.515 -12.235 0.086 958 HZ2 LYS 70 1HZ LYS 70 -25.164 -11.538 1.431 959 HZ3 LYS 70 2HZ LYS 70 -26.016 -12.680 0.603 960 H THR 71 HN THR 71 -22.953 -15.803 4.884 961 HA THR 71 HA THR 71 -25.766 -16.581 4.160 962 HB THR 71 HB THR 71 -23.834 -18.244 2.797 963 HG1 THR 71 1HG THR 71 -22.422 -16.494 2.856 964 HG21 THR 71 3HG2 THR 71 -25.806 -16.184 1.758 965 HG22 THR 71 1HG2 THR 71 -26.151 -17.897 2.096 966 HG23 THR 71 2HG2 THR 71 -25.017 -17.459 0.804 967 H CYS 72 HN CYS 72 -22.521 -18.055 4.870 968 HA CYS 72 HA CYS 72 -23.957 -20.201 6.391 969 HB2 CYS 72 2HB CYS 72 -22.004 -21.549 6.055 970 HB3 CYS 72 3HB CYS 72 -22.408 -20.827 4.478 971 H GLN 73 HN GLN 73 -22.566 -17.254 7.009 972 HA GLN 73 HA GLN 73 -21.756 -16.222 8.894 973 HB2 GLN 73 2HB GLN 73 -23.069 -18.664 10.218 974 HB3 GLN 73 3HB GLN 73 -22.432 -17.296 11.098 975 HG2 GLN 73 2HG GLN 73 -24.838 -17.080 10.804 976 HG3 GLN 73 3HG GLN 73 -23.954 -15.751 10.058 977 HE21 GLN 73 1HE2 GLN 73 -25.241 -19.053 9.027 978 HE22 GLN 73 2HE2 GLN 73 -25.756 -18.371 7.465 979 H ARG 74 HN ARG 74 -19.983 -18.330 7.492 980 HA ARG 74 HA ARG 74 -18.208 -19.289 9.602 981 HE ARG 74 HE ARG 74 -13.824 -20.917 6.592 982 HB2 ARG 74 2HB ARG 74 -18.424 -20.442 7.418 983 HB3 ARG 74 3HB ARG 74 -17.745 -19.029 6.585 984 HG2 ARG 74 2HG ARG 74 -15.620 -19.308 7.743 985 HG3 ARG 74 3HG ARG 74 -16.302 -20.534 8.821 986 HD2 ARG 74 2HD ARG 74 -16.525 -22.118 6.999 987 HD3 ARG 74 3HD ARG 74 -16.068 -20.899 5.815 988 HH11 ARG 74 2HH1 ARG 74 -15.686 -23.318 8.368 989 HH12 ARG 74 1HH1 ARG 74 -14.248 -24.034 9.065 990 HH21 ARG 74 1HH2 ARG 74 -12.054 -21.875 7.518 991 HH22 ARG 74 2HH2 ARG 74 -12.261 -23.242 8.587 992 H LYS 75 HN LYS 75 -16.522 -18.268 10.516 993 HA LYS 75 HA LYS 75 -16.093 -15.467 9.753 994 HB2 LYS 75 2HB LYS 75 -15.608 -17.173 12.194 995 HB3 LYS 75 3HB LYS 75 -14.566 -15.779 11.952 996 HG2 LYS 75 2HG LYS 75 -16.516 -14.313 11.654 997 HG3 LYS 75 3HG LYS 75 -17.594 -15.678 12.007 998 HD2 LYS 75 2HD LYS 75 -16.759 -15.859 14.261 999 HD3 LYS 75 3HD LYS 75 -15.431 -14.736 13.942 1000 HE2 LYS 75 2HE LYS 75 -18.388 -13.979 13.882 1001 HE3 LYS 75 3HE LYS 75 -17.290 -13.714 15.246 1002 HZ1 LYS 75 3HZ LYS 75 -15.904 -12.391 13.726 1003 HZ2 LYS 75 1HZ LYS 75 -17.411 -11.741 13.968 1004 HZ3 LYS 75 2HZ LYS 75 -17.056 -12.526 12.567 1005 H PHE 76 HN PHE 76 -14.146 -14.505 9.301 1006 HA PHE 76 HA PHE 76 -11.727 -16.201 8.965 1007 HD1 PHE 76 1HD PHE 76 -11.451 -17.736 6.295 1008 HD2 PHE 76 2HD PHE 76 -14.995 -15.273 6.449 1009 HE1 PHE 76 1HE PHE 76 -12.760 -19.533 5.191 1010 HE2 PHE 76 2HE PHE 76 -16.306 -17.091 5.405 1011 HZ PHE 76 HZ PHE 76 -15.184 -19.216 4.767 1012 HB2 PHE 76 2HB PHE 76 -12.763 -14.314 6.808 1013 HB3 PHE 76 3HB PHE 76 -11.316 -15.299 6.724 1014 H SER 77 HN SER 77 -9.747 -14.880 8.713 1015 HA SER 77 HA SER 77 -9.950 -12.396 10.309 1016 HG SER 77 HG SER 77 -8.534 -13.811 12.106 1017 HB2 SER 77 2HB SER 77 -7.538 -14.039 9.439 1018 HB3 SER 77 3HB SER 77 -7.483 -12.650 10.525 1019 H ARG 78 HN ARG 78 -9.997 -13.130 7.045 1020 HA ARG 78 HA ARG 78 -8.728 -10.520 6.318 1021 HE ARG 78 HE ARG 78 -5.952 -12.371 3.244 1022 HB2 ARG 78 2HB ARG 78 -8.098 -13.284 5.284 1023 HB3 ARG 78 3HB ARG 78 -7.994 -11.929 4.170 1024 HG2 ARG 78 2HG ARG 78 -6.342 -10.802 5.517 1025 HG3 ARG 78 3HG ARG 78 -6.595 -11.914 6.865 1026 HD2 ARG 78 2HD ARG 78 -4.541 -12.482 5.843 1027 HD3 ARG 78 3HD ARG 78 -5.685 -13.780 5.539 1028 HH11 ARG 78 2HH1 ARG 78 -3.038 -13.470 4.857 1029 HH12 ARG 78 1HH1 ARG 78 -2.137 -13.494 3.333 1030 HH21 ARG 78 1HH2 ARG 78 -4.861 -12.675 1.419 1031 HH22 ARG 78 2HH2 ARG 78 -3.146 -13.080 1.400 1032 H SER 79 HN SER 79 -9.839 -9.327 4.875 1033 HA SER 79 HA SER 79 -12.522 -10.018 4.129 1034 HG SER 79 HG SER 79 -13.518 -7.964 3.173 1035 HB2 SER 79 2HB SER 79 -11.622 -7.675 4.373 1036 HB3 SER 79 3HB SER 79 -10.687 -7.915 2.893 1037 H ASP 80 HN ASP 80 -9.425 -9.984 2.291 1038 HA ASP 80 HA ASP 80 -10.446 -10.719 -0.225 1039 HB2 ASP 80 2HB ASP 80 -8.141 -11.582 -0.676 1040 HB3 ASP 80 3HB ASP 80 -8.219 -9.960 0.024 1041 H HIS 81 HN HIS 81 -9.380 -12.911 2.491 1042 HA HIS 81 HA HIS 81 -10.007 -15.395 1.197 1043 HD1 HIS 81 1HD HIS 81 -7.490 -15.136 1.557 1044 HD2 HIS 81 2HD HIS 81 -8.199 -16.055 5.599 1045 HE1 HIS 81 1HE HIS 81 -5.298 -15.634 2.517 1046 HB2 HIS 81 2HB HIS 81 -10.095 -14.594 4.151 1047 HB3 HIS 81 3HB HIS 81 -10.299 -16.228 3.566 1048 H LEU 82 HN LEU 82 -12.011 -13.192 3.274 1049 HA LEU 82 HA LEU 82 -14.297 -14.890 3.350 1050 HG LEU 82 HG LEU 82 -16.308 -13.921 3.955 1051 HB2 LEU 82 2HB LEU 82 -13.910 -12.961 4.841 1052 HB3 LEU 82 3HB LEU 82 -14.192 -11.829 3.519 1053 HD11 LEU 82 1HD1 LEU 82 -16.425 -11.552 5.793 1054 HD12 LEU 82 2HD1 LEU 82 -15.627 -13.090 6.302 1055 HD13 LEU 82 3HD1 LEU 82 -17.309 -13.061 5.787 1056 HD21 LEU 82 3HD2 LEU 82 -17.851 -12.046 3.535 1057 HD22 LEU 82 1HD2 LEU 82 -16.656 -12.126 2.247 1058 HD23 LEU 82 2HD2 LEU 82 -16.491 -10.901 3.514 1059 H LYS 83 HN LYS 83 -13.459 -12.194 1.092 1060 HA LYS 83 HA LYS 83 -15.831 -12.382 -0.550 1061 HB2 LYS 83 2HB LYS 83 -14.128 -10.499 -0.527 1062 HB3 LYS 83 3HB LYS 83 -13.005 -11.575 -1.364 1063 HG2 LYS 83 2HG LYS 83 -14.994 -11.763 -3.136 1064 HG3 LYS 83 3HG LYS 83 -15.537 -10.270 -2.385 1065 HD2 LYS 83 2HD LYS 83 -12.816 -10.771 -3.706 1066 HD3 LYS 83 3HD LYS 83 -14.186 -9.933 -4.422 1067 HE2 LYS 83 2HE LYS 83 -12.798 -8.199 -3.735 1068 HE3 LYS 83 3HE LYS 83 -14.048 -8.265 -2.486 1069 HZ1 LYS 83 3HZ LYS 83 -11.323 -9.386 -2.305 1070 HZ2 LYS 83 1HZ LYS 83 -12.482 -9.543 -1.140 1071 HZ3 LYS 83 2HZ LYS 83 -11.906 -8.052 -1.508 1072 H THR 84 HN THR 84 -12.693 -14.101 -0.575 1073 HA THR 84 HA THR 84 -13.109 -15.494 -3.062 1074 HB THR 84 HB THR 84 -11.466 -16.144 -0.592 1075 HG1 THR 84 1HG THR 84 -10.753 -14.331 -1.462 1076 HG21 THR 84 3HG2 THR 84 -11.651 -18.239 -1.837 1077 HG22 THR 84 1HG2 THR 84 -10.033 -17.524 -1.761 1078 HG23 THR 84 2HG2 THR 84 -10.990 -17.404 -3.279 1079 H HIS 85 HN HIS 85 -13.595 -16.458 0.381 1080 HA HIS 85 HA HIS 85 -14.790 -18.997 -0.126 1081 HD1 HIS 85 1HD HIS 85 -16.216 -20.636 2.232 1082 HD2 HIS 85 2HD HIS 85 -17.151 -16.575 2.921 1083 HE1 HIS 85 1HE HIS 85 -18.686 -20.531 3.006 1084 HB2 HIS 85 2HB HIS 85 -14.118 -18.687 2.100 1085 HB3 HIS 85 3HB HIS 85 -14.733 -17.041 2.169 1086 H THR 86 HN THR 86 -16.115 -15.703 -0.021 1087 HA THR 86 HA THR 86 -18.861 -16.216 0.127 1088 HB THR 86 HB THR 86 -17.414 -14.097 -1.505 1089 HG1 THR 86 1HG THR 86 -17.071 -14.111 0.784 1090 HG21 THR 86 3HG2 THR 86 -20.291 -14.031 -0.613 1091 HG22 THR 86 1HG2 THR 86 -19.714 -14.133 -2.304 1092 HG23 THR 86 2HG2 THR 86 -19.324 -12.707 -1.323 1093 H ARG 87 HN ARG 87 -16.665 -16.456 -2.701 1094 HA ARG 87 HA ARG 87 -18.714 -16.607 -4.709 1095 HE ARG 87 HE ARG 87 -15.907 -20.940 -4.529 1096 HB2 ARG 87 2HB ARG 87 -16.977 -16.991 -6.174 1097 HB3 ARG 87 3HB ARG 87 -16.076 -16.314 -4.841 1098 HG2 ARG 87 2HG ARG 87 -14.758 -18.125 -5.430 1099 HG3 ARG 87 3HG ARG 87 -15.693 -18.825 -4.118 1100 HD2 ARG 87 2HD ARG 87 -17.238 -19.283 -6.466 1101 HD3 ARG 87 3HD ARG 87 -15.600 -19.510 -6.956 1102 HH11 ARG 87 1HH2 ARG 87 -17.093 -21.213 -7.835 1103 HH12 ARG 87 2HH2 ARG 87 -17.702 -22.839 -7.563 1104 HH21 ARG 87 1HH1 ARG 87 -16.626 -23.060 -4.317 1105 HH22 ARG 87 2HH1 ARG 87 -17.419 -23.834 -5.667 1106 H THR 88 HN THR 88 -17.517 -18.965 -2.384 1107 HA THR 88 HA THR 88 -18.158 -21.410 -3.591 1108 HB THR 88 HB THR 88 -18.743 -20.703 -0.695 1109 HG1 THR 88 1HG THR 88 -16.839 -20.071 -0.828 1110 HG21 THR 88 3HG2 THR 88 -17.840 -23.326 -1.912 1111 HG22 THR 88 1HG2 THR 88 -19.443 -22.980 -1.228 1112 HG23 THR 88 2HG2 THR 88 -18.016 -22.984 -0.177 1113 H HIS 89 HN HIS 89 -20.346 -19.034 -2.022 1114 HA HIS 89 HA HIS 89 -22.685 -20.813 -2.283 1115 HD1 HIS 89 1HD HIS 89 -20.753 -17.201 -0.569 1116 HD2 HIS 89 2HD HIS 89 -22.981 -20.341 1.121 1117 HE1 HIS 89 1HE HIS 89 -20.027 -17.342 1.843 1118 HB2 HIS 89 2HB HIS 89 -22.861 -17.832 -1.864 1119 HB3 HIS 89 3HB HIS 89 -23.901 -19.104 -1.238 1120 H THR 90 HN THR 90 -21.022 -18.401 -4.205 1121 HA THR 90 HA THR 90 -23.296 -17.924 -5.986 1122 HB THR 90 HB THR 90 -20.382 -17.085 -6.262 1123 HG1 THR 90 1HG THR 90 -22.479 -15.649 -5.051 1124 HG21 THR 90 3HG2 THR 90 -22.873 -15.770 -7.386 1125 HG22 THR 90 1HG2 THR 90 -21.540 -16.499 -8.307 1126 HG23 THR 90 2HG2 THR 90 -21.248 -15.044 -7.357 1127 H GLY 91 HN GLY 91 -20.959 -20.397 -5.757 1128 HA2 GLY 91 2HA GLY 91 -20.247 -22.047 -7.220 1129 HA3 GLY 91 3HA GLY 91 -21.684 -21.682 -8.190 1130 H GLU 92 HN GLU 92 -19.380 -19.103 -7.614 1131 HA GLU 92 HA GLU 92 -19.110 -18.663 -10.443 1132 HB2 GLU 92 2HB GLU 92 -18.701 -17.199 -8.035 1133 HB3 GLU 92 3HB GLU 92 -17.137 -17.198 -8.831 1134 HG2 GLU 92 2HG GLU 92 -19.744 -16.416 -10.218 1135 HG3 GLU 92 3HG GLU 92 -18.719 -15.274 -9.351 1136 H LYS 93 HN LYS 93 -17.217 -18.616 -11.737 1137 HA LYS 93 HA LYS 93 -14.696 -19.618 -10.731 1138 HB2 LYS 93 2HB LYS 93 -16.187 -21.383 -12.730 1139 HB3 LYS 93 3HB LYS 93 -14.462 -21.488 -12.385 1140 HG2 LYS 93 2HG LYS 93 -15.128 -21.919 -9.938 1141 HG3 LYS 93 3HG LYS 93 -16.760 -22.229 -10.566 1142 HD2 LYS 93 2HD LYS 93 -14.177 -23.677 -11.234 1143 HD3 LYS 93 3HD LYS 93 -15.510 -24.305 -10.274 1144 HE2 LYS 93 2HE LYS 93 -16.970 -24.420 -12.194 1145 HE3 LYS 93 3HE LYS 93 -15.822 -23.507 -13.190 1146 HZ1 LYS 93 3HZ LYS 93 -14.261 -25.289 -12.976 1147 HZ2 LYS 93 1HZ LYS 93 -15.668 -25.851 -13.639 1148 HZ3 LYS 93 2HZ LYS 93 -15.309 -26.175 -12.063 1149 HA PRO 94 HA PRO 94 -14.800 -16.708 -14.307 1150 HB2 PRO 94 2HB PRO 94 -13.253 -14.691 -13.270 1151 HB3 PRO 94 3HB PRO 94 -14.967 -14.929 -12.831 1152 HG2 PRO 94 2HG PRO 94 -12.510 -15.824 -11.305 1153 HG3 PRO 94 3HG PRO 94 -13.959 -14.980 -10.675 1154 HD2 PRO 94 2HD PRO 94 -13.616 -17.687 -10.520 1155 HD3 PRO 94 3HD PRO 94 -15.232 -16.949 -10.707 1156 H PHE 95 HN PHE 95 -12.096 -18.205 -12.584 1157 HA PHE 95 HA PHE 95 -10.068 -17.205 -14.490 1158 HD1 PHE 95 2HD PHE 95 -7.912 -16.224 -13.077 1159 HD2 PHE 95 1HD PHE 95 -10.794 -18.055 -10.467 1160 HE1 PHE 95 2HE PHE 95 -7.716 -14.292 -11.526 1161 HE2 PHE 95 1HE PHE 95 -10.594 -16.118 -8.897 1162 HZ PHE 95 HZ PHE 95 -9.052 -14.249 -9.427 1163 HB2 PHE 95 2HB PHE 95 -9.891 -19.292 -12.275 1164 HB3 PHE 95 3HB PHE 95 -8.539 -18.656 -13.207 1165 H SER 96 HN SER 96 -11.220 -18.046 -16.438 1166 HA SER 96 HA SER 96 -11.130 -20.945 -16.936 1167 HG SER 96 HG SER 96 -12.029 -21.423 -19.204 1168 HB2 SER 96 2HB SER 96 -12.834 -19.461 -17.991 1169 HB3 SER 96 3HB SER 96 -11.544 -18.599 -18.824 1170 H CYS 97 HN CYS 97 -9.631 -22.090 -18.102 1171 HA CYS 97 HA CYS 97 -6.979 -21.055 -18.253 1172 HB2 CYS 97 2HB CYS 97 -7.581 -23.487 -18.033 1173 HB3 CYS 97 3HB CYS 97 -8.133 -23.477 -19.711 1174 H ARG 98 HN ARG 98 -5.614 -20.683 -20.053 1175 HA ARG 98 HA ARG 98 -7.086 -19.547 -22.402 1176 HE ARG 98 HE ARG 98 -8.434 -18.744 -20.889 1177 HB2 ARG 98 2HB ARG 98 -4.502 -18.585 -21.111 1178 HB3 ARG 98 3HB ARG 98 -5.301 -17.831 -22.483 1179 HG2 ARG 98 2HG ARG 98 -6.477 -17.978 -19.664 1180 HG3 ARG 98 3HG ARG 98 -5.575 -16.630 -20.334 1181 HD2 ARG 98 2HD ARG 98 -7.840 -16.019 -20.515 1182 HD3 ARG 98 3HD ARG 98 -7.317 -16.429 -22.160 1183 HH11 ARG 98 1HH1 ARG 98 -9.637 -15.743 -22.274 1184 HH12 ARG 98 2HH1 ARG 98 -11.183 -16.485 -22.649 1185 HH21 ARG 98 1HH2 ARG 98 -10.275 -19.567 -21.360 1186 HH22 ARG 98 2HH2 ARG 98 -11.578 -18.634 -22.087 1187 H TRP 99 HN TRP 99 -5.354 -22.176 -21.631 1188 HA TRP 99 HA TRP 99 -3.152 -22.137 -23.481 1189 HD1 TRP 99 1HD TRP 99 -3.425 -22.472 -20.152 1190 HE1 TRP 99 1HE TRP 99 -1.117 -22.641 -19.066 1191 HE3 TRP 99 3HE TRP 99 -1.213 -25.624 -23.513 1192 HZ2 TRP 99 2HZ TRP 99 1.407 -23.939 -19.624 1193 HZ3 TRP 99 3HZ TRP 99 1.173 -26.266 -23.242 1194 HH2 TRP 99 2HH TRP 99 2.482 -25.443 -21.306 1195 HB2 TRP 99 2HB TRP 99 -4.679 -24.281 -21.982 1196 HB3 TRP 99 3HB TRP 99 -3.575 -24.746 -23.256 1197 HA PRO 100 HA PRO 100 -5.186 -22.581 -27.332 1198 HB2 PRO 100 2HB PRO 100 -3.265 -23.841 -28.877 1199 HB3 PRO 100 3HB PRO 100 -3.072 -22.201 -28.214 1200 HG2 PRO 100 2HG PRO 100 -2.056 -24.800 -27.014 1201 HG3 PRO 100 3HG PRO 100 -1.124 -23.306 -27.362 1202 HD2 PRO 100 2HD PRO 100 -2.112 -23.793 -24.890 1203 HD3 PRO 100 3HD PRO 100 -2.158 -22.137 -25.575 1204 H SER 101 HN SER 101 -5.591 -24.869 -25.299 1205 HA SER 101 HA SER 101 -7.074 -26.604 -27.081 1206 HG SER 101 HG SER 101 -4.964 -26.806 -28.099 1207 HB2 SER 101 2HB SER 101 -4.587 -27.719 -25.708 1208 HB3 SER 101 3HB SER 101 -5.892 -28.739 -26.346 1209 H CYS 102 HN CYS 102 -7.209 -24.852 -24.534 1210 HA CYS 102 HA CYS 102 -8.832 -26.750 -22.952 1211 HB2 CYS 102 2HB CYS 102 -6.444 -26.795 -22.029 1212 HB3 CYS 102 3HB CYS 102 -6.659 -25.080 -21.636 1213 H GLN 103 HN GLN 103 -9.794 -25.499 -21.008 1214 HA GLN 103 HA GLN 103 -10.060 -22.641 -21.186 1215 HB2 GLN 103 2HB GLN 103 -12.517 -22.569 -21.708 1216 HB3 GLN 103 3HB GLN 103 -11.518 -23.039 -23.054 1217 HG2 GLN 103 2HG GLN 103 -13.458 -24.397 -23.132 1218 HG3 GLN 103 3HG GLN 103 -12.132 -25.450 -22.678 1219 HE21 GLN 103 1HE2 GLN 103 -14.905 -23.561 -21.265 1220 HE22 GLN 103 2HE2 GLN 103 -15.100 -24.737 -19.958 1221 H LYS 104 HN LYS 104 -9.710 -25.210 -19.379 1222 HA LYS 104 HA LYS 104 -11.999 -25.656 -17.791 1223 HB2 LYS 104 2HB LYS 104 -9.064 -26.178 -17.530 1224 HB3 LYS 104 3HB LYS 104 -9.933 -26.046 -16.019 1225 HG2 LYS 104 2HG LYS 104 -10.082 -28.260 -16.335 1226 HG3 LYS 104 3HG LYS 104 -11.639 -27.746 -16.960 1227 HD2 LYS 104 2HD LYS 104 -9.174 -28.377 -18.641 1228 HD3 LYS 104 3HD LYS 104 -10.446 -29.537 -18.283 1229 HE2 LYS 104 2HE LYS 104 -12.075 -28.380 -19.576 1230 HE3 LYS 104 3HE LYS 104 -11.098 -26.919 -19.650 1231 HZ1 LYS 104 3HZ LYS 104 -10.355 -29.454 -20.935 1232 HZ2 LYS 104 1HZ LYS 104 -9.498 -28.042 -20.964 1233 HZ3 LYS 104 2HZ LYS 104 -10.977 -28.122 -21.696 1234 H LYS 105 HN LYS 105 -12.998 -24.626 -16.183 1235 HA LYS 105 HA LYS 105 -11.999 -21.922 -15.558 1236 HB2 LYS 105 2HB LYS 105 -14.712 -23.241 -15.094 1237 HB3 LYS 105 3HB LYS 105 -14.318 -21.553 -14.766 1238 HG2 LYS 105 2HG LYS 105 -13.862 -21.173 -17.165 1239 HG3 LYS 105 3HG LYS 105 -14.215 -22.865 -17.515 1240 HD2 LYS 105 2HD LYS 105 -16.115 -21.538 -18.126 1241 HD3 LYS 105 3HD LYS 105 -16.549 -22.552 -16.741 1242 HE2 LYS 105 2HE LYS 105 -16.268 -20.630 -15.224 1243 HE3 LYS 105 3HE LYS 105 -15.721 -19.617 -16.561 1244 HZ1 LYS 105 3HZ LYS 105 -18.038 -19.267 -16.054 1245 HZ2 LYS 105 1HZ LYS 105 -18.391 -20.852 -16.333 1246 HZ3 LYS 105 2HZ LYS 105 -17.885 -19.890 -17.571 1247 H PHE 106 HN PHE 106 -11.435 -21.204 -13.583 1248 HA PHE 106 HA PHE 106 -11.914 -23.011 -11.233 1249 HD1 PHE 106 1HD PHE 106 -9.966 -24.761 -10.328 1250 HD2 PHE 106 2HD PHE 106 -8.813 -22.609 -13.879 1251 HE1 PHE 106 1HE PHE 106 -9.408 -26.905 -11.445 1252 HE2 PHE 106 2HE PHE 106 -8.280 -24.735 -15.004 1253 HZ PHE 106 HZ PHE 106 -8.612 -26.900 -13.804 1254 HB2 PHE 106 2HB PHE 106 -9.396 -21.409 -11.889 1255 HB3 PHE 106 3HB PHE 106 -9.695 -22.243 -10.369 1256 H ALA 107 HN ALA 107 -11.611 -21.819 -9.113 1257 HA ALA 107 HA ALA 107 -13.162 -19.292 -9.361 1258 HB1 ALA 107 1HB ALA 107 -13.566 -19.788 -6.874 1259 HB2 ALA 107 2HB ALA 107 -14.272 -20.967 -8.024 1260 HB3 ALA 107 3HB ALA 107 -12.786 -21.341 -7.133 1261 H ARG 108 HN ARG 108 -9.993 -20.417 -8.696 1262 HA ARG 108 HA ARG 108 -9.321 -17.782 -7.456 1263 HE ARG 108 HE ARG 108 -7.272 -21.176 -4.603 1264 HB2 ARG 108 2HB ARG 108 -8.267 -20.529 -6.727 1265 HB3 ARG 108 3HB ARG 108 -7.526 -19.033 -6.168 1266 HG2 ARG 108 2HG ARG 108 -9.256 -18.523 -4.712 1267 HG3 ARG 108 3HG ARG 108 -10.482 -19.398 -5.626 1268 HD2 ARG 108 2HD ARG 108 -9.993 -20.519 -3.506 1269 HD3 ARG 108 3HD ARG 108 -9.658 -21.537 -4.900 1270 HH11 ARG 108 1HH2 ARG 108 -9.100 -19.916 -1.825 1271 HH12 ARG 108 2HH2 ARG 108 -7.603 -19.772 -0.921 1272 HH21 ARG 108 1HH1 ARG 108 -5.558 -20.806 -3.450 1273 HH22 ARG 108 2HH1 ARG 108 -5.688 -20.189 -1.790 1274 H SER 109 HN SER 109 -7.441 -16.829 -8.143 1275 HA SER 109 HA SER 109 -6.530 -17.401 -10.759 1276 HG SER 109 HG SER 109 -5.820 -14.638 -8.115 1277 HB2 SER 109 2HB SER 109 -4.549 -15.863 -9.969 1278 HB3 SER 109 3HB SER 109 -6.170 -15.194 -10.063 1279 H ASP 110 HN ASP 110 -5.252 -18.353 -7.547 1280 HA ASP 110 HA ASP 110 -2.802 -19.535 -8.581 1281 HB2 ASP 110 2HB ASP 110 -2.703 -20.604 -6.325 1282 HB3 ASP 110 3HB ASP 110 -2.765 -18.851 -6.348 1283 H GLU 111 HN GLU 111 -6.143 -20.703 -7.998 1284 HA GLU 111 HA GLU 111 -5.604 -23.522 -8.273 1285 HB2 GLU 111 2HB GLU 111 -8.062 -21.792 -8.690 1286 HB3 GLU 111 3HB GLU 111 -8.044 -23.461 -9.220 1287 HG2 GLU 111 2HG GLU 111 -7.612 -24.264 -6.984 1288 HG3 GLU 111 3HG GLU 111 -7.553 -22.617 -6.360 1289 H LEU 112 HN LEU 112 -6.377 -20.901 -10.619 1290 HA LEU 112 HA LEU 112 -6.289 -22.614 -12.928 1291 HG LEU 112 HG LEU 112 -4.905 -20.481 -14.798 1292 HB2 LEU 112 2HB LEU 112 -7.341 -20.430 -12.973 1293 HB3 LEU 112 3HB LEU 112 -5.801 -19.616 -12.656 1294 HD11 LEU 112 1HD1 LEU 112 -7.723 -21.457 -15.443 1295 HD12 LEU 112 2HD1 LEU 112 -6.386 -22.546 -14.997 1296 HD13 LEU 112 3HD1 LEU 112 -6.268 -21.582 -16.430 1297 HD21 LEU 112 3HD2 LEU 112 -6.135 -19.064 -16.304 1298 HD22 LEU 112 1HD2 LEU 112 -6.025 -18.271 -14.723 1299 HD23 LEU 112 2HD2 LEU 112 -7.543 -19.052 -15.235 1300 H VAL 113 HN VAL 113 -3.762 -20.614 -11.261 1301 HA VAL 113 HA VAL 113 -1.596 -21.159 -13.025 1302 HB VAL 113 HB VAL 113 -1.604 -20.820 -9.991 1303 HG11 VAL 113 1HG1 VAL 113 0.791 -20.189 -10.212 1304 HG12 VAL 113 2HG1 VAL 113 0.499 -21.890 -10.557 1305 HG13 VAL 113 3HG1 VAL 113 0.756 -20.752 -11.898 1306 HG21 VAL 113 3HG2 VAL 113 -0.710 -18.767 -12.020 1307 HG22 VAL 113 1HG2 VAL 113 -2.364 -18.821 -11.455 1308 HG23 VAL 113 2HG2 VAL 113 -1.054 -18.542 -10.294 1309 H ARG 114 HN ARG 114 -2.630 -22.980 -10.094 1310 HA ARG 114 HA ARG 114 -0.826 -25.125 -10.310 1311 HE ARG 114 HE ARG 114 -1.694 -26.174 -6.578 1312 HB2 ARG 114 2HB ARG 114 -2.263 -24.788 -8.368 1313 HB3 ARG 114 3HB ARG 114 -3.714 -25.119 -9.308 1314 HG2 ARG 114 2HG ARG 114 -3.012 -27.453 -9.668 1315 HG3 ARG 114 3HG ARG 114 -1.496 -27.156 -8.802 1316 HD2 ARG 114 2HD ARG 114 -4.281 -26.848 -7.589 1317 HD3 ARG 114 3HD ARG 114 -3.292 -28.315 -7.467 1318 HH11 ARG 114 1HH1 ARG 114 -4.619 -27.805 -5.422 1319 HH12 ARG 114 2HH1 ARG 114 -4.222 -27.504 -3.755 1320 HH21 ARG 114 1HH2 ARG 114 -1.270 -25.789 -4.446 1321 HH22 ARG 114 2HH2 ARG 114 -2.468 -26.271 -3.247 1322 H HIS 115 HN HIS 115 -4.133 -24.864 -11.738 1323 HA HIS 115 HA HIS 115 -4.157 -27.349 -13.082 1324 HD1 HIS 115 1HD HIS 115 -6.537 -28.142 -14.960 1325 HD2 HIS 115 2HD HIS 115 -5.337 -24.297 -16.211 1326 HE1 HIS 115 1HE HIS 115 -6.912 -28.007 -17.509 1327 HB2 HIS 115 2HB HIS 115 -6.166 -26.146 -12.981 1328 HB3 HIS 115 3HB HIS 115 -5.459 -24.668 -13.613 1329 H HIS 116 HN HIS 116 -3.009 -24.135 -14.280 1330 HA HIS 116 HA HIS 116 -2.170 -24.972 -16.851 1331 HD1 HIS 116 1HD HIS 116 -3.840 -23.362 -17.744 1332 HD2 HIS 116 2HD HIS 116 -1.627 -20.330 -15.772 1333 HE1 HIS 116 1HE HIS 116 -4.862 -21.184 -18.368 1334 HB2 HIS 116 2HB HIS 116 -1.086 -22.832 -14.980 1335 HB3 HIS 116 3HB HIS 116 -0.499 -23.071 -16.609 1336 H ASN 117 HN ASN 117 -0.633 -25.384 -13.647 1337 HA ASN 117 HA ASN 117 2.026 -25.971 -14.604 1338 HB2 ASN 117 2HB ASN 117 1.105 -25.436 -12.186 1339 HB3 ASN 117 3HB ASN 117 0.873 -27.181 -12.069 1340 HD21 ASN 117 1HD2 ASN 117 3.268 -28.050 -13.505 1341 HD22 ASN 117 2HD2 ASN 117 4.606 -27.501 -12.463 1342 H MET 118 HN MET 118 -0.954 -27.798 -14.646 1343 HA MET 118 HA MET 118 0.322 -30.435 -14.873 1344 HB2 MET 118 2HB MET 118 -2.518 -29.589 -15.631 1345 HB3 MET 118 3HB MET 118 -1.924 -31.229 -15.395 1346 HG2 MET 118 2HG MET 118 -1.471 -30.764 -13.020 1347 HG3 MET 118 3HG MET 118 -2.020 -29.099 -13.215 1348 HE1 MET 118 3HE MET 118 -4.750 -30.627 -10.902 1349 HE2 MET 118 1HE MET 118 -3.026 -31.047 -10.918 1350 HE3 MET 118 2HE MET 118 -3.529 -29.352 -11.109 1351 H HIS 119 HN HIS 119 -0.775 -27.813 -17.031 1352 HA HIS 119 HA HIS 119 -0.475 -29.352 -19.485 1353 HD1 HIS 119 1HD HIS 119 -2.699 -29.192 -20.607 1354 HD2 HIS 119 2HD HIS 119 -3.028 -25.388 -18.827 1355 HE1 HIS 119 1HE HIS 119 -5.193 -28.547 -20.636 1356 HB2 HIS 119 2HB HIS 119 -0.590 -26.344 -18.958 1357 HB3 HIS 119 3HB HIS 119 -0.511 -27.081 -20.542 Start of MODEL 11 1 H5 DC 124 5H C 124 -3.991 -31.543 -5.088 2 H6 DC 124 6H C 124 -5.900 -31.195 -6.566 3 H5' DC 124 H5' C 124 -9.018 -32.566 -9.824 4 H5'' DC 124 H5" C 124 -7.541 -32.355 -8.857 5 H4' DC 124 H4' C 124 -10.371 -32.489 -7.731 6 H3' DC 124 H3' C 124 -9.111 -30.328 -9.020 7 H2' DC 124 H2' C 124 -7.380 -30.098 -7.488 8 H2'' DC 124 H2" C 124 -8.577 -29.067 -6.667 9 H1' DC 124 H1' C 124 -9.395 -30.866 -5.298 10 H41 DC 124 1H4 C 124 -4.504 -32.270 -1.529 11 H42 DC 124 2H4 C 124 -3.352 -32.074 -2.835 12 H8 DG 125 8H G 125 -9.185 -27.046 -5.707 13 H1 DG 125 1H G 125 -6.361 -29.025 -0.273 14 H5' DG 125 H5' G 125 -12.879 -29.679 -6.412 15 H5'' DG 125 H5" G 125 -13.965 -28.348 -6.866 16 H4' DG 125 H4' G 125 -13.816 -28.618 -4.415 17 H3' DG 125 H3' G 125 -13.405 -26.144 -5.728 18 H2' DG 125 H2' G 125 -11.151 -26.020 -5.263 19 H2'' DG 125 H2" G 125 -11.704 -25.349 -3.706 20 H1' DG 125 H1' G 125 -11.552 -27.485 -2.619 21 H21 DG 125 1H2 G 125 -7.831 -29.220 1.302 22 H22 DG 125 2H2 G 125 -9.542 -28.956 1.013 23 H5 DC 126 5H C 126 -8.099 -23.980 -4.334 24 H6 DC 126 6H C 126 -10.072 -23.613 -2.941 25 H5' DC 126 H5' C 126 -13.584 -26.186 -1.176 26 H5'' DC 126 H5" C 126 -14.628 -24.941 -0.455 27 H4' DC 126 H4' C 126 -12.637 -25.158 0.895 28 H3' DC 126 H3' C 126 -13.248 -22.636 -0.313 29 H2' DC 126 H2' C 126 -11.332 -22.698 -1.638 30 H2'' DC 126 H2" C 126 -10.601 -21.953 -0.200 31 H1' DC 126 H1' C 126 -10.048 -24.225 0.740 32 H41 DC 126 1H4 C 126 -5.016 -25.361 -2.904 33 H42 DC 126 2H4 C 126 -5.834 -24.776 -4.335 34 H8 DG 127 8H G 127 -9.657 -21.674 1.624 35 H1 DG 127 1H G 127 -3.416 -22.969 0.693 36 H5' DG 127 H5' G 127 -12.177 -23.576 3.964 37 H5'' DG 127 H5" G 127 -12.556 -22.474 5.299 38 H4' DG 127 H4' G 127 -10.509 -23.756 5.770 39 H3' DG 127 H3' G 127 -10.707 -20.931 5.803 40 H2' DG 127 H2' G 127 -9.254 -20.503 4.096 41 H2'' DG 127 H2" G 127 -7.983 -20.767 5.333 42 H1' DG 127 H1' G 127 -7.670 -23.035 4.684 43 H21 DG 127 1H2 G 127 -2.447 -23.433 2.562 44 H22 DG 127 2H2 G 127 -3.286 -23.276 4.095 45 H8 DG 128 8H G 128 -7.466 -18.642 4.228 46 H1 DG 128 1H G 128 -2.675 -19.650 0.033 47 H5' DG 128 H5' G 128 -6.729 -21.955 7.851 48 H5'' DG 128 H5" G 128 -6.570 -20.937 9.306 49 H4' DG 128 H4' G 128 -4.541 -20.678 8.028 50 H3' DG 128 H3' G 128 -6.216 -18.460 8.564 51 H2' DG 128 H2' G 128 -6.755 -18.121 6.304 52 H2'' DG 128 H2" G 128 -5.258 -17.132 6.415 53 H1' DG 128 H1' G 128 -3.896 -19.027 5.742 54 H21 DG 128 1H2 G 128 -0.862 -20.208 1.054 55 H22 DG 128 2H2 G 128 -0.811 -20.389 2.796 56 H8 DG 129 8H G 129 -3.474 -16.248 5.655 57 H1 DG 129 1H G 129 -1.013 -16.723 -0.269 58 H5' DG 129 H5' G 129 -1.500 -18.231 8.966 59 H5'' DG 129 H5" G 129 -1.024 -16.892 10.002 60 H4' DG 129 H4' G 129 0.591 -17.229 8.223 61 H3' DG 129 H3' G 129 -0.597 -14.846 8.686 62 H2' DG 129 H2' G 129 -1.948 -14.863 6.710 63 H2'' DG 129 H2" G 129 -0.512 -14.011 6.055 64 H1' DG 129 H1' G 129 0.406 -16.114 5.334 65 H21 DG 129 1H2 G 129 1.129 -16.459 -0.234 66 H22 DG 129 2H2 G 129 2.011 -16.242 1.269 67 H8 DG 130 8H G 130 0.525 -13.215 4.288 68 H1 DG 130 1H G 130 -0.655 -12.854 -1.989 69 H5' DG 130 H5' G 130 3.019 -15.502 5.581 70 H5'' DG 130 H5" G 130 4.062 -14.545 6.646 71 H4' DG 130 H4' G 130 5.103 -14.406 4.544 72 H3' DG 130 H3' G 130 4.139 -12.079 5.782 73 H2' DG 130 H2' G 130 2.350 -11.677 4.433 74 H2'' DG 130 H2" G 130 3.528 -10.936 3.356 75 H1' DG 130 H1' G 130 3.633 -12.782 1.943 76 H21 DG 130 1H2 G 130 1.127 -12.272 -3.054 77 H22 DG 130 2H2 G 130 2.648 -11.996 -2.214 78 H8 DG 131 8H G 131 2.591 -9.450 2.354 79 H1 DG 131 1H G 131 -1.914 -9.556 -2.240 80 H5' DG 131 H5' G 131 6.146 -11.733 1.625 81 H5'' DG 131 H5" G 131 7.458 -10.547 1.808 82 H4' DG 131 H4' G 131 6.601 -10.298 -0.419 83 H3' DG 131 H3' G 131 6.589 -8.160 1.404 84 H2' DG 131 H2' G 131 4.300 -8.125 1.659 85 H2'' DG 131 H2" G 131 4.423 -7.031 0.278 86 H1' DG 131 H1' G 131 3.874 -8.815 -1.296 87 H21 DG 131 1H2 G 131 -1.049 -9.023 -4.169 88 H22 DG 131 2H2 G 131 0.656 -8.642 -4.349 89 H5 DC 132 5H C 132 1.259 -6.717 1.556 90 H6 DC 132 6H C 132 2.809 -5.931 -0.178 91 H5' DC 132 H5' C 132 5.205 -7.695 -2.889 92 H5'' DC 132 H5" C 132 6.287 -6.457 -3.573 93 H4' DC 132 H4' C 132 4.228 -6.125 -4.679 94 H3' DC 132 H3' C 132 5.311 -4.077 -3.009 95 H2' DC 132 H2' C 132 3.604 -4.187 -1.395 96 H2'' DC 132 H2" C 132 2.760 -3.114 -2.544 97 H1' DC 132 H1' C 132 1.656 -4.951 -3.617 98 H41 DC 132 1H4 C 132 -2.379 -6.665 0.956 99 H42 DC 132 2H4 C 132 -1.083 -7.137 2.040 100 H8 DG 133 8H G 133 1.247 -1.710 -3.133 101 H1 DG 133 1H G 133 -4.875 -2.804 -1.527 102 H5' DG 133 H5' G 133 2.574 -3.291 -6.684 103 H5'' DG 133 H5" G 133 3.267 -1.966 -7.626 104 H4' DG 133 H4' G 133 0.931 -1.994 -8.144 105 H3' DG 133 H3' G 133 2.000 0.263 -6.920 106 H2' DG 133 H2' G 133 1.159 -0.207 -4.808 107 H2'' DG 133 H2" G 133 -0.217 0.721 -5.315 108 H1' DG 133 H1' G 133 -1.439 -1.301 -5.978 109 H21 DG 133 1H2 G 133 -6.152 -2.257 -3.186 110 H22 DG 133 2H2 G 133 -5.505 -1.827 -4.754 111 H5' DT 134 H5' T 134 -2.481 0.033 -7.508 112 H5'' DT 134 H5" T 134 -2.796 1.473 -8.496 113 H4' DT 134 H4' T 134 -4.681 1.210 -7.115 114 H3' DT 134 H3' T 134 -3.041 3.494 -7.119 115 H2' DT 134 H2' T 134 -2.302 3.179 -4.947 116 H2'' DT 134 H2" T 134 -3.772 4.076 -4.605 117 H1' DT 134 H1' T 134 -5.052 1.966 -4.141 118 H3 DT 134 3H T 134 -4.095 0.364 -0.080 119 H71 DT 134 1H7 T 134 0.590 1.882 -2.401 120 H72 DT 134 2H7 T 134 0.395 1.993 -0.635 121 H73 DT 134 3H7 T 134 0.508 0.400 -1.420 122 H6 DT 134 6H T 134 -1.288 1.750 -3.755 123 H5 DC 135 5H C 135 -3.674 5.073 -2.694 124 H6 DC 135 6H C 135 -5.529 5.347 -4.242 125 H5' DC 135 H5' C 135 -7.480 3.626 -7.639 126 H5'' DC 135 H5" C 135 -8.355 5.016 -8.309 127 H4' DC 135 H4' C 135 -9.622 4.269 -6.379 128 H3' DC 135 H3' C 135 -8.722 6.909 -6.494 129 H2' DC 135 H2' C 135 -7.077 6.568 -4.838 130 H2'' DC 135 H2" C 135 -8.393 7.158 -3.820 131 H1' DC 135 H1' C 135 -9.112 4.885 -3.262 132 H41 DC 135 1H4 C 135 -4.076 3.528 0.547 133 H42 DC 135 2H4 C 135 -2.980 4.039 -0.720 134 H5' DT 136 H5' T 136 -10.708 5.310 -2.555 135 H5'' DT 136 H5" T 136 -12.293 5.869 -3.042 136 H4' DT 136 H4' T 136 -12.553 5.949 -0.820 137 H3' DT 136 H3' T 136 -12.430 8.483 -1.932 138 H2' DT 136 H2' T 136 -10.240 8.911 -1.520 139 H2'' DT 136 H2" T 136 -10.773 9.509 0.002 140 H1' DT 136 H1' T 136 -10.242 7.680 1.249 141 H3 DT 136 3H T 136 -5.873 6.576 1.699 142 H71 DT 136 1H7 T 136 -5.137 7.696 -2.896 143 H72 DT 136 2H7 T 136 -6.539 8.731 -3.246 144 H73 DT 136 3H7 T 136 -5.240 9.327 -2.188 145 H6 DT 136 6H T 136 -8.532 8.211 -1.965 146 H8 DG 137 8H G 137 -9.789 10.480 1.693 147 H1 DG 137 1H G 137 -3.880 9.108 3.820 148 H5' DG 137 H5' G 137 -12.117 7.421 2.417 149 H5'' DG 137 H5" G 137 -13.648 8.086 2.990 150 H4' DG 137 H4' G 137 -12.354 7.847 4.956 151 H3' DG 137 H3' G 137 -13.227 10.415 4.244 152 H2' DG 137 H2' G 137 -11.180 11.053 3.311 153 H2'' DG 137 H2" G 137 -10.867 11.618 4.938 154 H1' DG 137 H1' G 137 -9.556 9.652 5.501 155 H21 DG 137 1H2 G 137 -3.867 8.721 5.955 156 H22 DG 137 2H2 G 137 -5.352 8.732 6.891 157 H5 DC 138 5H C 138 -8.683 13.106 4.011 158 H6 DC 138 6H C 138 -9.242 12.335 6.257 159 H5' DC 138 H5' C 138 -10.350 9.248 7.477 160 H5'' DC 138 H5" C 138 -11.311 9.637 8.907 161 H4' DC 138 H4' C 138 -9.156 9.513 9.735 162 H3' DC 138 H3' C 138 -10.459 11.979 9.900 163 H2' DC 138 H2' C 138 -9.335 13.006 8.197 164 H2'' DC 138 H2" C 138 -8.171 13.401 9.428 165 H1' DC 138 H1' C 138 -6.668 11.656 8.857 166 H41 DC 138 1H4 C 138 -5.206 13.161 2.848 167 H42 DC 138 2H4 C 138 -6.904 13.252 2.415 168 H8 DG 139 8H G 139 -6.463 14.588 9.632 169 H1 DG 139 1H G 139 -2.216 15.787 4.973 170 H5' DG 139 H5' G 139 -6.199 11.178 11.137 171 H5'' DG 139 H5" G 139 -6.270 11.385 12.892 172 H4' DG 139 H4' G 139 -3.995 11.513 12.407 173 H3' DG 139 H3' G 139 -5.193 13.746 13.535 174 H2' DG 139 H2' G 139 -5.411 14.968 11.572 175 H2'' DG 139 H2" G 139 -3.808 15.538 12.006 176 H1' DG 139 H1' G 139 -2.717 14.030 10.518 177 H21 DG 139 1H2 G 139 -0.210 15.277 5.621 178 H22 DG 139 2H2 G 139 0.118 14.749 7.267 179 H5 DC 140 5H C 140 -4.241 17.606 10.492 180 H6 DC 140 6H C 140 -2.195 16.804 11.568 181 H5' DC 140 H5' C 140 -0.835 13.439 12.014 182 H5'' DC 140 H5" C 140 0.084 13.704 13.509 183 H4' DC 140 H4' C 140 1.527 14.231 11.665 184 H3' DC 140 H3' C 140 1.137 16.097 13.696 185 H2' DC 140 H2' C 140 -0.359 17.506 12.544 186 H2'' DC 140 H2" C 140 1.161 18.246 11.972 187 H1' DC 140 H1' C 140 1.164 17.034 9.949 188 H41 DC 140 1H4 C 140 -4.142 19.008 7.110 189 H42 DC 140 2H4 C 140 -5.135 18.474 8.448 190 H8 DG 141 8H G 141 -3.516 21.611 0.855 191 H1 DG 141 1H G 141 -1.667 18.820 6.335 192 H5' DG 141 H5' G 141 -0.847 24.562 -0.678 193 H5'' DG 141 H5" G 141 -1.114 23.889 -2.298 194 H4' DG 141 H4' G 141 0.774 22.833 -1.043 195 H3' DG 141 H3' G 141 -1.059 21.392 -2.589 196 H2' DG 141 H2' G 141 -2.324 20.594 -0.803 197 H2'' DG 141 H2" G 141 -1.134 19.287 -0.823 198 H1' DG 141 H1' G 141 0.140 20.266 0.939 199 H21 DG 141 1H2 G 141 0.438 18.272 6.264 200 H22 DG 141 2H2 G 141 1.389 18.457 4.795 201 H5 DC 142 5H C 142 -2.705 17.844 0.390 202 H6 DC 142 6H C 142 -0.376 17.289 -0.105 203 H5' DC 142 H5' C 142 2.050 19.684 0.333 204 H5'' DC 142 H5" C 142 3.203 19.235 -0.916 205 H4' DC 142 H4' C 142 3.928 18.047 0.910 206 H3' DC 142 H3' C 142 3.074 16.639 -1.327 207 H2' DC 142 H2' C 142 1.067 15.954 -0.565 208 H2'' DC 142 H2" C 142 1.907 14.643 0.147 209 H1' DC 142 H1' C 142 1.882 15.556 2.328 210 H41 DC 142 1H4 C 142 -4.202 16.898 3.605 211 H42 DC 142 2H4 C 142 -4.404 17.760 2.090 212 H8 DG 143 8H G 143 1.439 13.037 1.247 213 H1 DG 143 1H G 143 -3.772 12.390 4.899 214 H5' DG 143 H5' G 143 4.172 15.411 3.273 215 H5'' DG 143 H5" G 143 5.623 14.482 2.834 216 H4' DG 143 H4' G 143 4.838 13.579 4.882 217 H3' DG 143 H3' G 143 5.298 12.001 2.658 218 H2' DG 143 H2' G 143 3.089 11.824 1.946 219 H2'' DG 143 H2" G 143 3.079 10.423 2.999 220 H1' DG 143 H1' G 143 2.062 11.559 4.782 221 H21 DG 143 1H2 G 143 -3.278 11.654 6.868 222 H22 DG 143 2H2 G 143 -1.617 11.313 7.332 223 H5 DC 144 5H C 144 0.656 9.402 1.926 224 H6 DC 144 6H C 144 1.713 8.737 4.036 225 H5' DC 144 H5' C 144 3.092 10.886 6.347 226 H5'' DC 144 H5" C 144 4.346 9.921 7.083 227 H4' DC 144 H4' C 144 2.566 9.429 8.368 228 H3' DC 144 H3' C 144 3.631 7.328 6.876 229 H2' DC 144 H2' C 144 2.038 7.117 5.263 230 H2'' DC 144 H2" C 144 1.177 6.187 6.469 231 H1' DC 144 H1' C 144 -0.245 7.894 7.095 232 H41 DC 144 1H4 C 144 -2.986 9.783 1.660 233 H42 DC 144 2H4 C 144 -1.432 9.969 0.871 234 H8 DA 145 8H A 145 -0.255 4.927 5.889 235 H2 DA 145 2H A 145 -6.358 6.192 4.415 236 H5' DA 145 H5' A 145 -0.073 7.368 9.551 237 H5'' DA 145 H5" A 145 0.208 6.130 10.805 238 H4' DA 145 H4' A 145 -2.211 6.272 10.386 239 H3' DA 145 H3' A 145 -0.955 3.763 10.135 240 H2' DA 145 H2' A 145 -0.888 3.811 7.747 241 H2'' DA 145 H2" A 145 -2.443 2.994 7.974 242 H1' DA 145 H1' A 145 -3.668 5.061 7.792 243 H61 DA 145 2H6 A 145 -2.058 5.885 1.497 244 H62 DA 145 1H6 A 145 -3.671 6.219 0.898 245 H8 DG 146 8H G 146 -3.949 1.671 7.172 246 H1 DG 146 1H G 146 -5.835 3.420 1.307 247 H5' DG 146 H5' G 146 -5.307 4.654 9.916 248 H5'' DG 146 H5" G 146 -6.535 4.410 11.121 249 H4' DG 146 H4' G 146 -7.827 3.907 9.418 250 H3' DG 146 H3' G 146 -6.870 1.378 10.339 251 H2' DG 146 H2' G 146 -5.717 0.920 8.384 252 H2'' DG 146 H2" G 146 -7.316 0.447 7.776 253 H1' DG 146 H1' G 146 -7.719 2.590 6.792 254 H21 DG 146 1H2 G 146 -7.971 3.850 1.303 255 H22 DG 146 2H2 G 146 -8.918 3.834 2.768 256 H8 DA 147 8H A 147 -6.913 -1.217 6.444 257 H2 DA 147 2H A 147 -6.570 0.287 0.236 258 H5' DA 147 H5' A 147 -10.149 1.936 7.377 259 H5'' DA 147 H5" A 147 -11.601 0.953 7.711 260 H4' DA 147 H4' A 147 -11.284 1.074 5.327 261 H3' DA 147 H3' A 147 -11.279 -1.484 6.639 262 H2' DA 147 H2' A 147 -9.085 -1.980 6.068 263 H2'' DA 147 H2" A 147 -9.800 -2.446 4.496 264 H1' DA 147 H1' A 147 -9.391 -0.281 3.554 265 H61 DA 147 2H6 A 147 -2.817 -0.730 3.752 266 H62 DA 147 1H6 A 147 -2.566 -0.230 2.080 267 H5 DC 148 5H C 148 -7.120 -3.575 3.267 268 H6 DC 148 6H C 148 -9.424 -3.485 2.420 269 H5' DC 148 H5' C 148 -12.297 -0.755 1.844 270 H5'' DC 148 H5" C 148 -13.740 -1.763 1.717 271 H4' DC 148 H4' C 148 -12.757 -1.652 -0.459 272 H3' DC 148 H3' C 148 -13.264 -4.105 0.810 273 H2' DC 148 H2' C 148 -11.035 -4.461 1.448 274 H2'' DC 148 H2" C 148 -10.938 -5.256 -0.129 275 H1' DC 148 H1' C 148 -10.191 -3.260 -1.233 276 H41 DC 148 1H4 C 148 -4.238 -3.164 0.985 277 H42 DC 148 2H4 C 148 -4.771 -3.566 2.609 278 H8 DG 149 8H G 149 -9.190 -6.941 -1.006 279 H1 DG 149 1H G 149 -2.840 -5.876 -1.129 280 H5' DG 149 H5' G 149 -10.957 -3.491 -3.241 281 H5'' DG 149 H5" G 149 -12.150 -4.265 -4.301 282 H4' DG 149 H4' G 149 -10.130 -4.477 -5.475 283 H3' DG 149 H3' G 149 -11.535 -6.736 -4.617 284 H2' DG 149 H2' G 149 -10.097 -7.342 -2.908 285 H2'' DG 149 H2" G 149 -9.302 -8.260 -4.198 286 H1' DG 149 H1' G 149 -7.673 -6.499 -4.572 287 H21 DG 149 1H2 G 149 -2.181 -5.479 -3.160 288 H22 DG 149 2H2 G 149 -3.320 -5.356 -4.490 289 H5 DC 150 5H C 150 -7.053 -9.476 -1.695 290 H6 DC 150 6H C 150 -7.224 -9.765 -4.117 291 H5' DC 150 H5' C 150 -8.245 -9.115 -5.832 292 H5'' DC 150 H5" C 150 -7.999 -7.433 -6.370 293 H4' DC 150 H4' C 150 -6.745 -8.282 -8.343 294 H3' DC 150 H3' C 150 -7.765 -10.771 -7.725 295 H2' DC 150 H2' C 150 -6.828 -11.116 -5.675 296 H2'' DC 150 H2" C 150 -5.492 -11.718 -6.609 297 H1' DC 150 H1' C 150 -4.202 -9.777 -6.345 298 H41 DC 150 1H4 C 150 -3.766 -9.293 -0.063 299 H42 DC 150 2H4 C 150 -5.509 -9.306 0.168 300 H5 DC 151 5H C 151 -5.076 -12.827 -4.377 301 H6 DC 151 6H C 151 -3.889 -12.788 -6.513 302 H5' DC 151 H5' C 151 -3.475 -10.178 -9.255 303 H5'' DC 151 H5" C 151 -3.289 -11.283 -10.640 304 H4' DC 151 H4' C 151 -1.145 -10.967 -9.577 305 H3' DC 151 H3' C 151 -2.106 -13.554 -9.985 306 H2' DC 151 H2' C 151 -2.627 -13.977 -7.787 307 H2'' DC 151 H2" C 151 -0.959 -14.512 -7.694 308 H1' DC 151 H1' C 151 -0.196 -12.422 -6.781 309 H41 DC 151 1H4 C 151 -3.244 -12.749 -1.230 310 H42 DC 151 2H4 C 151 -4.804 -12.682 -2.018 311 H5 DC 152 5H C 152 -3.180 -15.958 -5.025 312 H6 DC 152 6H C 152 -0.985 -16.011 -6.119 313 H5' DC 152 H5' C 152 1.675 -13.276 -7.497 314 H5'' DC 152 H5" C 152 2.983 -14.006 -8.442 315 H4' DC 152 H4' C 152 3.542 -14.606 -6.218 316 H3' DC 152 H3' C 152 2.639 -16.718 -7.950 317 H2' DC 152 H2' C 152 0.757 -17.197 -6.739 318 H2'' DC 152 H2" C 152 1.868 -18.157 -5.732 319 H1' DC 152 H1' C 152 2.228 -16.320 -4.196 320 H41 DC 152 1H4 C 152 -3.453 -16.128 -1.372 321 H42 DC 152 2H4 C 152 -4.293 -15.983 -2.904 322 H5 DC 153 5H C 153 -1.368 -19.455 -4.697 323 H6 DC 153 6H C 153 1.029 -19.908 -4.494 324 H5' DC 153 H5' C 153 4.474 -17.600 -4.061 325 H5'' DC 153 H5" C 153 5.858 -18.649 -4.386 326 H4' DC 153 H4' C 153 5.217 -19.241 -2.226 327 H3' DC 153 H3' C 153 4.890 -21.136 -4.343 328 H2' DC 153 H2' C 153 2.595 -21.205 -4.282 329 H2'' DC 153 H2" C 153 2.876 -22.383 -2.985 330 H1' DC 153 H1' C 153 2.674 -20.712 -1.237 331 H41 DC 153 1H4 C 153 -3.522 -19.221 -1.730 332 H42 DC 153 2H4 C 153 -3.461 -19.469 -3.465 333 H5 DC 154 5H C 154 -0.145 -22.760 -3.053 334 H6 DC 154 6H C 154 1.681 -23.459 -1.583 335 H5' DC 154 H5' C 154 4.694 -21.797 0.080 336 H5'' DC 154 H5" C 154 5.773 -23.130 0.516 337 H4' DC 154 H4' C 154 4.046 -22.983 2.170 338 H3' DC 154 H3' C 154 4.547 -25.307 0.630 339 H2' DC 154 H2' C 154 2.485 -25.348 -0.415 340 H2'' DC 154 H2" C 154 1.975 -26.133 1.109 341 H1' DC 154 H1' C 154 1.178 -24.084 2.046 342 H41 DC 154 1H4 C 154 -3.626 -22.680 -1.832 343 H42 DC 154 2H4 C 154 -2.547 -22.433 -3.192 344 H8 DG 155 8H G 155 0.517 -27.631 0.881 345 H1 DG 155 1H G 155 -5.541 -25.868 -0.284 346 H5' DG 155 H5' G 155 2.271 -25.504 4.573 347 H5'' DG 155 H5" G 155 2.794 -26.872 5.581 348 H4' DG 155 H4' G 155 0.400 -26.526 5.890 349 H3' DG 155 H3' G 155 1.489 -29.007 4.989 350 H2' DG 155 H2' G 155 0.513 -28.895 2.871 351 H2'' DG 155 H2" G 155 -0.887 -29.566 3.751 352 H1' DG 155 H1' G 155 -1.879 -27.381 4.025 353 H21 DG 155 1H2 G 155 -6.699 -25.871 1.526 354 H22 DG 155 2H2 G 155 -5.980 -26.253 3.084 355 H5 DC 156 5H C 156 -1.584 -30.563 1.122 356 H6 DC 156 6H C 156 -2.473 -30.916 3.382 357 H5' DC 156 H5' C 156 -2.710 -28.699 6.909 358 H5'' DC 156 H5" C 156 -3.022 -29.961 8.117 359 H4' DC 156 H4' C 156 -5.099 -29.449 7.007 360 H3' DC 156 H3' C 156 -3.944 -32.071 6.949 361 H2' DC 156 H2' C 156 -3.685 -32.158 4.656 362 H2'' DC 156 H2" C 156 -5.434 -32.484 4.694 363 H1' DC 156 H1' C 156 -6.055 -30.266 4.262 364 H41 DC 156 1H4 C 156 -3.762 -29.319 -1.574 365 H42 DC 156 2H4 C 156 -2.132 -29.731 -1.087 366 H8 DG 157 8H G 157 -6.397 -34.824 4.636 367 H1 DG 157 1H G 157 -6.879 -32.183 -1.179 368 H5' DG 157 H5' G 157 -8.674 -31.534 7.236 369 H5'' DG 157 H5" G 157 -9.468 -32.733 8.286 370 H4' DG 157 H4' G 157 -10.770 -32.376 6.218 371 H3' DG 157 H3' G 157 -10.065 -34.924 7.088 372 H2' DG 157 H2' G 157 -8.302 -35.304 5.584 373 H2'' DG 157 H2" G 157 -9.653 -35.925 4.572 374 H1' DG 157 H1' G 157 -9.957 -33.833 3.488 375 H21 DG 157 1H2 G 157 -8.971 -31.814 -1.626 376 H22 DG 157 2H2 G 157 -10.224 -32.044 -0.422 377 HA ALA 1 HA ALA 1 -6.611 24.796 -13.633 378 H1 ALA 1 HN ALA 1 -9.230 24.497 -13.368 379 HB1 ALA 1 1HB ALA 1 -8.148 26.680 -13.170 380 HB2 ALA 1 2HB ALA 1 -8.190 26.233 -11.449 381 HB3 ALA 1 3HB ALA 1 -6.678 26.805 -12.184 382 H SER 2 HN SER 2 -7.874 22.811 -11.198 383 HA SER 2 HA SER 2 -6.150 23.125 -9.000 384 HG SER 2 HG SER 2 -7.042 19.837 -8.010 385 HB2 SER 2 2HB SER 2 -8.091 21.616 -9.000 386 HB3 SER 2 3HB SER 2 -7.291 20.550 -10.175 387 H GLU 3 HN GLU 3 -5.683 21.016 -11.894 388 HA GLU 3 HA GLU 3 -2.970 20.309 -11.030 389 HB2 GLU 3 2HB GLU 3 -4.548 19.626 -13.564 390 HB3 GLU 3 3HB GLU 3 -2.945 18.997 -13.140 391 HG2 GLU 3 2HG GLU 3 -4.052 18.307 -10.876 392 HG3 GLU 3 3HG GLU 3 -5.575 18.448 -11.759 393 H LYS 4 HN LYS 4 -3.710 23.196 -11.786 394 HA LYS 4 HA LYS 4 -1.455 23.581 -13.741 395 HB2 LYS 4 2HB LYS 4 -3.641 25.572 -12.980 396 HB3 LYS 4 3HB LYS 4 -2.360 25.829 -14.150 397 HG2 LYS 4 2HG LYS 4 -4.605 23.780 -14.414 398 HG3 LYS 4 3HG LYS 4 -4.513 25.343 -15.226 399 HD2 LYS 4 2HD LYS 4 -2.404 24.617 -16.360 400 HD3 LYS 4 3HD LYS 4 -2.583 23.010 -15.639 401 HE2 LYS 4 2HE LYS 4 -4.630 24.345 -17.460 402 HE3 LYS 4 3HE LYS 4 -3.416 23.172 -17.993 403 HZ1 LYS 4 3HZ LYS 4 -5.539 22.649 -16.021 404 HZ2 LYS 4 1HZ LYS 4 -4.392 21.567 -16.489 405 HZ3 LYS 4 2HZ LYS 4 -5.508 22.105 -17.576 406 H ARG 5 HN ARG 5 -2.291 23.582 -10.479 407 HA ARG 5 HA ARG 5 -0.677 25.853 -9.578 408 HE ARG 5 HE ARG 5 -4.240 22.953 -7.814 409 HB2 ARG 5 2HB ARG 5 -1.773 23.416 -8.124 410 HB3 ARG 5 3HB ARG 5 -1.027 24.780 -7.317 411 HG2 ARG 5 2HG ARG 5 -2.820 26.278 -8.067 412 HG3 ARG 5 3HG ARG 5 -3.593 24.962 -8.968 413 HD2 ARG 5 2HD ARG 5 -3.084 24.942 -5.964 414 HD3 ARG 5 3HD ARG 5 -4.621 25.388 -6.722 415 HH11 ARG 5 1HH1 ARG 5 -3.778 23.773 -4.391 416 HH12 ARG 5 2HH1 ARG 5 -4.253 22.165 -3.898 417 HH21 ARG 5 1HH2 ARG 5 -5.110 21.075 -7.029 418 HH22 ARG 5 2HH2 ARG 5 -4.916 20.682 -5.326 419 HA PRO 6 HA PRO 6 3.195 23.575 -9.292 420 HB2 PRO 6 2HB PRO 6 4.497 24.949 -7.327 421 HB3 PRO 6 3HB PRO 6 4.138 25.687 -8.916 422 HG2 PRO 6 2HG PRO 6 2.580 25.988 -6.328 423 HG3 PRO 6 3HG PRO 6 3.115 27.275 -7.454 424 HD2 PRO 6 2HD PRO 6 0.594 26.181 -7.494 425 HD3 PRO 6 3HD PRO 6 1.399 26.786 -8.973 426 H PHE 7 HN PHE 7 4.107 21.894 -8.086 427 HA PHE 7 HA PHE 7 3.029 21.420 -5.324 428 HD1 PHE 7 1HD PHE 7 0.459 20.296 -5.063 429 HD2 PHE 7 2HD PHE 7 1.590 20.003 -9.184 430 HE1 PHE 7 1HE PHE 7 -1.894 20.677 -5.721 431 HE2 PHE 7 2HE PHE 7 -0.754 20.474 -9.858 432 HZ PHE 7 HZ PHE 7 -2.506 20.781 -8.120 433 HB2 PHE 7 2HB PHE 7 3.114 19.318 -7.517 434 HB3 PHE 7 3HB PHE 7 2.609 19.041 -5.868 435 H MET 8 HN MET 8 4.579 20.574 -3.918 436 HA MET 8 HA MET 8 6.858 19.112 -5.201 437 HB2 MET 8 2HB MET 8 8.424 20.061 -3.627 438 HB3 MET 8 3HB MET 8 7.602 21.366 -4.482 439 HG2 MET 8 2HG MET 8 6.132 21.728 -2.519 440 HG3 MET 8 3HG MET 8 6.945 20.410 -1.667 441 HE1 MET 8 3HE MET 8 7.460 21.784 0.420 442 HE2 MET 8 1HE MET 8 8.187 23.408 0.401 443 HE3 MET 8 2HE MET 8 6.572 23.150 -0.297 444 H CYS 9 HN CYS 9 7.806 17.455 -4.063 445 HA CYS 9 HA CYS 9 6.132 16.039 -2.135 446 HB2 CYS 9 2HB CYS 9 7.604 14.836 -3.697 447 HB3 CYS 9 3HB CYS 9 9.022 15.641 -3.049 448 H ALA 10 HN ALA 10 7.306 15.288 -0.017 449 HA ALA 10 HA ALA 10 8.914 17.445 1.219 450 HB1 ALA 10 1HB ALA 10 6.235 16.510 2.340 451 HB2 ALA 10 2HB ALA 10 7.395 17.553 3.195 452 HB3 ALA 10 3HB ALA 10 6.608 18.117 1.710 453 H TYR 11 HN TYR 11 8.654 14.254 0.493 454 HA TYR 11 HA TYR 11 9.352 12.993 3.019 455 HD1 TYR 11 1HD TYR 11 8.026 10.587 2.979 456 HD2 TYR 11 2HD TYR 11 11.767 10.354 0.851 457 HE1 TYR 11 1HE TYR 11 8.655 8.580 4.316 458 HE2 TYR 11 2HE TYR 11 12.409 8.375 2.230 459 HH TYR 11 HH TYR 11 10.359 6.730 4.547 460 HB2 TYR 11 2HB TYR 11 8.503 11.898 0.833 461 HB3 TYR 11 3HB TYR 11 10.153 12.046 0.246 462 HA PRO 12 HA PRO 12 13.296 14.777 3.532 463 HB2 PRO 12 2HB PRO 12 14.550 12.878 5.156 464 HB3 PRO 12 3HB PRO 12 13.268 13.998 5.686 465 HG2 PRO 12 2HG PRO 12 12.964 11.122 4.776 466 HG3 PRO 12 3HG PRO 12 12.287 11.902 6.244 467 HD2 PRO 12 2HD PRO 12 10.784 11.591 4.054 468 HD3 PRO 12 3HD PRO 12 10.701 13.131 4.958 469 H GLY 13 HN GLY 13 12.951 12.101 1.526 470 HA2 GLY 13 2HA GLY 13 15.874 12.091 0.845 471 HA3 GLY 13 3HA GLY 13 14.797 10.709 0.576 472 H CYS 14 HN CYS 14 13.005 13.475 -0.079 473 HA CYS 14 HA CYS 14 13.713 13.406 -2.991 474 HB2 CYS 14 2HB CYS 14 11.859 11.898 -2.594 475 HB3 CYS 14 3HB CYS 14 10.979 13.117 -1.665 476 H ASN 15 HN ASN 15 10.889 15.009 -1.554 477 HA ASN 15 HA ASN 15 10.193 17.199 -1.619 478 HB2 ASN 15 2HB ASN 15 12.049 17.491 0.054 479 HB3 ASN 15 3HB ASN 15 13.135 17.937 -1.257 480 HD21 ASN 15 1HD2 ASN 15 9.630 19.050 -0.744 481 HD22 ASN 15 2HD2 ASN 15 10.210 20.709 -0.623 482 H LYS 16 HN LYS 16 10.650 15.874 -4.117 483 HA LYS 16 HA LYS 16 11.894 17.873 -5.918 484 HB2 LYS 16 2HB LYS 16 10.562 15.163 -6.372 485 HB3 LYS 16 3HB LYS 16 11.068 16.213 -7.696 486 HG2 LYS 16 2HG LYS 16 13.380 16.265 -6.818 487 HG3 LYS 16 3HG LYS 16 12.943 15.147 -5.531 488 HD2 LYS 16 2HD LYS 16 12.635 14.529 -8.504 489 HD3 LYS 16 3HD LYS 16 14.093 14.156 -7.591 490 HE2 LYS 16 2HE LYS 16 11.341 13.069 -6.870 491 HE3 LYS 16 3HE LYS 16 12.515 12.224 -7.901 492 HZ1 LYS 16 3HZ LYS 16 12.763 12.940 -5.076 493 HZ2 LYS 16 1HZ LYS 16 14.076 12.447 -5.965 494 HZ3 LYS 16 2HZ LYS 16 12.780 11.442 -5.721 495 H ARG 17 HN ARG 17 10.711 18.736 -7.771 496 HA ARG 17 HA ARG 17 8.066 19.667 -6.799 497 HE ARG 17 HE ARG 17 10.268 23.524 -5.173 498 HB2 ARG 17 2HB ARG 17 10.206 20.792 -8.641 499 HB3 ARG 17 3HB ARG 17 8.547 21.352 -8.796 500 HG2 ARG 17 2HG ARG 17 9.788 22.859 -7.398 501 HG3 ARG 17 3HG ARG 17 8.473 22.108 -6.501 502 HD2 ARG 17 2HD ARG 17 10.057 20.650 -5.318 503 HD3 ARG 17 3HD ARG 17 11.398 21.255 -6.312 504 HH11 ARG 17 2HH1 ARG 17 11.733 20.610 -3.705 505 HH12 ARG 17 1HH1 ARG 17 12.244 21.501 -2.323 506 HH21 ARG 17 2HH2 ARG 17 10.987 24.558 -3.360 507 HH22 ARG 17 1HH2 ARG 17 11.880 23.648 -2.158 508 H TYR 18 HN TYR 18 6.250 19.082 -7.698 509 HA TYR 18 HA TYR 18 6.221 17.832 -10.399 510 HD1 TYR 18 2HD TYR 18 6.336 16.839 -6.615 511 HD2 TYR 18 1HD TYR 18 5.139 14.842 -10.256 512 HE1 TYR 18 2HE TYR 18 7.934 15.012 -6.152 513 HE2 TYR 18 1HE TYR 18 6.825 13.087 -9.833 514 HH TYR 18 HH TYR 18 8.708 12.948 -6.886 515 HB2 TYR 18 2HB TYR 18 4.392 17.615 -7.983 516 HB3 TYR 18 3HB TYR 18 4.023 16.892 -9.534 517 H PHE 19 HN PHE 19 4.056 18.148 -11.550 518 HA PHE 19 HA PHE 19 3.166 21.004 -11.238 519 HD1 PHE 19 1HD PHE 19 4.536 22.838 -12.886 520 HD2 PHE 19 2HD PHE 19 5.856 18.806 -13.659 521 HE1 PHE 19 1HE PHE 19 6.898 23.609 -12.901 522 HE2 PHE 19 2HE PHE 19 8.213 19.579 -13.655 523 HZ PHE 19 HZ PHE 19 8.737 21.979 -13.284 524 HB2 PHE 19 2HB PHE 19 3.494 19.368 -13.795 525 HB3 PHE 19 3HB PHE 19 2.949 21.041 -13.695 526 H LYS 20 HN LYS 20 2.204 17.624 -11.757 527 HA LYS 20 HA LYS 20 -0.664 18.473 -11.940 528 HB2 LYS 20 2HB LYS 20 0.929 16.250 -13.106 529 HB3 LYS 20 3HB LYS 20 -0.609 15.729 -12.388 530 HG2 LYS 20 2HG LYS 20 -0.765 16.227 -14.799 531 HG3 LYS 20 3HG LYS 20 -1.862 17.167 -13.802 532 HD2 LYS 20 2HD LYS 20 -0.278 19.123 -13.962 533 HD3 LYS 20 3HD LYS 20 0.724 18.175 -15.072 534 HE2 LYS 20 2HE LYS 20 -1.038 18.136 -16.714 535 HE3 LYS 20 3HE LYS 20 -2.246 18.658 -15.523 536 HZ1 LYS 20 3HZ LYS 20 0.002 20.319 -16.441 537 HZ2 LYS 20 1HZ LYS 20 -1.166 20.753 -15.357 538 HZ3 LYS 20 2HZ LYS 20 -1.565 20.473 -16.938 539 H LEU 21 HN LEU 21 -2.001 18.118 -10.255 540 HA LEU 21 HA LEU 21 -1.104 17.354 -7.698 541 HG LEU 21 HG LEU 21 -3.722 15.901 -6.719 542 HB2 LEU 21 2HB LEU 21 -3.239 18.566 -8.136 543 HB3 LEU 21 3HB LEU 21 -3.896 17.128 -8.900 544 HD11 LEU 21 1HD1 LEU 21 -1.949 17.260 -5.615 545 HD12 LEU 21 2HD1 LEU 21 -3.421 17.183 -4.643 546 HD13 LEU 21 3HD1 LEU 21 -3.060 18.649 -5.576 547 HD21 LEU 21 3HD2 LEU 21 -5.635 17.034 -5.681 548 HD22 LEU 21 1HD2 LEU 21 -5.817 16.954 -7.439 549 HD23 LEU 21 2HD2 LEU 21 -5.328 18.479 -6.668 550 H SER 22 HN SER 22 -2.863 15.380 -10.151 551 HA SER 22 HA SER 22 -2.880 12.971 -8.592 552 HG SER 22 HG SER 22 -3.366 14.483 -11.911 553 HB2 SER 22 2HB SER 22 -3.516 11.888 -10.736 554 HB3 SER 22 3HB SER 22 -4.481 13.330 -10.383 555 H HIS 23 HN HIS 23 -0.559 14.262 -10.976 556 HA HIS 23 HA HIS 23 0.878 11.733 -11.237 557 HD1 HIS 23 1HD HIS 23 3.684 13.871 -14.133 558 HD2 HIS 23 2HD HIS 23 2.518 15.810 -10.616 559 HE1 HIS 23 1HE HIS 23 5.153 15.953 -13.918 560 HB2 HIS 23 2HB HIS 23 1.859 12.697 -12.910 561 HB3 HIS 23 3HB HIS 23 0.746 13.982 -12.788 562 H LEU 24 HN LEU 24 0.915 14.511 -9.129 563 HA LEU 24 HA LEU 24 3.461 13.818 -7.825 564 HG LEU 24 HG LEU 24 3.414 16.793 -5.910 565 HB2 LEU 24 2HB LEU 24 2.654 16.136 -7.889 566 HB3 LEU 24 3HB LEU 24 1.219 15.705 -7.033 567 HD11 LEU 24 1HD1 LEU 24 1.510 14.914 -4.474 568 HD12 LEU 24 2HD1 LEU 24 1.224 16.628 -4.859 569 HD13 LEU 24 3HD1 LEU 24 2.508 16.180 -3.726 570 HD21 LEU 24 3HD2 LEU 24 4.668 14.476 -6.222 571 HD22 LEU 24 1HD2 LEU 24 3.776 14.060 -4.741 572 HD23 LEU 24 2HD2 LEU 24 4.843 15.448 -4.756 573 H GLN 25 HN GLN 25 -0.083 13.425 -7.270 574 HA GLN 25 HA GLN 25 0.060 12.078 -4.776 575 HB2 GLN 25 2HB GLN 25 -2.054 12.841 -5.687 576 HB3 GLN 25 3HB GLN 25 -1.900 11.803 -7.093 577 HG2 GLN 25 2HG GLN 25 -3.545 11.005 -5.393 578 HG3 GLN 25 3HG GLN 25 -2.335 9.832 -5.886 579 HE21 GLN 25 1HE2 GLN 25 -2.079 12.484 -3.341 580 HE22 GLN 25 2HE2 GLN 25 -1.716 11.275 -2.110 581 H MET 26 HN MET 26 0.245 10.797 -8.139 582 HA MET 26 HA MET 26 0.624 8.053 -7.475 583 HB2 MET 26 2HB MET 26 1.335 9.803 -9.827 584 HB3 MET 26 3HB MET 26 2.018 8.177 -9.732 585 HG2 MET 26 2HG MET 26 -0.965 8.737 -9.491 586 HG3 MET 26 3HG MET 26 -0.138 8.354 -10.998 587 HE1 MET 26 3HE MET 26 -1.124 6.913 -7.390 588 HE2 MET 26 1HE MET 26 -2.441 6.776 -8.578 589 HE3 MET 26 2HE MET 26 -1.643 5.316 -7.954 590 H HIS 27 HN HIS 27 3.030 10.723 -7.946 591 HA HIS 27 HA HIS 27 5.358 9.187 -7.460 592 HD1 HIS 27 1HD HIS 27 7.902 9.910 -6.847 593 HD2 HIS 27 2HD HIS 27 5.926 13.111 -4.946 594 HE1 HIS 27 1HE HIS 27 9.367 10.646 -4.860 595 HB2 HIS 27 2HB HIS 27 5.711 11.393 -8.238 596 HB3 HIS 27 3HB HIS 27 4.693 12.130 -7.005 597 H SER 28 HN SER 28 3.287 10.980 -5.108 598 HA SER 28 HA SER 28 4.717 10.496 -2.836 599 HG SER 28 HG SER 28 1.169 10.056 -3.777 600 HB2 SER 28 2HB SER 28 2.785 11.050 -1.617 601 HB3 SER 28 3HB SER 28 2.571 11.878 -3.158 602 H ARG 29 HN ARG 29 2.686 8.148 -4.586 603 HA ARG 29 HA ARG 29 2.165 6.330 -2.448 604 HE ARG 29 HE ARG 29 0.161 5.106 -2.702 605 HB2 ARG 29 2HB ARG 29 2.723 5.603 -5.359 606 HB3 ARG 29 3HB ARG 29 1.881 4.643 -4.164 607 HG2 ARG 29 2HG ARG 29 0.901 7.027 -5.675 608 HG3 ARG 29 3HG ARG 29 0.164 5.455 -5.476 609 HD2 ARG 29 2HD ARG 29 0.277 7.760 -3.496 610 HD3 ARG 29 3HD ARG 29 -1.135 7.116 -4.340 611 HH11 ARG 29 1HH2 ARG 29 -2.043 7.866 -2.487 612 HH12 ARG 29 2HH2 ARG 29 -2.891 7.201 -1.106 613 HH21 ARG 29 1HH1 ARG 29 -0.665 4.528 -0.734 614 HH22 ARG 29 2HH1 ARG 29 -2.053 5.431 -0.113 615 H LYS 30 HN LYS 30 5.056 6.793 -4.517 616 HA LYS 30 HA LYS 30 6.496 4.408 -3.801 617 HB2 LYS 30 2HB LYS 30 7.209 5.866 -5.642 618 HB3 LYS 30 3HB LYS 30 7.459 7.211 -4.529 619 HG2 LYS 30 2HG LYS 30 9.576 6.263 -5.207 620 HG3 LYS 30 3HG LYS 30 9.343 6.107 -3.472 621 HD2 LYS 30 2HD LYS 30 8.633 3.692 -3.860 622 HD3 LYS 30 3HD LYS 30 9.077 3.891 -5.561 623 HE2 LYS 30 2HE LYS 30 10.927 4.307 -3.163 624 HE3 LYS 30 3HE LYS 30 10.845 2.825 -4.120 625 HZ1 LYS 30 3HZ LYS 30 12.641 4.237 -4.830 626 HZ2 LYS 30 1HZ LYS 30 11.605 5.475 -5.150 627 HZ3 LYS 30 2HZ LYS 30 11.534 4.090 -6.043 628 H HIS 31 HN HIS 31 5.995 7.479 -2.113 629 HA HIS 31 HA HIS 31 8.052 6.869 -0.096 630 HD1 HIS 31 1HD HIS 31 9.919 8.078 -0.425 631 HD2 HIS 31 2HD HIS 31 7.452 11.192 -1.861 632 HE1 HIS 31 1HE HIS 31 11.404 9.622 -1.789 633 HB2 HIS 31 2HB HIS 31 6.184 9.237 -0.537 634 HB3 HIS 31 3HB HIS 31 7.238 9.083 0.864 635 H THR 32 HN THR 32 4.749 5.937 -0.461 636 HA THR 32 HA THR 32 3.783 6.770 2.208 637 HB THR 32 HB THR 32 1.841 5.337 1.650 638 HG1 THR 32 1HG THR 32 3.156 4.890 -0.855 639 HG21 THR 32 3HG2 THR 32 1.895 7.749 1.125 640 HG22 THR 32 1HG2 THR 32 0.787 6.805 0.115 641 HG23 THR 32 2HG2 THR 32 2.335 7.358 -0.535 642 H GLY 33 HN GLY 33 5.187 3.951 0.536 643 HA2 GLY 33 2HA GLY 33 4.764 2.225 2.899 644 HA3 GLY 33 3HA GLY 33 5.463 1.747 1.341 645 H GLU 34 HN GLU 34 6.978 4.613 2.205 646 HA GLU 34 HA GLU 34 9.400 3.136 3.058 647 HB2 GLU 34 2HB GLU 34 8.945 6.057 2.218 648 HB3 GLU 34 3HB GLU 34 10.514 5.380 2.747 649 HG2 GLU 34 2HG GLU 34 10.413 3.613 1.077 650 HG3 GLU 34 3HG GLU 34 8.899 4.246 0.455 651 H LYS 35 HN LYS 35 7.079 3.388 4.901 652 HA LYS 35 HA LYS 35 8.720 4.250 7.227 653 HB2 LYS 35 2HB LYS 35 7.143 6.104 6.712 654 HB3 LYS 35 3HB LYS 35 5.777 4.999 6.865 655 HG2 LYS 35 2HG LYS 35 6.287 4.644 9.245 656 HG3 LYS 35 3HG LYS 35 7.787 5.586 9.105 657 HD2 LYS 35 2HD LYS 35 6.558 7.625 8.667 658 HD3 LYS 35 3HD LYS 35 5.050 6.723 8.466 659 HE2 LYS 35 2HE LYS 35 5.200 5.987 10.854 660 HE3 LYS 35 3HE LYS 35 6.612 7.044 11.054 661 HZ1 LYS 35 3HZ LYS 35 5.207 8.900 10.424 662 HZ2 LYS 35 1HZ LYS 35 4.568 8.118 11.730 663 HZ3 LYS 35 2HZ LYS 35 3.908 7.900 10.236 664 HA PRO 36 HA PRO 36 6.859 0.043 7.401 665 HB2 PRO 36 2HB PRO 36 9.084 -1.397 8.113 666 HB3 PRO 36 3HB PRO 36 8.858 -0.725 6.473 667 HG2 PRO 36 2HG PRO 36 10.418 0.495 8.779 668 HG3 PRO 36 3HG PRO 36 10.980 0.204 7.100 669 HD2 PRO 36 2HD PRO 36 10.007 2.620 7.909 670 HD3 PRO 36 3HD PRO 36 9.687 1.988 6.260 671 H TYR 37 HN TYR 37 6.905 -1.779 9.115 672 HA TYR 37 HA TYR 37 7.139 -0.672 11.909 673 HD1 TYR 37 2HD TYR 37 4.665 -1.019 8.827 674 HD2 TYR 37 1HD TYR 37 3.761 0.369 12.819 675 HE1 TYR 37 2HE TYR 37 3.453 0.909 7.890 676 HE2 TYR 37 1HE TYR 37 2.312 2.157 11.845 677 HH TYR 37 HH TYR 37 2.379 2.942 8.463 678 HB2 TYR 37 2HB TYR 37 4.863 -2.477 11.015 679 HB3 TYR 37 3HB TYR 37 5.042 -1.577 12.531 680 H GLN 38 HN GLN 38 6.890 -2.586 13.553 681 HA GLN 38 HA GLN 38 7.801 -5.168 12.437 682 HB2 GLN 38 2HB GLN 38 9.517 -5.530 13.918 683 HB3 GLN 38 3HB GLN 38 9.847 -3.912 13.327 684 HG2 GLN 38 2HG GLN 38 9.426 -2.923 15.418 685 HG3 GLN 38 3HG GLN 38 8.449 -4.269 16.012 686 HE21 GLN 38 1HE2 GLN 38 9.436 -6.250 16.736 687 HE22 GLN 38 2HE2 GLN 38 11.184 -6.291 17.035 688 H CYS 39 HN CYS 39 7.331 -6.957 13.808 689 HA CYS 39 HA CYS 39 4.962 -6.632 15.506 690 HB2 CYS 39 2HB CYS 39 6.194 -8.788 14.152 691 HB3 CYS 39 3HB CYS 39 6.375 -9.137 15.878 692 H ASP 40 HN ASP 40 4.880 -6.315 17.667 693 HA ASP 40 HA ASP 40 7.421 -5.640 18.986 694 HB2 ASP 40 2HB ASP 40 5.372 -4.168 19.002 695 HB3 ASP 40 3HB ASP 40 4.562 -5.369 20.012 696 H PHE 41 HN PHE 41 5.972 -8.554 18.669 697 HA PHE 41 HA PHE 41 5.675 -9.524 21.356 698 HD1 PHE 41 1HD PHE 41 3.723 -11.557 21.386 699 HD2 PHE 41 2HD PHE 41 4.637 -10.088 17.454 700 HE1 PHE 41 1HE PHE 41 1.293 -11.163 20.982 701 HE2 PHE 41 2HE PHE 41 2.228 -9.570 17.098 702 HZ PHE 41 HZ PHE 41 0.563 -10.085 18.852 703 HB2 PHE 41 2HB PHE 41 6.343 -10.966 18.768 704 HB3 PHE 41 3HB PHE 41 5.997 -11.791 20.274 705 H LYS 42 HN LYS 42 8.502 -8.829 19.415 706 HA LYS 42 HA LYS 42 10.785 -8.974 19.842 707 HB2 LYS 42 2HB LYS 42 10.024 -9.911 22.678 708 HB3 LYS 42 3HB LYS 42 11.612 -9.446 22.124 709 HG2 LYS 42 2HG LYS 42 11.011 -7.183 21.744 710 HG3 LYS 42 3HG LYS 42 9.292 -7.525 21.798 711 HD2 LYS 42 2HD LYS 42 9.519 -8.112 24.247 712 HD3 LYS 42 3HD LYS 42 11.195 -7.534 24.149 713 HE2 LYS 42 2HE LYS 42 9.879 -5.687 24.945 714 HE3 LYS 42 3HE LYS 42 10.289 -5.332 23.260 715 HZ1 LYS 42 3HZ LYS 42 8.063 -6.195 22.668 716 HZ2 LYS 42 1HZ LYS 42 7.995 -4.868 23.634 717 HZ3 LYS 42 2HZ LYS 42 7.710 -6.367 24.258 718 H ASP 43 HN ASP 43 8.815 -11.780 20.831 719 HA ASP 43 HA ASP 43 10.902 -13.707 20.055 720 HB2 ASP 43 2HB ASP 43 9.223 -14.219 21.818 721 HB3 ASP 43 3HB ASP 43 7.925 -14.057 20.636 722 H CYS 44 HN CYS 44 8.384 -11.820 18.537 723 HA CYS 44 HA CYS 44 8.085 -13.522 16.181 724 HB2 CYS 44 2HB CYS 44 6.210 -12.153 16.849 725 HB3 CYS 44 3HB CYS 44 7.197 -10.680 16.813 726 H GLU 45 HN GLU 45 9.121 -10.043 16.398 727 HA GLU 45 HA GLU 45 10.800 -8.863 15.372 728 HB2 GLU 45 2HB GLU 45 12.175 -11.600 15.463 729 HB3 GLU 45 3HB GLU 45 12.949 -10.215 14.731 730 HG2 GLU 45 2HG GLU 45 11.841 -10.159 17.541 731 HG3 GLU 45 3HG GLU 45 13.508 -10.602 17.151 732 H ARG 46 HN ARG 46 8.557 -10.082 13.803 733 HA ARG 46 HA ARG 46 9.833 -10.152 11.096 734 HE ARG 46 HE ARG 46 6.323 -12.634 12.895 735 HB2 ARG 46 2HB ARG 46 6.989 -10.764 12.026 736 HB3 ARG 46 3HB ARG 46 7.450 -10.634 10.332 737 HG2 ARG 46 2HG ARG 46 9.064 -12.416 10.490 738 HG3 ARG 46 3HG ARG 46 8.882 -12.541 12.241 739 HD2 ARG 46 2HD ARG 46 6.616 -13.093 10.289 740 HD3 ARG 46 3HD ARG 46 7.736 -14.327 10.904 741 HH11 ARG 46 1HH2 ARG 46 6.722 -15.908 11.673 742 HH12 ARG 46 2HH2 ARG 46 5.884 -16.563 13.071 743 HH21 ARG 46 2HH1 ARG 46 5.278 -13.469 14.470 744 HH22 ARG 46 1HH1 ARG 46 5.027 -15.209 14.622 745 H ARG 47 HN ARG 47 9.301 -8.604 9.543 746 HA ARG 47 HA ARG 47 8.223 -6.072 10.712 747 HE ARG 47 HE ARG 47 11.956 -4.906 12.917 748 HB2 ARG 47 2HB ARG 47 10.575 -6.625 8.865 749 HB3 ARG 47 3HB ARG 47 9.761 -5.069 8.837 750 HG2 ARG 47 2HG ARG 47 11.632 -4.822 10.252 751 HG3 ARG 47 3HG ARG 47 10.184 -4.750 11.242 752 HD2 ARG 47 2HD ARG 47 10.623 -7.110 11.985 753 HD3 ARG 47 3HD ARG 47 12.099 -7.112 11.006 754 HH11 ARG 47 2HH2 ARG 47 12.774 -8.385 12.838 755 HH12 ARG 47 1HH2 ARG 47 13.854 -8.138 14.202 756 HH21 ARG 47 1HH1 ARG 47 13.010 -4.998 14.914 757 HH22 ARG 47 2HH1 ARG 47 13.960 -6.429 15.265 758 H PHE 48 HN PHE 48 7.141 -4.621 9.301 759 HA PHE 48 HA PHE 48 6.105 -5.799 6.760 760 HD1 PHE 48 1HD PHE 48 3.776 -7.496 6.714 761 HD2 PHE 48 2HD PHE 48 4.981 -6.326 10.682 762 HE1 PHE 48 1HE PHE 48 3.755 -9.863 7.427 763 HE2 PHE 48 2HE PHE 48 4.954 -8.706 11.404 764 HZ PHE 48 HZ PHE 48 4.447 -10.473 9.735 765 HB2 PHE 48 2HB PHE 48 4.389 -4.615 8.993 766 HB3 PHE 48 3HB PHE 48 3.808 -5.099 7.401 767 H SER 49 HN SER 49 4.932 -4.093 5.444 768 HA SER 49 HA SER 49 6.550 -1.592 5.668 769 HG SER 49 HG SER 49 4.219 -3.419 3.700 770 HB2 SER 49 2HB SER 49 6.091 -1.296 3.304 771 HB3 SER 49 3HB SER 49 6.647 -2.953 3.574 772 H ARG 50 HN ARG 50 3.248 -2.740 5.947 773 HA ARG 50 HA ARG 50 2.370 0.094 6.327 774 HE ARG 50 HE ARG 50 -0.948 -1.911 3.036 775 HB2 ARG 50 2HB ARG 50 0.846 -2.117 4.893 776 HB3 ARG 50 3HB ARG 50 0.148 -0.585 5.435 777 HG2 ARG 50 2HG ARG 50 1.885 0.624 4.035 778 HG3 ARG 50 3HG ARG 50 2.285 -0.945 3.308 779 HD2 ARG 50 2HD ARG 50 -0.473 0.376 3.336 780 HD3 ARG 50 3HD ARG 50 0.623 0.365 1.964 781 HH11 ARG 50 1HH2 ARG 50 1.424 -0.891 0.655 782 HH12 ARG 50 2HH2 ARG 50 1.018 -2.241 -0.389 783 HH21 ARG 50 2HH1 ARG 50 -1.279 -3.606 1.645 784 HH22 ARG 50 1HH1 ARG 50 -0.329 -3.737 0.212 785 H SER 51 HN SER 51 0.799 0.439 7.921 786 HA SER 51 HA SER 51 0.958 -1.178 10.219 787 HG SER 51 HG SER 51 -1.528 0.873 11.698 788 HB2 SER 51 2HB SER 51 0.246 1.195 10.265 789 HB3 SER 51 3HB SER 51 -1.241 0.768 9.403 790 H ASP 52 HN ASP 52 -1.484 -1.134 7.590 791 HA ASP 52 HA ASP 52 -3.273 -2.977 8.795 792 HB2 ASP 52 2HB ASP 52 -4.376 -3.037 6.763 793 HB3 ASP 52 3HB ASP 52 -3.625 -1.446 6.808 794 H GLN 53 HN GLN 53 -0.315 -3.508 6.868 795 HA GLN 53 HA GLN 53 -0.684 -6.363 6.479 796 HB2 GLN 53 2HB GLN 53 1.804 -4.620 6.548 797 HB3 GLN 53 3HB GLN 53 1.813 -6.328 6.129 798 HG2 GLN 53 2HG GLN 53 0.584 -5.966 4.121 799 HG3 GLN 53 3HG GLN 53 0.155 -4.315 4.577 800 HE21 GLN 53 1HE2 GLN 53 1.171 -4.215 2.161 801 HE22 GLN 53 2HE2 GLN 53 2.875 -3.772 2.213 802 H LEU 54 HN LEU 54 1.064 -4.335 8.896 803 HA LEU 54 HA LEU 54 1.932 -6.510 10.567 804 HG LEU 54 HG LEU 54 1.356 -4.763 13.330 805 HB2 LEU 54 2HB LEU 54 2.873 -4.259 10.738 806 HB3 LEU 54 3HB LEU 54 1.311 -3.589 11.179 807 HD11 LEU 54 1HD1 LEU 54 2.771 -6.760 12.665 808 HD12 LEU 54 2HD1 LEU 54 3.334 -5.941 14.125 809 HD13 LEU 54 3HD1 LEU 54 4.178 -5.686 12.601 810 HD21 LEU 54 3HD2 LEU 54 4.043 -3.430 12.946 811 HD22 LEU 54 1HD2 LEU 54 3.018 -3.420 14.375 812 HD23 LEU 54 2HD2 LEU 54 2.516 -2.492 12.945 813 H LYS 55 HN LYS 55 -1.068 -4.501 10.563 814 HA LYS 55 HA LYS 55 -2.249 -5.605 12.904 815 HB2 LYS 55 2HB LYS 55 -2.958 -3.516 11.755 816 HB3 LYS 55 3HB LYS 55 -3.645 -4.474 10.435 817 HG2 LYS 55 2HG LYS 55 -5.333 -5.411 11.900 818 HG3 LYS 55 3HG LYS 55 -4.500 -4.804 13.336 819 HD2 LYS 55 2HD LYS 55 -6.437 -3.410 12.897 820 HD3 LYS 55 3HD LYS 55 -4.957 -2.482 12.682 821 HE2 LYS 55 2HE LYS 55 -6.472 -1.867 10.927 822 HE3 LYS 55 3HE LYS 55 -5.157 -2.798 10.196 823 HZ1 LYS 55 3HZ LYS 55 -7.820 -3.843 10.913 824 HZ2 LYS 55 1HZ LYS 55 -6.614 -4.717 10.205 825 HZ3 LYS 55 2HZ LYS 55 -7.322 -3.467 9.391 826 H ARG 56 HN ARG 56 -2.544 -6.568 9.444 827 HA ARG 56 HA ARG 56 -4.297 -8.810 9.817 828 HE ARG 56 HE ARG 56 -1.927 -8.995 5.977 829 HB2 ARG 56 2HB ARG 56 -2.073 -8.163 7.861 830 HB3 ARG 56 3HB ARG 56 -2.898 -9.712 7.803 831 HG2 ARG 56 2HG ARG 56 -4.928 -8.789 7.114 832 HG3 ARG 56 3HG ARG 56 -4.501 -7.157 7.623 833 HD2 ARG 56 2HD ARG 56 -4.471 -7.759 5.065 834 HD3 ARG 56 3HD ARG 56 -3.211 -6.728 5.753 835 HH11 ARG 56 1HH1 ARG 56 -3.726 -8.072 3.024 836 HH12 ARG 56 2HH1 ARG 56 -2.594 -9.008 2.056 837 HH21 ARG 56 1HH2 ARG 56 -0.615 -10.032 4.640 838 HH22 ARG 56 2HH2 ARG 56 -0.843 -9.960 2.913 839 H HIS 57 HN HIS 57 -0.713 -8.526 9.921 840 HA HIS 57 HA HIS 57 -0.165 -11.238 10.475 841 HD1 HIS 57 1HD HIS 57 2.366 -12.372 10.076 842 HD2 HIS 57 2HD HIS 57 2.890 -9.572 13.148 843 HE1 HIS 57 1HE HIS 57 3.824 -13.499 11.812 844 HB2 HIS 57 2HB HIS 57 1.517 -9.590 9.761 845 HB3 HIS 57 3HB HIS 57 1.413 -8.765 11.316 846 H GLN 58 HN GLN 58 -0.965 -8.544 12.729 847 HA GLN 58 HA GLN 58 -0.410 -9.791 15.196 848 HB2 GLN 58 2HB GLN 58 -2.760 -7.941 14.519 849 HB3 GLN 58 3HB GLN 58 -2.288 -8.444 16.111 850 HG2 GLN 58 2HG GLN 58 -0.851 -6.504 14.341 851 HG3 GLN 58 3HG GLN 58 -1.377 -6.344 15.996 852 HE21 GLN 58 1HE2 GLN 58 1.104 -7.609 13.868 853 HE22 GLN 58 2HE2 GLN 58 2.278 -8.043 15.131 854 H ARG 59 HN ARG 59 -3.175 -10.304 12.974 855 HA ARG 59 HA ARG 59 -4.904 -11.712 14.761 856 HE ARG 59 HE ARG 59 -6.477 -10.585 15.304 857 HB2 ARG 59 2HB ARG 59 -4.512 -12.211 11.788 858 HB3 ARG 59 3HB ARG 59 -5.896 -12.687 12.742 859 HG2 ARG 59 2HG ARG 59 -5.109 -9.777 12.246 860 HG3 ARG 59 3HG ARG 59 -6.273 -10.691 11.305 861 HD2 ARG 59 2HD ARG 59 -7.523 -9.367 12.850 862 HD3 ARG 59 3HD ARG 59 -7.643 -11.054 13.348 863 HH11 ARG 59 1HH2 ARG 59 -6.208 -7.721 13.289 864 HH12 ARG 59 2HH2 ARG 59 -5.456 -6.805 14.575 865 HH21 ARG 59 1HH1 ARG 59 -5.342 -9.472 16.753 866 HH22 ARG 59 2HH1 ARG 59 -5.070 -7.744 16.549 867 H ARG 60 HN ARG 60 -1.981 -12.761 13.037 868 HA ARG 60 HA ARG 60 -2.424 -15.607 13.350 869 HE ARG 60 HE ARG 60 -1.105 -12.586 9.448 870 HB2 ARG 60 2HB ARG 60 0.319 -14.322 13.251 871 HB3 ARG 60 3HB ARG 60 -0.188 -15.889 12.672 872 HG2 ARG 60 2HG ARG 60 -0.078 -13.309 11.308 873 HG3 ARG 60 3HG ARG 60 0.078 -14.910 10.693 874 HD2 ARG 60 2HD ARG 60 -2.334 -15.104 10.422 875 HD3 ARG 60 3HD ARG 60 -2.661 -13.659 11.277 876 HH11 ARG 60 1HH2 ARG 60 -3.991 -14.574 9.066 877 HH12 ARG 60 2HH2 ARG 60 -4.404 -13.772 7.568 878 HH21 ARG 60 1HH1 ARG 60 -1.526 -11.905 7.470 879 HH22 ARG 60 2HH1 ARG 60 -3.006 -12.371 6.651 880 H HIS 61 HN HIS 61 -1.122 -13.051 15.435 881 HA HIS 61 HA HIS 61 -0.175 -15.038 17.446 882 HD1 HIS 61 1HD HIS 61 2.679 -14.673 18.188 883 HD2 HIS 61 2HD HIS 61 1.969 -11.454 15.572 884 HE1 HIS 61 1HE HIS 61 4.923 -14.066 17.112 885 HB2 HIS 61 2HB HIS 61 0.045 -12.011 17.228 886 HB3 HIS 61 3HB HIS 61 0.576 -12.917 18.630 887 H THR 62 HN THR 62 -3.096 -13.479 16.689 888 HA THR 62 HA THR 62 -3.947 -13.350 19.578 889 HB THR 62 HB THR 62 -5.258 -11.307 18.990 890 HG1 THR 62 1HG THR 62 -3.696 -11.303 16.642 891 HG21 THR 62 3HG2 THR 62 -3.000 -10.955 19.908 892 HG22 THR 62 1HG2 THR 62 -3.414 -9.707 18.723 893 HG23 THR 62 2HG2 THR 62 -2.293 -11.010 18.290 894 H GLY 63 HN GLY 63 -4.581 -14.762 16.568 895 HA2 GLY 63 2HA GLY 63 -6.397 -15.893 15.704 896 HA3 GLY 63 3HA GLY 63 -7.140 -15.824 17.314 897 H VAL 64 HN VAL 64 -8.830 -14.479 17.670 898 HA VAL 64 HA VAL 64 -10.503 -12.927 17.326 899 HB VAL 64 HB VAL 64 -8.654 -11.491 15.341 900 HG11 VAL 64 1HG1 VAL 64 -10.890 -10.496 17.141 901 HG12 VAL 64 2HG1 VAL 64 -9.915 -9.525 16.017 902 HG13 VAL 64 3HG1 VAL 64 -11.026 -10.747 15.392 903 HG21 VAL 64 3HG2 VAL 64 -7.363 -11.701 17.393 904 HG22 VAL 64 1HG2 VAL 64 -8.014 -10.068 17.310 905 HG23 VAL 64 2HG2 VAL 64 -8.774 -11.267 18.380 906 H LYS 65 HN LYS 65 -8.977 -13.171 14.036 907 HA LYS 65 HA LYS 65 -9.991 -13.240 11.946 908 HB2 LYS 65 2HB LYS 65 -11.704 -15.367 13.319 909 HB3 LYS 65 3HB LYS 65 -11.576 -15.097 11.575 910 HG2 LYS 65 2HG LYS 65 -9.024 -15.426 11.891 911 HG3 LYS 65 3HG LYS 65 -9.434 -16.113 13.467 912 HD2 LYS 65 2HD LYS 65 -10.436 -17.076 10.748 913 HD3 LYS 65 3HD LYS 65 -9.157 -17.838 11.696 914 HE2 LYS 65 2HE LYS 65 -10.716 -18.440 13.461 915 HE3 LYS 65 3HE LYS 65 -12.013 -17.505 12.696 916 HZ1 LYS 65 3HZ LYS 65 -11.949 -18.969 10.836 917 HZ2 LYS 65 1HZ LYS 65 -12.192 -19.849 12.212 918 HZ3 LYS 65 2HZ LYS 65 -10.711 -19.853 11.486 919 HA PRO 66 HA PRO 66 -13.345 -10.481 13.583 920 HB2 PRO 66 2HB PRO 66 -12.672 -8.187 12.177 921 HB3 PRO 66 3HB PRO 66 -11.884 -8.707 13.691 922 HG2 PRO 66 2HG PRO 66 -10.934 -9.172 10.851 923 HG3 PRO 66 3HG PRO 66 -9.998 -8.537 12.245 924 HD2 PRO 66 2HD PRO 66 -9.860 -11.132 11.543 925 HD3 PRO 66 3HD PRO 66 -9.911 -10.670 13.272 926 H PHE 67 HN PHE 67 -12.561 -11.467 10.298 927 HA PHE 67 HA PHE 67 -15.047 -10.268 9.163 928 HD1 PHE 67 2HD PHE 67 -14.334 -8.927 6.687 929 HD2 PHE 67 1HD PHE 67 -10.994 -10.890 8.559 930 HE1 PHE 67 2HE PHE 67 -12.959 -6.886 6.382 931 HE2 PHE 67 1HE PHE 67 -9.600 -8.863 8.208 932 HZ PHE 67 HZ PHE 67 -10.585 -6.857 7.119 933 HB2 PHE 67 2HB PHE 67 -13.005 -12.175 7.918 934 HB3 PHE 67 3HB PHE 67 -14.292 -11.358 7.078 935 H GLN 68 HN GLN 68 -16.955 -11.404 8.815 936 HA GLN 68 HA GLN 68 -16.965 -14.310 9.558 937 HB2 GLN 68 2HB GLN 68 -17.864 -12.884 11.441 938 HB3 GLN 68 3HB GLN 68 -19.163 -12.339 10.373 939 HG2 GLN 68 2HG GLN 68 -19.988 -14.647 10.164 940 HG3 GLN 68 3HG GLN 68 -18.600 -15.262 11.071 941 HE21 GLN 68 1HE2 GLN 68 -21.935 -14.687 11.487 942 HE22 GLN 68 2HE2 GLN 68 -21.760 -14.291 13.199 943 H CYS 69 HN CYS 69 -18.117 -15.610 8.197 944 HA CYS 69 HA CYS 69 -19.129 -14.615 5.705 945 HB2 CYS 69 2HB CYS 69 -18.386 -16.962 5.993 946 HB3 CYS 69 3HB CYS 69 -19.712 -17.249 7.131 947 H LYS 70 HN LYS 70 -21.333 -14.626 4.930 948 HA LYS 70 HA LYS 70 -23.213 -13.602 7.027 949 HB2 LYS 70 2HB LYS 70 -23.578 -13.412 4.013 950 HB3 LYS 70 3HB LYS 70 -24.411 -12.504 5.275 951 HG2 LYS 70 2HG LYS 70 -21.541 -12.200 4.319 952 HG3 LYS 70 3HG LYS 70 -22.847 -11.030 4.186 953 HD2 LYS 70 2HD LYS 70 -22.796 -10.604 6.602 954 HD3 LYS 70 3HD LYS 70 -21.631 -11.915 6.848 955 HE2 LYS 70 2HE LYS 70 -20.099 -10.687 5.199 956 HE3 LYS 70 3HE LYS 70 -21.160 -9.284 5.435 957 HZ1 LYS 70 3HZ LYS 70 -20.705 -9.506 7.822 958 HZ2 LYS 70 1HZ LYS 70 -19.314 -9.261 6.966 959 HZ3 LYS 70 2HZ LYS 70 -19.688 -10.772 7.514 960 H THR 71 HN THR 71 -22.344 -16.437 5.612 961 HA THR 71 HA THR 71 -25.154 -17.444 5.345 962 HB THR 71 HB THR 71 -23.098 -19.139 4.071 963 HG1 THR 71 1HG THR 71 -21.994 -17.267 3.704 964 HG21 THR 71 3HG2 THR 71 -24.501 -18.939 2.128 965 HG22 THR 71 1HG2 THR 71 -25.431 -17.633 2.892 966 HG23 THR 71 2HG2 THR 71 -25.490 -19.282 3.564 967 H CYS 72 HN CYS 72 -21.949 -19.090 5.665 968 HA CYS 72 HA CYS 72 -23.138 -20.946 7.635 969 HB2 CYS 72 2HB CYS 72 -20.955 -22.120 7.391 970 HB3 CYS 72 3HB CYS 72 -21.745 -21.841 5.822 971 H GLN 73 HN GLN 73 -21.748 -17.917 7.840 972 HA GLN 73 HA GLN 73 -20.861 -16.678 9.560 973 HB2 GLN 73 2HB GLN 73 -21.505 -18.969 11.470 974 HB3 GLN 73 3HB GLN 73 -21.395 -17.256 11.805 975 HG2 GLN 73 2HG GLN 73 -23.599 -18.693 10.282 976 HG3 GLN 73 3HG GLN 73 -23.710 -17.852 11.823 977 HE21 GLN 73 1HE2 GLN 73 -24.556 -17.520 8.582 978 HE22 GLN 73 2HE2 GLN 73 -24.529 -15.749 8.579 979 H ARG 74 HN ARG 74 -19.165 -18.736 8.083 980 HA ARG 74 HA ARG 74 -17.105 -19.619 9.939 981 HE ARG 74 HE ARG 74 -14.688 -23.299 8.136 982 HB2 ARG 74 2HB ARG 74 -17.375 -19.417 6.924 983 HB3 ARG 74 3HB ARG 74 -15.788 -19.503 7.637 984 HG2 ARG 74 2HG ARG 74 -16.712 -21.587 8.969 985 HG3 ARG 74 3HG ARG 74 -17.923 -21.617 7.697 986 HD2 ARG 74 2HD ARG 74 -16.378 -22.891 6.627 987 HD3 ARG 74 3HD ARG 74 -15.677 -21.348 6.152 988 HH11 ARG 74 1HH1 ARG 74 -14.072 -20.018 6.940 989 HH12 ARG 74 2HH1 ARG 74 -12.518 -19.961 7.729 990 HH21 ARG 74 1HH2 ARG 74 -12.727 -23.121 9.078 991 HH22 ARG 74 2HH2 ARG 74 -11.795 -21.656 8.887 992 H LYS 75 HN LYS 75 -15.604 -18.416 10.893 993 HA LYS 75 HA LYS 75 -15.349 -15.623 10.111 994 HB2 LYS 75 2HB LYS 75 -14.359 -17.306 12.444 995 HB3 LYS 75 3HB LYS 75 -13.698 -15.692 12.113 996 HG2 LYS 75 2HG LYS 75 -16.011 -14.772 12.029 997 HG3 LYS 75 3HG LYS 75 -16.631 -16.319 12.606 998 HD2 LYS 75 2HD LYS 75 -15.702 -16.053 14.738 999 HD3 LYS 75 3HD LYS 75 -14.425 -14.965 14.186 1000 HE2 LYS 75 2HE LYS 75 -17.375 -14.203 14.285 1001 HE3 LYS 75 3HE LYS 75 -16.184 -13.830 15.544 1002 HZ1 LYS 75 3HZ LYS 75 -16.355 -11.972 14.108 1003 HZ2 LYS 75 1HZ LYS 75 -16.125 -12.890 12.760 1004 HZ3 LYS 75 2HZ LYS 75 -14.887 -12.686 13.805 1005 H PHE 76 HN PHE 76 -13.590 -14.579 9.336 1006 HA PHE 76 HA PHE 76 -11.166 -16.192 8.657 1007 HD1 PHE 76 1HD PHE 76 -10.991 -17.389 5.863 1008 HD2 PHE 76 2HD PHE 76 -14.733 -15.370 6.636 1009 HE1 PHE 76 1HE PHE 76 -12.230 -19.259 4.808 1010 HE2 PHE 76 2HE PHE 76 -15.960 -17.268 5.640 1011 HZ PHE 76 HZ PHE 76 -14.712 -19.227 4.738 1012 HB2 PHE 76 2HB PHE 76 -12.571 -14.186 6.832 1013 HB3 PHE 76 3HB PHE 76 -11.059 -14.995 6.480 1014 H SER 77 HN SER 77 -9.246 -14.827 8.258 1015 HA SER 77 HA SER 77 -9.255 -12.525 10.131 1016 HG SER 77 HG SER 77 -6.270 -15.017 8.976 1017 HB2 SER 77 2HB SER 77 -6.741 -12.835 10.003 1018 HB3 SER 77 3HB SER 77 -7.617 -14.273 10.571 1019 H ARG 78 HN ARG 78 -9.442 -13.045 6.773 1020 HA ARG 78 HA ARG 78 -8.573 -10.239 6.281 1021 HE ARG 78 HE ARG 78 -5.063 -13.534 4.386 1022 HB2 ARG 78 2HB ARG 78 -7.739 -12.646 4.576 1023 HB3 ARG 78 3HB ARG 78 -7.522 -10.938 4.154 1024 HG2 ARG 78 2HG ARG 78 -6.265 -10.740 6.421 1025 HG3 ARG 78 3HG ARG 78 -6.140 -12.499 6.363 1026 HD2 ARG 78 2HD ARG 78 -5.218 -10.617 4.152 1027 HD3 ARG 78 3HD ARG 78 -4.173 -11.137 5.472 1028 HH11 ARG 78 1HH1 ARG 78 -3.668 -10.681 2.805 1029 HH12 ARG 78 2HH1 ARG 78 -2.950 -11.678 1.556 1030 HH21 ARG 78 1HH2 ARG 78 -3.989 -14.668 2.768 1031 HH22 ARG 78 2HH2 ARG 78 -3.204 -13.753 1.478 1032 H SER 79 HN SER 79 -9.751 -9.141 4.751 1033 HA SER 79 HA SER 79 -12.404 -10.061 4.147 1034 HG SER 79 HG SER 79 -10.549 -6.661 2.927 1035 HB2 SER 79 2HB SER 79 -12.435 -8.029 2.640 1036 HB3 SER 79 3HB SER 79 -11.978 -7.694 4.315 1037 H ASP 80 HN ASP 80 -9.348 -9.965 2.293 1038 HA ASP 80 HA ASP 80 -10.373 -10.727 -0.217 1039 HB2 ASP 80 2HB ASP 80 -8.043 -11.610 -0.640 1040 HB3 ASP 80 3HB ASP 80 -8.206 -9.950 -0.068 1041 H HIS 81 HN HIS 81 -9.282 -12.875 2.525 1042 HA HIS 81 HA HIS 81 -9.945 -15.375 1.270 1043 HD1 HIS 81 1HD HIS 81 -7.593 -15.634 1.438 1044 HD2 HIS 81 2HD HIS 81 -7.933 -15.681 5.629 1045 HE1 HIS 81 1HE HIS 81 -5.351 -16.149 2.297 1046 HB2 HIS 81 2HB HIS 81 -9.932 -14.525 4.207 1047 HB3 HIS 81 3HB HIS 81 -10.204 -16.167 3.662 1048 H LEU 82 HN LEU 82 -11.864 -13.172 3.410 1049 HA LEU 82 HA LEU 82 -14.153 -14.843 3.566 1050 HG LEU 82 HG LEU 82 -16.186 -13.779 4.161 1051 HB2 LEU 82 2HB LEU 82 -13.744 -12.919 5.023 1052 HB3 LEU 82 3HB LEU 82 -13.978 -11.788 3.692 1053 HD11 LEU 82 1HD1 LEU 82 -15.544 -13.058 6.477 1054 HD12 LEU 82 2HD1 LEU 82 -17.170 -12.673 5.925 1055 HD13 LEU 82 3HD1 LEU 82 -16.005 -11.371 5.969 1056 HD21 LEU 82 3HD2 LEU 82 -17.638 -11.831 3.718 1057 HD22 LEU 82 1HD2 LEU 82 -16.466 -12.001 2.421 1058 HD23 LEU 82 2HD2 LEU 82 -16.221 -10.759 3.661 1059 H LYS 83 HN LYS 83 -13.386 -12.188 1.246 1060 HA LYS 83 HA LYS 83 -15.824 -12.427 -0.289 1061 HB2 LYS 83 2HB LYS 83 -14.282 -10.466 -0.313 1062 HB3 LYS 83 3HB LYS 83 -13.059 -11.447 -1.136 1063 HG2 LYS 83 2HG LYS 83 -14.466 -11.645 -3.115 1064 HG3 LYS 83 3HG LYS 83 -15.844 -10.945 -2.260 1065 HD2 LYS 83 2HD LYS 83 -14.932 -9.323 -3.773 1066 HD3 LYS 83 3HD LYS 83 -14.683 -8.760 -2.125 1067 HE2 LYS 83 2HE LYS 83 -12.518 -10.216 -3.705 1068 HE3 LYS 83 3HE LYS 83 -12.776 -8.477 -3.852 1069 HZ1 LYS 83 3HZ LYS 83 -12.177 -9.847 -1.319 1070 HZ2 LYS 83 1HZ LYS 83 -12.377 -8.229 -1.521 1071 HZ3 LYS 83 2HZ LYS 83 -11.094 -8.995 -2.223 1072 H THR 84 HN THR 84 -12.635 -14.042 -0.428 1073 HA THR 84 HA THR 84 -13.067 -15.443 -2.902 1074 HB THR 84 HB THR 84 -11.353 -16.018 -0.473 1075 HG1 THR 84 1HG THR 84 -10.659 -14.308 -1.453 1076 HG21 THR 84 3HG2 THR 84 -9.980 -17.491 -1.726 1077 HG22 THR 84 1HG2 THR 84 -11.144 -17.486 -3.095 1078 HG23 THR 84 2HG2 THR 84 -11.583 -18.195 -1.516 1079 H HIS 85 HN HIS 85 -13.537 -16.408 0.523 1080 HA HIS 85 HA HIS 85 -14.726 -18.942 0.009 1081 HD1 HIS 85 1HD HIS 85 -15.869 -20.716 1.963 1082 HD2 HIS 85 2HD HIS 85 -17.134 -16.980 3.478 1083 HE1 HIS 85 1HE HIS 85 -18.245 -21.040 2.914 1084 HB2 HIS 85 2HB HIS 85 -13.979 -18.491 2.216 1085 HB3 HIS 85 3HB HIS 85 -14.852 -16.962 2.301 1086 H THR 86 HN THR 86 -16.089 -15.649 0.253 1087 HA THR 86 HA THR 86 -18.836 -16.240 0.189 1088 HB THR 86 HB THR 86 -17.369 -13.939 -1.174 1089 HG1 THR 86 1HG THR 86 -17.046 -14.120 1.093 1090 HG21 THR 86 3HG2 THR 86 -19.637 -13.954 -2.031 1091 HG22 THR 86 1HG2 THR 86 -19.358 -12.634 -0.888 1092 HG23 THR 86 2HG2 THR 86 -20.272 -14.075 -0.364 1093 H ARG 87 HN ARG 87 -16.440 -16.159 -2.513 1094 HA ARG 87 HA ARG 87 -18.396 -16.279 -4.639 1095 HE ARG 87 HE ARG 87 -13.420 -16.128 -6.710 1096 HB2 ARG 87 2HB ARG 87 -15.439 -17.064 -4.540 1097 HB3 ARG 87 3HB ARG 87 -16.437 -17.176 -5.977 1098 HG2 ARG 87 2HG ARG 87 -17.071 -14.716 -5.625 1099 HG3 ARG 87 3HG ARG 87 -15.776 -14.641 -4.446 1100 HD2 ARG 87 2HD ARG 87 -15.484 -15.368 -7.388 1101 HD3 ARG 87 3HD ARG 87 -15.116 -13.797 -6.677 1102 HH11 ARG 87 2HH1 ARG 87 -14.000 -13.259 -4.750 1103 HH12 ARG 87 1HH1 ARG 87 -12.380 -13.353 -4.061 1104 HH21 ARG 87 1HH2 ARG 87 -11.539 -16.167 -5.857 1105 HH22 ARG 87 2HH2 ARG 87 -11.048 -15.071 -4.545 1106 H THR 88 HN THR 88 -17.135 -18.720 -2.414 1107 HA THR 88 HA THR 88 -17.861 -21.056 -3.981 1108 HB THR 88 HB THR 88 -17.638 -22.318 -1.986 1109 HG1 THR 88 1HG THR 88 -17.648 -19.934 -0.458 1110 HG21 THR 88 3HG2 THR 88 -15.597 -20.076 -1.739 1111 HG22 THR 88 1HG2 THR 88 -15.463 -21.540 -2.721 1112 HG23 THR 88 2HG2 THR 88 -15.516 -21.668 -0.954 1113 H HIS 89 HN HIS 89 -19.622 -18.914 -1.702 1114 HA HIS 89 HA HIS 89 -22.060 -20.596 -1.785 1115 HD1 HIS 89 1HD HIS 89 -22.815 -21.368 0.462 1116 HD2 HIS 89 2HD HIS 89 -20.500 -18.137 1.852 1117 HE1 HIS 89 1HE HIS 89 -22.070 -21.948 2.853 1118 HB2 HIS 89 2HB HIS 89 -21.413 -17.866 -0.586 1119 HB3 HIS 89 3HB HIS 89 -23.035 -18.538 -0.598 1120 H THR 90 HN THR 90 -20.603 -17.913 -3.492 1121 HA THR 90 HA THR 90 -23.116 -17.085 -4.767 1122 HB THR 90 HB THR 90 -20.295 -16.202 -5.475 1123 HG1 THR 90 1HG THR 90 -20.611 -15.969 -3.205 1124 HG21 THR 90 3HG2 THR 90 -22.934 -14.700 -5.583 1125 HG22 THR 90 1HG2 THR 90 -21.969 -15.231 -6.980 1126 HG23 THR 90 2HG2 THR 90 -21.332 -13.998 -5.893 1127 H GLY 91 HN GLY 91 -20.912 -19.597 -5.330 1128 HA2 GLY 91 2HA GLY 91 -20.468 -20.965 -7.146 1129 HA3 GLY 91 3HA GLY 91 -21.974 -20.361 -7.864 1130 H GLU 92 HN GLU 92 -19.426 -18.081 -7.037 1131 HA GLU 92 HA GLU 92 -19.372 -17.220 -9.838 1132 HB2 GLU 92 2HB GLU 92 -19.556 -15.667 -7.868 1133 HB3 GLU 92 3HB GLU 92 -17.904 -16.063 -7.419 1134 HG2 GLU 92 2HG GLU 92 -17.130 -15.196 -9.645 1135 HG3 GLU 92 3HG GLU 92 -18.804 -14.818 -10.060 1136 H LYS 93 HN LYS 93 -18.193 -18.642 -11.079 1137 HA LYS 93 HA LYS 93 -15.295 -18.930 -10.366 1138 HB2 LYS 93 2HB LYS 93 -17.150 -20.925 -11.735 1139 HB3 LYS 93 3HB LYS 93 -15.390 -21.091 -11.682 1140 HG2 LYS 93 2HG LYS 93 -15.412 -21.179 -9.252 1141 HG3 LYS 93 3HG LYS 93 -17.166 -20.920 -9.209 1142 HD2 LYS 93 2HD LYS 93 -17.484 -23.058 -10.440 1143 HD3 LYS 93 3HD LYS 93 -15.738 -23.340 -10.394 1144 HE2 LYS 93 2HE LYS 93 -17.530 -23.002 -7.947 1145 HE3 LYS 93 3HE LYS 93 -17.000 -24.556 -8.605 1146 HZ1 LYS 93 3HZ LYS 93 -15.222 -22.457 -7.548 1147 HZ2 LYS 93 1HZ LYS 93 -14.727 -23.898 -8.177 1148 HZ3 LYS 93 2HZ LYS 93 -15.604 -23.860 -6.785 1149 HA PRO 94 HA PRO 94 -15.641 -16.778 -14.401 1150 HB2 PRO 94 2HB PRO 94 -14.051 -14.623 -13.920 1151 HB3 PRO 94 3HB PRO 94 -15.689 -14.762 -13.213 1152 HG2 PRO 94 2HG PRO 94 -13.030 -15.386 -11.891 1153 HG3 PRO 94 3HG PRO 94 -14.399 -14.438 -11.235 1154 HD2 PRO 94 2HD PRO 94 -13.962 -17.112 -10.706 1155 HD3 PRO 94 3HD PRO 94 -15.585 -16.364 -10.685 1156 H PHE 95 HN PHE 95 -12.775 -17.843 -12.556 1157 HA PHE 95 HA PHE 95 -10.843 -17.262 -14.683 1158 HD1 PHE 95 2HD PHE 95 -8.512 -16.251 -13.445 1159 HD2 PHE 95 1HD PHE 95 -11.358 -17.607 -10.522 1160 HE1 PHE 95 2HE PHE 95 -8.054 -14.231 -12.071 1161 HE2 PHE 95 1HE PHE 95 -10.919 -15.571 -9.151 1162 HZ PHE 95 HZ PHE 95 -9.260 -13.892 -9.923 1163 HB2 PHE 95 2HB PHE 95 -10.625 -19.087 -12.245 1164 HB3 PHE 95 3HB PHE 95 -9.313 -18.620 -13.304 1165 H SER 96 HN SER 96 -11.887 -18.248 -16.522 1166 HA SER 96 HA SER 96 -12.250 -21.173 -16.535 1167 HG SER 96 HG SER 96 -13.842 -18.637 -17.023 1168 HB2 SER 96 2HB SER 96 -12.482 -19.198 -18.843 1169 HB3 SER 96 3HB SER 96 -13.178 -20.827 -18.741 1170 H CYS 97 HN CYS 97 -10.988 -22.673 -17.533 1171 HA CYS 97 HA CYS 97 -8.272 -22.010 -18.155 1172 HB2 CYS 97 2HB CYS 97 -9.143 -24.234 -17.278 1173 HB3 CYS 97 3HB CYS 97 -9.776 -24.537 -18.899 1174 H ARG 98 HN ARG 98 -7.248 -21.602 -20.020 1175 HA ARG 98 HA ARG 98 -8.983 -21.157 -22.393 1176 HE ARG 98 HE ARG 98 -10.034 -19.824 -20.391 1177 HB2 ARG 98 2HB ARG 98 -6.194 -20.108 -21.759 1178 HB3 ARG 98 3HB ARG 98 -7.200 -19.613 -23.117 1179 HG2 ARG 98 2HG ARG 98 -7.814 -19.076 -20.170 1180 HG3 ARG 98 3HG ARG 98 -7.131 -17.946 -21.325 1181 HD2 ARG 98 2HD ARG 98 -9.393 -17.346 -21.174 1182 HD3 ARG 98 3HD ARG 98 -9.241 -18.200 -22.720 1183 HH11 ARG 98 1HH1 ARG 98 -11.410 -17.930 -23.036 1184 HH12 ARG 98 2HH1 ARG 98 -12.830 -18.963 -23.102 1185 HH21 ARG 98 1HH2 ARG 98 -11.654 -21.206 -20.838 1186 HH22 ARG 98 2HH2 ARG 98 -13.009 -20.739 -21.853 1187 H TRP 99 HN TRP 99 -7.335 -23.715 -21.373 1188 HA TRP 99 HA TRP 99 -5.398 -24.235 -23.433 1189 HD1 TRP 99 1HD TRP 99 -5.216 -23.877 -20.204 1190 HE1 TRP 99 1HE TRP 99 -2.825 -24.129 -19.332 1191 HE3 TRP 99 3HE TRP 99 -3.870 -28.062 -22.811 1192 HZ2 TRP 99 2HZ TRP 99 -0.574 -25.889 -19.770 1193 HZ3 TRP 99 3HZ TRP 99 -1.583 -29.001 -22.574 1194 HH2 TRP 99 2HH TRP 99 0.072 -27.918 -21.075 1195 HB2 TRP 99 2HB TRP 99 -6.884 -25.900 -21.394 1196 HB3 TRP 99 3HB TRP 99 -6.012 -26.713 -22.678 1197 HA PRO 100 HA PRO 100 -7.904 -25.139 -26.894 1198 HB2 PRO 100 2HB PRO 100 -6.346 -26.917 -28.327 1199 HB3 PRO 100 3HB PRO 100 -5.902 -25.212 -28.058 1200 HG2 PRO 100 2HG PRO 100 -4.993 -27.630 -26.462 1201 HG3 PRO 100 3HG PRO 100 -3.978 -26.346 -27.197 1202 HD2 PRO 100 2HD PRO 100 -4.691 -26.246 -24.588 1203 HD3 PRO 100 3HD PRO 100 -4.667 -24.753 -25.579 1204 H SER 101 HN SER 101 -7.836 -27.257 -24.406 1205 HA SER 101 HA SER 101 -9.784 -29.078 -25.700 1206 HG SER 101 HG SER 101 -9.461 -31.103 -23.914 1207 HB2 SER 101 2HB SER 101 -7.621 -30.268 -25.878 1208 HB3 SER 101 3HB SER 101 -7.351 -30.052 -24.135 1209 H CYS 102 HN CYS 102 -9.596 -26.809 -23.550 1210 HA CYS 102 HA CYS 102 -11.270 -28.212 -21.545 1211 HB2 CYS 102 2HB CYS 102 -8.946 -28.318 -20.669 1212 HB3 CYS 102 3HB CYS 102 -8.830 -26.552 -20.801 1213 H GLN 103 HN GLN 103 -12.481 -26.766 -20.195 1214 HA GLN 103 HA GLN 103 -12.359 -23.885 -20.702 1215 HB2 GLN 103 2HB GLN 103 -14.851 -25.513 -21.384 1216 HB3 GLN 103 3HB GLN 103 -14.914 -23.788 -21.057 1217 HG2 GLN 103 2HG GLN 103 -13.409 -25.027 -23.377 1218 HG3 GLN 103 3HG GLN 103 -14.977 -24.244 -23.432 1219 HE21 GLN 103 1HE2 GLN 103 -11.515 -23.678 -23.209 1220 HE22 GLN 103 2HE2 GLN 103 -11.642 -21.917 -23.381 1221 H LYS 104 HN LYS 104 -11.926 -25.940 -18.507 1222 HA LYS 104 HA LYS 104 -14.187 -25.864 -16.679 1223 HB2 LYS 104 2HB LYS 104 -11.243 -26.597 -16.339 1224 HB3 LYS 104 3HB LYS 104 -12.421 -26.682 -15.023 1225 HG2 LYS 104 2HG LYS 104 -13.859 -28.189 -16.377 1226 HG3 LYS 104 3HG LYS 104 -12.654 -28.211 -17.662 1227 HD2 LYS 104 2HD LYS 104 -12.181 -29.134 -14.794 1228 HD3 LYS 104 3HD LYS 104 -12.599 -30.211 -16.127 1229 HE2 LYS 104 2HE LYS 104 -10.130 -28.431 -16.134 1230 HE3 LYS 104 3HE LYS 104 -10.142 -30.096 -15.513 1231 HZ1 LYS 104 3HZ LYS 104 -10.913 -30.763 -17.760 1232 HZ2 LYS 104 1HZ LYS 104 -9.403 -30.074 -17.748 1233 HZ3 LYS 104 2HZ LYS 104 -10.665 -29.192 -18.250 1234 H LYS 105 HN LYS 105 -14.499 -24.623 -14.846 1235 HA LYS 105 HA LYS 105 -12.978 -22.060 -14.910 1236 HB2 LYS 105 2HB LYS 105 -15.877 -22.394 -14.034 1237 HB3 LYS 105 3HB LYS 105 -14.974 -20.927 -14.474 1238 HG2 LYS 105 2HG LYS 105 -14.711 -21.933 -16.796 1239 HG3 LYS 105 3HG LYS 105 -15.918 -23.140 -16.328 1240 HD2 LYS 105 2HD LYS 105 -17.542 -21.304 -15.854 1241 HD3 LYS 105 3HD LYS 105 -16.349 -20.126 -16.407 1242 HE2 LYS 105 2HE LYS 105 -17.648 -22.344 -18.049 1243 HE3 LYS 105 3HE LYS 105 -17.900 -20.598 -18.217 1244 HZ1 LYS 105 3HZ LYS 105 -15.502 -20.468 -18.773 1245 HZ2 LYS 105 1HZ LYS 105 -16.402 -21.299 -19.890 1246 HZ3 LYS 105 2HZ LYS 105 -15.449 -22.113 -18.818 1247 H PHE 106 HN PHE 106 -12.279 -21.111 -13.106 1248 HA PHE 106 HA PHE 106 -12.880 -22.483 -10.498 1249 HD1 PHE 106 1HD PHE 106 -10.805 -24.473 -9.775 1250 HD2 PHE 106 2HD PHE 106 -9.901 -22.362 -13.424 1251 HE1 PHE 106 1HE PHE 106 -10.296 -26.621 -10.911 1252 HE2 PHE 106 2HE PHE 106 -9.443 -24.508 -14.563 1253 HZ PHE 106 HZ PHE 106 -9.655 -26.645 -13.309 1254 HB2 PHE 106 2HB PHE 106 -10.266 -21.136 -11.323 1255 HB3 PHE 106 3HB PHE 106 -10.594 -21.982 -9.816 1256 H ALA 107 HN ALA 107 -12.609 -21.074 -8.566 1257 HA ALA 107 HA ALA 107 -13.665 -18.373 -9.189 1258 HB1 ALA 107 1HB ALA 107 -13.554 -19.967 -6.575 1259 HB2 ALA 107 2HB ALA 107 -14.330 -18.384 -6.788 1260 HB3 ALA 107 3HB ALA 107 -14.977 -19.790 -7.626 1261 H ARG 108 HN ARG 108 -10.661 -19.718 -8.715 1262 HA ARG 108 HA ARG 108 -9.630 -17.148 -7.614 1263 HE ARG 108 HE ARG 108 -7.399 -19.855 -4.798 1264 HB2 ARG 108 2HB ARG 108 -8.737 -19.926 -6.789 1265 HB3 ARG 108 3HB ARG 108 -7.946 -18.399 -6.359 1266 HG2 ARG 108 2HG ARG 108 -9.586 -17.737 -4.891 1267 HG3 ARG 108 3HG ARG 108 -10.830 -18.785 -5.584 1268 HD2 ARG 108 2HD ARG 108 -10.037 -19.572 -3.398 1269 HD3 ARG 108 3HD ARG 108 -9.879 -20.754 -4.686 1270 HH11 ARG 108 2HH1 ARG 108 -9.213 -20.184 -1.823 1271 HH12 ARG 108 1HH1 ARG 108 -7.839 -20.844 -0.957 1272 HH21 ARG 108 1HH2 ARG 108 -5.673 -20.653 -3.664 1273 HH22 ARG 108 2HH2 ARG 108 -5.874 -21.058 -1.965 1274 H SER 109 HN SER 109 -7.735 -16.435 -8.473 1275 HA SER 109 HA SER 109 -7.070 -17.251 -11.098 1276 HG SER 109 HG SER 109 -5.743 -14.587 -8.533 1277 HB2 SER 109 2HB SER 109 -5.060 -15.751 -10.749 1278 HB3 SER 109 3HB SER 109 -6.608 -14.994 -10.359 1279 H ASP 110 HN ASP 110 -5.581 -18.029 -7.924 1280 HA ASP 110 HA ASP 110 -3.273 -19.438 -9.074 1281 HB2 ASP 110 2HB ASP 110 -2.790 -20.069 -6.829 1282 HB3 ASP 110 3HB ASP 110 -3.323 -18.399 -6.773 1283 H GLU 111 HN GLU 111 -6.624 -20.340 -8.058 1284 HA GLU 111 HA GLU 111 -6.253 -23.201 -8.151 1285 HB2 GLU 111 2HB GLU 111 -8.655 -21.378 -8.492 1286 HB3 GLU 111 3HB GLU 111 -8.757 -23.086 -8.876 1287 HG2 GLU 111 2HG GLU 111 -8.036 -23.708 -6.634 1288 HG3 GLU 111 3HG GLU 111 -7.983 -22.009 -6.158 1289 H LEU 112 HN LEU 112 -7.078 -20.719 -10.627 1290 HA LEU 112 HA LEU 112 -7.186 -22.602 -12.827 1291 HG LEU 112 HG LEU 112 -5.826 -20.562 -14.881 1292 HB2 LEU 112 2HB LEU 112 -8.214 -20.432 -12.986 1293 HB3 LEU 112 3HB LEU 112 -6.679 -19.594 -12.746 1294 HD11 LEU 112 1HD1 LEU 112 -7.236 -22.606 -15.025 1295 HD12 LEU 112 2HD1 LEU 112 -7.375 -21.583 -16.435 1296 HD13 LEU 112 3HD1 LEU 112 -8.686 -21.585 -15.249 1297 HD21 LEU 112 3HD2 LEU 112 -7.036 -19.159 -16.379 1298 HD22 LEU 112 1HD2 LEU 112 -6.944 -18.329 -14.816 1299 HD23 LEU 112 2HD2 LEU 112 -8.455 -19.126 -15.326 1300 H VAL 113 HN VAL 113 -4.545 -20.482 -11.494 1301 HA VAL 113 HA VAL 113 -2.553 -21.146 -13.422 1302 HB VAL 113 HB VAL 113 -1.042 -20.274 -12.028 1303 HG11 VAL 113 1HG1 VAL 113 -2.809 -18.452 -10.760 1304 HG12 VAL 113 2HG1 VAL 113 -1.441 -18.247 -11.816 1305 HG13 VAL 113 3HG1 VAL 113 -2.997 -18.711 -12.506 1306 HG21 VAL 113 3HG2 VAL 113 -1.974 -21.027 -9.406 1307 HG22 VAL 113 1HG2 VAL 113 -0.569 -21.511 -10.322 1308 HG23 VAL 113 2HG2 VAL 113 -0.729 -19.844 -9.777 1309 H ARG 114 HN ARG 114 -3.366 -22.733 -10.315 1310 HA ARG 114 HA ARG 114 -1.503 -24.865 -10.487 1311 HE ARG 114 HE ARG 114 -2.080 -25.777 -6.625 1312 HB2 ARG 114 2HB ARG 114 -2.717 -24.424 -8.432 1313 HB3 ARG 114 3HB ARG 114 -4.274 -24.725 -9.208 1314 HG2 ARG 114 2HG ARG 114 -3.690 -27.100 -9.561 1315 HG3 ARG 114 3HG ARG 114 -2.090 -26.830 -8.855 1316 HD2 ARG 114 2HD ARG 114 -4.730 -26.383 -7.395 1317 HD3 ARG 114 3HD ARG 114 -3.825 -27.908 -7.369 1318 HH11 ARG 114 1HH1 ARG 114 -4.800 -27.586 -5.275 1319 HH12 ARG 114 2HH1 ARG 114 -4.239 -27.396 -3.644 1320 HH21 ARG 114 1HH2 ARG 114 -1.448 -25.492 -4.496 1321 HH22 ARG 114 2HH2 ARG 114 -2.505 -26.118 -3.229 1322 H HIS 115 HN HIS 115 -4.982 -24.788 -11.533 1323 HA HIS 115 HA HIS 115 -5.132 -27.303 -12.638 1324 HD1 HIS 115 1HD HIS 115 -7.085 -28.555 -13.607 1325 HD2 HIS 115 2HD HIS 115 -7.213 -25.231 -16.190 1326 HE1 HIS 115 1HE HIS 115 -7.852 -29.408 -15.896 1327 HB2 HIS 115 2HB HIS 115 -7.048 -25.786 -12.520 1328 HB3 HIS 115 3HB HIS 115 -6.355 -24.736 -13.760 1329 H HIS 116 HN HIS 116 -3.997 -24.344 -14.358 1330 HA HIS 116 HA HIS 116 -3.323 -25.599 -16.815 1331 HD1 HIS 116 1HD HIS 116 -5.131 -24.227 -17.593 1332 HD2 HIS 116 2HD HIS 116 -2.751 -20.855 -16.632 1333 HE1 HIS 116 1HE HIS 116 -6.285 -22.243 -18.522 1334 HB2 HIS 116 2HB HIS 116 -2.111 -23.215 -15.366 1335 HB3 HIS 116 3HB HIS 116 -1.646 -23.704 -16.988 1336 H ASN 117 HN ASN 117 -1.520 -25.363 -13.711 1337 HA ASN 117 HA ASN 117 1.001 -26.354 -14.792 1338 HB2 ASN 117 2HB ASN 117 0.476 -24.995 -12.593 1339 HB3 ASN 117 3HB ASN 117 0.179 -26.571 -11.872 1340 HD21 ASN 117 1HD2 ASN 117 2.310 -28.077 -13.160 1341 HD22 ASN 117 2HD2 ASN 117 3.812 -27.327 -12.553 1342 H MET 118 HN MET 118 -2.015 -27.843 -13.960 1343 HA MET 118 HA MET 118 -0.711 -30.539 -13.777 1344 HB2 MET 118 2HB MET 118 -3.460 -29.573 -12.866 1345 HB3 MET 118 3HB MET 118 -2.907 -31.252 -12.782 1346 HG2 MET 118 2HG MET 118 -1.103 -30.640 -11.265 1347 HG3 MET 118 3HG MET 118 -1.551 -28.934 -11.357 1348 HE1 MET 118 3HE MET 118 -2.436 -30.137 -7.679 1349 HE2 MET 118 1HE MET 118 -1.181 -30.874 -8.700 1350 HE3 MET 118 2HE MET 118 -1.373 -29.106 -8.667 1351 H HIS 119 HN HIS 119 -1.932 -28.546 -16.088 1352 HA HIS 119 HA HIS 119 -4.021 -30.154 -17.244 1353 HD1 HIS 119 1HD HIS 119 -4.471 -30.139 -20.132 1354 HD2 HIS 119 2HD HIS 119 -5.633 -26.779 -17.909 1355 HE1 HIS 119 1HE HIS 119 -7.013 -29.774 -20.567 1356 HB2 HIS 119 2HB HIS 119 -3.274 -27.589 -17.525 1357 HB3 HIS 119 3HB HIS 119 -2.458 -28.241 -18.947 Start of MODEL 12 1 H5 DC 124 5H C 124 -3.993 -31.414 -5.100 2 H6 DC 124 6H C 124 -5.924 -31.044 -6.550 3 H5' DC 124 H5' C 124 -8.759 -32.412 -9.828 4 H5'' DC 124 H5" C 124 -7.414 -32.437 -8.658 5 H4' DC 124 H4' C 124 -10.357 -32.499 -7.830 6 H3' DC 124 H3' C 124 -9.090 -30.299 -8.995 7 H2' DC 124 H2' C 124 -7.399 -30.037 -7.444 8 H2'' DC 124 H2" C 124 -8.631 -29.046 -6.625 9 H1' DC 124 H1' C 124 -9.413 -30.832 -5.257 10 H41 DC 124 1H4 C 124 -4.459 -32.239 -1.545 11 H42 DC 124 2H4 C 124 -3.320 -31.938 -2.845 12 H8 DG 125 8H G 125 -9.147 -26.948 -5.662 13 H1 DG 125 1H G 125 -6.439 -29.136 -0.243 14 H5' DG 125 H5' G 125 -12.812 -29.702 -6.264 15 H5'' DG 125 H5" G 125 -13.928 -28.424 -6.787 16 H4' DG 125 H4' G 125 -13.819 -28.559 -4.339 17 H3' DG 125 H3' G 125 -13.384 -26.126 -5.718 18 H2' DG 125 H2' G 125 -11.110 -25.958 -5.275 19 H2'' DG 125 H2" G 125 -11.674 -25.242 -3.736 20 H1' DG 125 H1' G 125 -11.538 -27.332 -2.589 21 H21 DG 125 1H2 G 125 -7.945 -29.339 1.315 22 H22 DG 125 2H2 G 125 -9.635 -28.950 1.028 23 H5 DC 126 5H C 126 -8.054 -23.928 -4.305 24 H6 DC 126 6H C 126 -10.050 -23.543 -2.936 25 H5' DC 126 H5' C 126 -13.636 -26.121 -1.123 26 H5'' DC 126 H5" C 126 -14.654 -24.809 -0.499 27 H4' DC 126 H4' C 126 -12.736 -25.117 0.942 28 H3' DC 126 H3' C 126 -13.332 -22.590 -0.205 29 H2' DC 126 H2' C 126 -11.476 -22.778 -1.640 30 H2'' DC 126 H2" C 126 -10.695 -21.945 -0.273 31 H1' DC 126 H1' C 126 -10.090 -24.178 0.770 32 H41 DC 126 1H4 C 126 -4.997 -25.327 -2.804 33 H42 DC 126 2H4 C 126 -5.775 -24.735 -4.254 34 H8 DG 127 8H G 127 -9.665 -21.782 1.611 35 H1 DG 127 1H G 127 -3.432 -22.953 0.632 36 H5' DG 127 H5' G 127 -12.207 -23.493 3.957 37 H5'' DG 127 H5" G 127 -12.604 -22.373 5.267 38 H4' DG 127 H4' G 127 -10.590 -23.632 5.819 39 H3' DG 127 H3' G 127 -10.683 -20.805 5.762 40 H2' DG 127 H2' G 127 -9.195 -20.527 4.017 41 H2'' DG 127 H2" G 127 -7.946 -20.776 5.273 42 H1' DG 127 H1' G 127 -7.685 -23.077 4.710 43 H21 DG 127 1H2 G 127 -2.434 -23.360 2.526 44 H22 DG 127 2H2 G 127 -3.270 -23.229 4.060 45 H8 DG 128 8H G 128 -7.436 -18.627 4.149 46 H1 DG 128 1H G 128 -2.663 -19.733 -0.005 47 H5' DG 128 H5' G 128 -6.696 -21.851 7.791 48 H5'' DG 128 H5" G 128 -6.564 -20.809 9.222 49 H4' DG 128 H4' G 128 -4.529 -20.609 7.933 50 H3' DG 128 H3' G 128 -6.179 -18.338 8.469 51 H2' DG 128 H2' G 128 -6.645 -17.948 6.216 52 H2'' DG 128 H2" G 128 -5.098 -17.041 6.332 53 H1' DG 128 H1' G 128 -3.837 -19.036 5.641 54 H21 DG 128 1H2 G 128 -0.808 -20.095 1.078 55 H22 DG 128 2H2 G 128 -0.778 -20.222 2.827 56 H8 DG 129 8H G 129 -3.443 -16.109 5.527 57 H1 DG 129 1H G 129 -0.879 -16.486 -0.356 58 H5' DG 129 H5' G 129 -1.592 -18.406 8.720 59 H5'' DG 129 H5" G 129 -0.827 -17.458 9.973 60 H4' DG 129 H4' G 129 0.650 -17.340 8.164 61 H3' DG 129 H3' G 129 -0.616 -14.898 8.795 62 H2' DG 129 H2' G 129 -1.989 -15.008 6.861 63 H2'' DG 129 H2" G 129 -0.597 -14.099 6.195 64 H1' DG 129 H1' G 129 0.458 -16.144 5.392 65 H21 DG 129 1H2 G 129 1.257 -16.289 -0.274 66 H22 DG 129 2H2 G 129 2.109 -16.106 1.252 67 H8 DG 130 8H G 130 0.547 -13.461 4.272 68 H1 DG 130 1H G 130 -0.554 -12.919 -2.030 69 H5' DG 130 H5' G 130 2.850 -15.504 5.514 70 H5'' DG 130 H5" G 130 3.965 -14.753 6.634 71 H4' DG 130 H4' G 130 5.069 -14.471 4.675 72 H3' DG 130 H3' G 130 4.234 -12.149 5.817 73 H2' DG 130 H2' G 130 2.330 -11.908 4.579 74 H2'' DG 130 H2" G 130 3.394 -10.993 3.523 75 H1' DG 130 H1' G 130 3.680 -12.775 2.004 76 H21 DG 130 1H2 G 130 1.282 -12.541 -3.103 77 H22 DG 130 2H2 G 130 2.827 -12.400 -2.277 78 H8 DG 131 8H G 131 2.672 -9.571 2.347 79 H1 DG 131 1H G 131 -1.925 -9.549 -2.116 80 H5' DG 131 H5' G 131 6.054 -11.741 1.713 81 H5'' DG 131 H5" G 131 7.364 -10.568 1.955 82 H4' DG 131 H4' G 131 6.655 -10.336 -0.291 83 H3' DG 131 H3' G 131 6.558 -8.165 1.503 84 H2' DG 131 H2' G 131 4.245 -8.075 1.596 85 H2'' DG 131 H2" G 131 4.417 -7.067 0.166 86 H1' DG 131 H1' G 131 3.878 -8.894 -1.320 87 H21 DG 131 1H2 G 131 -1.126 -8.989 -4.046 88 H22 DG 131 2H2 G 131 0.563 -8.543 -4.249 89 H5 DC 132 5H C 132 1.230 -6.352 1.657 90 H6 DC 132 6H C 132 2.761 -5.629 -0.122 91 H5' DC 132 H5' C 132 5.168 -7.675 -2.752 92 H5'' DC 132 H5" C 132 6.280 -6.519 -3.512 93 H4' DC 132 H4' C 132 4.253 -6.150 -4.637 94 H3' DC 132 H3' C 132 5.228 -4.086 -2.912 95 H2' DC 132 H2' C 132 3.472 -4.076 -1.474 96 H2'' DC 132 H2" C 132 2.652 -3.130 -2.728 97 H1' DC 132 H1' C 132 1.592 -5.024 -3.658 98 H41 DC 132 1H4 C 132 -2.380 -6.668 1.001 99 H42 DC 132 2H4 C 132 -1.079 -6.873 2.155 100 H8 DG 133 8H G 133 1.219 -1.771 -3.118 101 H1 DG 133 1H G 133 -4.921 -2.756 -1.568 102 H5' DG 133 H5' G 133 2.765 -3.215 -6.766 103 H5'' DG 133 H5" G 133 3.352 -1.706 -7.487 104 H4' DG 133 H4' G 133 0.998 -2.022 -8.062 105 H3' DG 133 H3' G 133 2.038 0.290 -6.882 106 H2' DG 133 H2' G 133 1.193 -0.164 -4.782 107 H2'' DG 133 H2" G 133 -0.158 0.784 -5.349 108 H1' DG 133 H1' G 133 -1.402 -1.210 -5.964 109 H21 DG 133 1H2 G 133 -6.193 -2.275 -3.254 110 H22 DG 133 2H2 G 133 -5.550 -1.696 -4.773 111 H5' DT 134 H5' T 134 -2.400 -0.138 -7.268 112 H5'' DT 134 H5" T 134 -2.783 1.060 -8.495 113 H4' DT 134 H4' T 134 -4.739 1.071 -7.176 114 H3' DT 134 H3' T 134 -3.038 3.375 -7.211 115 H2' DT 134 H2' T 134 -2.307 3.182 -5.081 116 H2'' DT 134 H2" T 134 -3.768 4.124 -4.796 117 H1' DT 134 H1' T 134 -5.094 2.110 -4.287 118 H3 DT 134 3H T 134 -4.174 0.268 -0.192 119 H71 DT 134 1H7 T 134 0.496 2.248 -2.201 120 H72 DT 134 2H7 T 134 0.302 1.738 -0.516 121 H73 DT 134 3H7 T 134 0.601 0.525 -1.779 122 H6 DT 134 6H T 134 -1.389 2.021 -3.743 123 H5 DC 135 5H C 135 -3.682 4.832 -2.810 124 H6 DC 135 6H C 135 -5.565 5.250 -4.326 125 H5' DC 135 H5' C 135 -7.525 3.517 -7.402 126 H5'' DC 135 H5" C 135 -8.359 4.878 -8.175 127 H4' DC 135 H4' C 135 -9.635 4.225 -6.243 128 H3' DC 135 H3' C 135 -8.656 6.850 -6.501 129 H2' DC 135 H2' C 135 -7.031 6.577 -4.868 130 H2'' DC 135 H2" C 135 -8.328 7.173 -3.838 131 H1' DC 135 H1' C 135 -9.086 4.874 -3.277 132 H41 DC 135 1H4 C 135 -4.199 3.486 0.562 133 H42 DC 135 2H4 C 135 -3.060 4.084 -0.613 134 H5' DT 136 H5' T 136 -10.935 5.179 -2.625 135 H5'' DT 136 H5" T 136 -12.421 6.060 -3.039 136 H4' DT 136 H4' T 136 -12.503 5.973 -0.714 137 H3' DT 136 H3' T 136 -12.273 8.497 -1.855 138 H2' DT 136 H2' T 136 -10.101 8.937 -1.421 139 H2'' DT 136 H2" T 136 -10.675 9.488 0.121 140 H1' DT 136 H1' T 136 -10.222 7.500 1.294 141 H3 DT 136 3H T 136 -5.809 6.475 1.766 142 H71 DT 136 1H7 T 136 -5.283 7.512 -2.881 143 H72 DT 136 2H7 T 136 -6.608 8.676 -3.118 144 H73 DT 136 3H7 T 136 -5.178 9.143 -2.175 145 H6 DT 136 6H T 136 -8.464 8.029 -1.910 146 H8 DG 137 8H G 137 -9.705 10.310 1.726 147 H1 DG 137 1H G 137 -3.802 9.271 3.976 148 H5' DG 137 H5' G 137 -12.235 7.367 2.502 149 H5'' DG 137 H5" G 137 -13.684 8.191 3.111 150 H4' DG 137 H4' G 137 -12.346 7.896 5.003 151 H3' DG 137 H3' G 137 -12.979 10.504 4.178 152 H2' DG 137 H2' G 137 -10.929 11.041 3.355 153 H2'' DG 137 H2" G 137 -10.599 11.523 5.004 154 H1' DG 137 H1' G 137 -9.443 9.496 5.507 155 H21 DG 137 1H2 G 137 -3.849 8.803 6.091 156 H22 DG 137 2H2 G 137 -5.353 8.805 6.999 157 H5 DC 138 5H C 138 -8.576 12.980 4.024 158 H6 DC 138 6H C 138 -9.157 12.269 6.288 159 H5' DC 138 H5' C 138 -10.316 9.243 7.572 160 H5'' DC 138 H5" C 138 -11.283 9.722 8.973 161 H4' DC 138 H4' C 138 -9.111 9.537 9.827 162 H3' DC 138 H3' C 138 -10.382 12.018 9.904 163 H2' DC 138 H2' C 138 -9.219 13.020 8.212 164 H2'' DC 138 H2" C 138 -8.088 13.413 9.468 165 H1' DC 138 H1' C 138 -6.577 11.678 8.920 166 H41 DC 138 1H4 C 138 -5.074 13.296 3.017 167 H42 DC 138 2H4 C 138 -6.753 13.410 2.543 168 H8 DG 139 8H G 139 -6.460 14.561 9.617 169 H1 DG 139 1H G 139 -2.152 15.790 5.031 170 H5' DG 139 H5' G 139 -6.190 10.995 11.262 171 H5'' DG 139 H5" G 139 -6.279 11.367 12.990 172 H4' DG 139 H4' G 139 -3.979 11.453 12.396 173 H3' DG 139 H3' G 139 -5.205 13.656 13.582 174 H2' DG 139 H2' G 139 -5.470 14.888 11.620 175 H2'' DG 139 H2" G 139 -3.884 15.511 12.068 176 H1' DG 139 H1' G 139 -2.733 14.013 10.598 177 H21 DG 139 1H2 G 139 -0.146 15.334 5.699 178 H22 DG 139 2H2 G 139 0.177 14.790 7.340 179 H5 DC 140 5H C 140 -4.233 17.594 10.548 180 H6 DC 140 6H C 140 -2.201 16.822 11.684 181 H5' DC 140 H5' C 140 -0.824 13.399 12.215 182 H5'' DC 140 H5" C 140 0.114 13.744 13.675 183 H4' DC 140 H4' C 140 1.513 14.153 11.731 184 H3' DC 140 H3' C 140 1.166 16.031 13.745 185 H2' DC 140 H2' C 140 -0.323 17.452 12.666 186 H2'' DC 140 H2" C 140 1.194 18.193 12.064 187 H1' DC 140 H1' C 140 1.167 16.957 10.056 188 H41 DC 140 1H4 C 140 -4.073 18.969 7.156 189 H42 DC 140 2H4 C 140 -5.088 18.481 8.495 190 H8 DG 141 8H G 141 -3.465 21.475 0.831 191 H1 DG 141 1H G 141 -1.654 18.722 6.359 192 H5' DG 141 H5' G 141 -0.738 24.564 -0.719 193 H5'' DG 141 H5" G 141 -1.036 23.800 -2.284 194 H4' DG 141 H4' G 141 0.861 22.867 -0.938 195 H3' DG 141 H3' G 141 -0.930 21.443 -2.531 196 H2' DG 141 H2' G 141 -2.174 20.608 -0.808 197 H2'' DG 141 H2" G 141 -0.980 19.314 -0.833 198 H1' DG 141 H1' G 141 0.248 20.266 0.994 199 H21 DG 141 1H2 G 141 0.497 18.348 6.375 200 H22 DG 141 2H2 G 141 1.490 18.617 4.951 201 H5 DC 142 5H C 142 -2.692 17.623 0.353 202 H6 DC 142 6H C 142 -0.308 17.270 -0.047 203 H5' DC 142 H5' C 142 2.127 19.676 0.397 204 H5'' DC 142 H5" C 142 3.300 19.254 -0.840 205 H4' DC 142 H4' C 142 3.969 18.011 0.913 206 H3' DC 142 H3' C 142 3.171 16.554 -1.275 207 H2' DC 142 H2' C 142 1.106 15.911 -0.520 208 H2'' DC 142 H2" C 142 1.941 14.587 0.191 209 H1' DC 142 H1' C 142 1.918 15.500 2.385 210 H41 DC 142 1H4 C 142 -4.199 16.760 3.578 211 H42 DC 142 2H4 C 142 -4.410 17.521 2.013 212 H8 DG 143 8H G 143 1.517 12.956 1.304 213 H1 DG 143 1H G 143 -3.726 12.429 4.928 214 H5' DG 143 H5' G 143 4.157 15.340 3.294 215 H5'' DG 143 H5" G 143 5.619 14.467 2.832 216 H4' DG 143 H4' G 143 4.897 13.535 4.907 217 H3' DG 143 H3' G 143 5.278 11.903 2.682 218 H2' DG 143 H2' G 143 3.076 11.736 2.032 219 H2'' DG 143 H2" G 143 3.043 10.365 3.103 220 H1' DG 143 H1' G 143 2.033 11.577 4.869 221 H21 DG 143 1H2 G 143 -3.236 11.693 6.898 222 H22 DG 143 2H2 G 143 -1.581 11.301 7.345 223 H5 DC 144 5H C 144 0.797 9.567 1.956 224 H6 DC 144 6H C 144 1.799 8.815 4.054 225 H5' DC 144 H5' C 144 3.054 10.970 6.454 226 H5'' DC 144 H5" C 144 4.313 9.996 7.166 227 H4' DC 144 H4' C 144 2.485 9.514 8.446 228 H3' DC 144 H3' C 144 3.743 7.503 7.016 229 H2' DC 144 H2' C 144 2.236 7.235 5.316 230 H2'' DC 144 H2" C 144 1.397 6.188 6.423 231 H1' DC 144 H1' C 144 -0.211 7.798 7.028 232 H41 DC 144 1H4 C 144 -2.852 9.888 1.635 233 H42 DC 144 2H4 C 144 -1.282 10.203 0.916 234 H8 DA 145 8H A 145 -0.210 5.076 6.006 235 H2 DA 145 2H A 145 -6.323 6.172 4.377 236 H5' DA 145 H5' A 145 -0.019 7.308 9.746 237 H5'' DA 145 H5" A 145 0.159 5.914 10.822 238 H4' DA 145 H4' A 145 -2.200 6.344 10.405 239 H3' DA 145 H3' A 145 -1.010 3.831 10.184 240 H2' DA 145 H2' A 145 -0.896 3.911 7.834 241 H2'' DA 145 H2" A 145 -2.463 3.114 7.973 242 H1' DA 145 H1' A 145 -3.671 5.188 7.818 243 H61 DA 145 2H6 A 145 -1.887 6.100 1.636 244 H62 DA 145 1H6 A 145 -3.470 6.505 0.999 245 H8 DG 146 8H G 146 -3.846 1.610 7.199 246 H1 DG 146 1H G 146 -5.774 3.305 1.334 247 H5' DG 146 H5' G 146 -5.388 4.644 9.911 248 H5'' DG 146 H5" G 146 -6.601 4.351 11.137 249 H4' DG 146 H4' G 146 -7.908 3.770 9.474 250 H3' DG 146 H3' G 146 -6.694 1.305 10.341 251 H2' DG 146 H2' G 146 -5.583 0.872 8.368 252 H2'' DG 146 H2" G 146 -7.177 0.368 7.780 253 H1' DG 146 H1' G 146 -7.641 2.431 6.779 254 H21 DG 146 1H2 G 146 -7.893 3.696 1.320 255 H22 DG 146 2H2 G 146 -8.836 3.716 2.788 256 H8 DA 147 8H A 147 -6.939 -1.280 6.427 257 H2 DA 147 2H A 147 -6.507 0.388 0.252 258 H5' DA 147 H5' A 147 -10.149 1.860 7.513 259 H5'' DA 147 H5" A 147 -11.521 0.770 7.812 260 H4' DA 147 H4' A 147 -11.270 1.156 5.405 261 H3' DA 147 H3' A 147 -11.293 -1.443 6.648 262 H2' DA 147 H2' A 147 -9.121 -1.991 6.033 263 H2'' DA 147 H2" A 147 -9.858 -2.387 4.453 264 H1' DA 147 H1' A 147 -9.389 -0.206 3.570 265 H61 DA 147 2H6 A 147 -2.809 -0.553 3.833 266 H62 DA 147 1H6 A 147 -2.538 -0.242 2.119 267 H5 DC 148 5H C 148 -7.082 -3.578 3.250 268 H6 DC 148 6H C 148 -9.372 -3.468 2.389 269 H5' DC 148 H5' C 148 -12.284 -0.784 1.969 270 H5'' DC 148 H5" C 148 -13.752 -1.754 1.779 271 H4' DC 148 H4' C 148 -12.721 -1.691 -0.359 272 H3' DC 148 H3' C 148 -13.170 -4.171 0.892 273 H2' DC 148 H2' C 148 -10.928 -4.441 1.458 274 H2'' DC 148 H2" C 148 -10.857 -5.257 -0.097 275 H1' DC 148 H1' C 148 -10.123 -3.249 -1.262 276 H41 DC 148 1H4 C 148 -4.196 -3.175 0.998 277 H42 DC 148 2H4 C 148 -4.752 -3.461 2.636 278 H8 DG 149 8H G 149 -9.212 -6.828 -0.939 279 H1 DG 149 1H G 149 -2.850 -5.852 -1.081 280 H5' DG 149 H5' G 149 -10.875 -3.551 -3.178 281 H5'' DG 149 H5" G 149 -12.066 -4.330 -4.221 282 H4' DG 149 H4' G 149 -10.034 -4.499 -5.390 283 H3' DG 149 H3' G 149 -11.491 -6.784 -4.552 284 H2' DG 149 H2' G 149 -10.024 -7.435 -2.900 285 H2'' DG 149 H2" G 149 -9.183 -8.272 -4.189 286 H1' DG 149 H1' G 149 -7.611 -6.428 -4.474 287 H21 DG 149 1H2 G 149 -2.197 -5.649 -3.174 288 H22 DG 149 2H2 G 149 -3.350 -5.590 -4.495 289 H5 DC 150 5H C 150 -6.999 -9.482 -1.675 290 H6 DC 150 6H C 150 -7.143 -9.737 -4.101 291 H5' DC 150 H5' C 150 -8.141 -9.094 -5.723 292 H5'' DC 150 H5" C 150 -7.873 -7.414 -6.275 293 H4' DC 150 H4' C 150 -6.655 -8.325 -8.237 294 H3' DC 150 H3' C 150 -7.809 -10.755 -7.651 295 H2' DC 150 H2' C 150 -6.799 -11.144 -5.629 296 H2'' DC 150 H2" C 150 -5.543 -11.798 -6.618 297 H1' DC 150 H1' C 150 -4.108 -9.911 -6.317 298 H41 DC 150 1H4 C 150 -3.740 -9.337 -0.018 299 H42 DC 150 2H4 C 150 -5.481 -9.214 0.172 300 H5 DC 151 5H C 151 -5.107 -12.903 -4.340 301 H6 DC 151 6H C 151 -3.928 -12.850 -6.486 302 H5' DC 151 H5' C 151 -3.518 -10.278 -9.259 303 H5'' DC 151 H5" C 151 -3.216 -11.433 -10.558 304 H4' DC 151 H4' C 151 -1.132 -10.876 -9.393 305 H3' DC 151 H3' C 151 -2.112 -13.440 -9.974 306 H2' DC 151 H2' C 151 -2.684 -13.957 -7.805 307 H2'' DC 151 H2" C 151 -1.037 -14.527 -7.689 308 H1' DC 151 H1' C 151 -0.237 -12.447 -6.730 309 H41 DC 151 1H4 C 151 -3.239 -12.929 -1.183 310 H42 DC 151 2H4 C 151 -4.807 -12.884 -1.948 311 H5 DC 152 5H C 152 -3.194 -15.921 -4.988 312 H6 DC 152 6H C 152 -1.008 -16.098 -6.082 313 H5' DC 152 H5' C 152 1.650 -13.239 -7.530 314 H5'' DC 152 H5" C 152 2.919 -14.031 -8.477 315 H4' DC 152 H4' C 152 3.469 -14.595 -6.247 316 H3' DC 152 H3' C 152 2.525 -16.722 -7.969 317 H2' DC 152 H2' C 152 0.693 -17.244 -6.674 318 H2'' DC 152 H2" C 152 1.851 -18.170 -5.702 319 H1' DC 152 H1' C 152 2.196 -16.336 -4.140 320 H41 DC 152 1H4 C 152 -3.483 -16.190 -1.338 321 H42 DC 152 2H4 C 152 -4.316 -16.025 -2.873 322 H5 DC 153 5H C 153 -1.311 -19.557 -4.667 323 H6 DC 153 6H C 153 1.082 -19.999 -4.430 324 H5' DC 153 H5' C 153 4.152 -17.561 -4.051 325 H5'' DC 153 H5" C 153 5.709 -18.361 -4.332 326 H4' DC 153 H4' C 153 5.167 -19.144 -2.215 327 H3' DC 153 H3' C 153 4.948 -21.136 -4.279 328 H2' DC 153 H2' C 153 2.689 -21.234 -4.143 329 H2'' DC 153 H2" C 153 2.977 -22.358 -2.827 330 H1' DC 153 H1' C 153 2.734 -20.642 -1.121 331 H41 DC 153 1H4 C 153 -3.489 -19.289 -1.724 332 H42 DC 153 2H4 C 153 -3.419 -19.580 -3.452 333 H5 DC 154 5H C 154 -0.140 -22.886 -3.129 334 H6 DC 154 6H C 154 1.686 -23.553 -1.627 335 H5' DC 154 H5' C 154 4.684 -21.827 0.133 336 H5'' DC 154 H5" C 154 5.770 -23.161 0.565 337 H4' DC 154 H4' C 154 4.009 -23.048 2.206 338 H3' DC 154 H3' C 154 4.476 -25.368 0.581 339 H2' DC 154 H2' C 154 2.378 -25.482 -0.355 340 H2'' DC 154 H2" C 154 1.913 -26.132 1.251 341 H1' DC 154 H1' C 154 1.150 -24.047 2.037 342 H41 DC 154 1H4 C 154 -3.630 -22.780 -1.900 343 H42 DC 154 2H4 C 154 -2.545 -22.510 -3.250 344 H8 DG 155 8H G 155 0.518 -27.538 0.900 345 H1 DG 155 1H G 155 -5.562 -25.888 -0.305 346 H5' DG 155 H5' G 155 2.208 -25.465 4.580 347 H5'' DG 155 H5" G 155 2.714 -26.831 5.602 348 H4' DG 155 H4' G 155 0.320 -26.506 5.879 349 H3' DG 155 H3' G 155 1.428 -28.945 5.006 350 H2' DG 155 H2' G 155 0.595 -28.775 2.836 351 H2'' DG 155 H2" G 155 -0.818 -29.557 3.603 352 H1' DG 155 H1' G 155 -1.909 -27.433 3.974 353 H21 DG 155 1H2 G 155 -6.746 -25.926 1.526 354 H22 DG 155 2H2 G 155 -6.022 -26.303 3.084 355 H5 DC 156 5H C 156 -1.629 -30.589 1.102 356 H6 DC 156 6H C 156 -2.471 -30.981 3.375 357 H5' DC 156 H5' C 156 -2.645 -28.752 6.972 358 H5'' DC 156 H5" C 156 -3.002 -30.015 8.163 359 H4' DC 156 H4' C 156 -5.034 -29.404 6.981 360 H3' DC 156 H3' C 156 -3.992 -32.048 7.001 361 H2' DC 156 H2' C 156 -3.684 -32.193 4.734 362 H2'' DC 156 H2" C 156 -5.444 -32.504 4.763 363 H1' DC 156 H1' C 156 -6.021 -30.248 4.342 364 H41 DC 156 1H4 C 156 -3.863 -29.276 -1.511 365 H42 DC 156 2H4 C 156 -2.215 -29.666 -1.056 366 H8 DG 157 8H G 157 -6.395 -34.855 4.650 367 H1 DG 157 1H G 157 -6.965 -32.246 -1.186 368 H5' DG 157 H5' G 157 -8.747 -31.508 7.276 369 H5'' DG 157 H5" G 157 -9.488 -32.744 8.319 370 H4' DG 157 H4' G 157 -10.813 -32.367 6.230 371 H3' DG 157 H3' G 157 -10.153 -34.917 7.133 372 H2' DG 157 H2' G 157 -8.293 -35.235 5.695 373 H2'' DG 157 H2" G 157 -9.587 -35.933 4.659 374 H1' DG 157 H1' G 157 -9.979 -33.846 3.560 375 H21 DG 157 1H2 G 157 -9.060 -31.848 -1.615 376 H22 DG 157 2H2 G 157 -10.301 -32.038 -0.391 377 HA ALA 1 HA ALA 1 5.075 27.574 -15.029 378 H1 ALA 1 HN ALA 1 6.180 29.772 -14.986 379 HB1 ALA 1 1HB ALA 1 6.435 25.558 -15.476 380 HB2 ALA 1 2HB ALA 1 6.502 26.685 -16.847 381 HB3 ALA 1 3HB ALA 1 7.876 26.573 -15.724 382 H SER 2 HN SER 2 8.001 28.837 -13.593 383 HA SER 2 HA SER 2 8.293 27.060 -11.374 384 HG SER 2 HG SER 2 11.001 29.219 -12.142 385 HB2 SER 2 2HB SER 2 8.934 30.035 -11.544 386 HB3 SER 2 3HB SER 2 9.585 28.889 -10.351 387 H GLU 3 HN GLU 3 5.803 29.332 -12.094 388 HA GLU 3 HA GLU 3 5.062 30.229 -9.483 389 HB2 GLU 3 2HB GLU 3 3.375 29.734 -11.981 390 HB3 GLU 3 3HB GLU 3 2.804 30.558 -10.536 391 HG2 GLU 3 2HG GLU 3 3.382 32.219 -12.166 392 HG3 GLU 3 3HG GLU 3 4.494 32.323 -10.805 393 H LYS 4 HN LYS 4 4.832 27.077 -10.963 394 HA LYS 4 HA LYS 4 2.587 26.056 -9.434 395 HB2 LYS 4 2HB LYS 4 3.249 23.905 -10.251 396 HB3 LYS 4 3HB LYS 4 3.535 25.063 -11.550 397 HG2 LYS 4 2HG LYS 4 5.999 25.122 -10.677 398 HG3 LYS 4 3HG LYS 4 5.567 23.674 -9.762 399 HD2 LYS 4 2HD LYS 4 4.972 22.475 -11.788 400 HD3 LYS 4 3HD LYS 4 5.245 23.915 -12.785 401 HE2 LYS 4 2HE LYS 4 7.378 22.570 -11.079 402 HE3 LYS 4 3HE LYS 4 7.136 22.250 -12.805 403 HZ1 LYS 4 3HZ LYS 4 7.541 24.594 -13.220 404 HZ2 LYS 4 1HZ LYS 4 8.842 23.897 -12.478 405 HZ3 LYS 4 2HZ LYS 4 7.807 24.862 -11.628 406 H ARG 5 HN ARG 5 5.794 26.953 -8.548 407 HA ARG 5 HA ARG 5 6.921 26.852 -6.516 408 HE ARG 5 HE ARG 5 2.763 25.354 -6.036 409 HB2 ARG 5 2HB ARG 5 4.727 25.096 -5.339 410 HB3 ARG 5 3HB ARG 5 5.857 26.062 -4.488 411 HG2 ARG 5 2HG ARG 5 4.762 28.053 -4.764 412 HG3 ARG 5 3HG ARG 5 3.986 27.599 -6.274 413 HD2 ARG 5 2HD ARG 5 3.240 26.475 -3.552 414 HD3 ARG 5 3HD ARG 5 2.363 27.738 -4.445 415 HH11 ARG 5 2HH2 ARG 5 0.561 26.652 -3.620 416 HH12 ARG 5 1HH2 ARG 5 -0.748 25.607 -4.138 417 HH21 ARG 5 1HH1 ARG 5 1.134 24.082 -6.607 418 HH22 ARG 5 2HH1 ARG 5 -0.421 24.144 -5.793 419 HA PRO 6 HA PRO 6 8.968 22.912 -6.839 420 HB2 PRO 6 2HB PRO 6 10.813 23.069 -4.844 421 HB3 PRO 6 3HB PRO 6 10.821 24.222 -6.214 422 HG2 PRO 6 2HG PRO 6 9.612 24.621 -3.452 423 HG3 PRO 6 3HG PRO 6 10.712 25.720 -4.342 424 HD2 PRO 6 2HD PRO 6 7.975 25.988 -4.330 425 HD3 PRO 6 3HD PRO 6 8.984 26.475 -5.728 426 H PHE 7 HN PHE 7 9.618 20.941 -5.504 427 HA PHE 7 HA PHE 7 8.039 20.571 -3.007 428 HD1 PHE 7 1HD PHE 7 5.148 20.245 -3.127 429 HD2 PHE 7 2HD PHE 7 6.867 20.038 -7.065 430 HE1 PHE 7 1HE PHE 7 3.385 21.764 -3.980 431 HE2 PHE 7 2HE PHE 7 5.105 21.582 -7.907 432 HZ PHE 7 HZ PHE 7 3.391 22.467 -6.365 433 HB2 PHE 7 2HB PHE 7 7.709 18.624 -5.327 434 HB3 PHE 7 3HB PHE 7 6.938 18.518 -3.746 435 H MET 8 HN MET 8 8.968 19.044 -1.603 436 HA MET 8 HA MET 8 10.973 17.188 -2.812 437 HB2 MET 8 2HB MET 8 12.452 17.428 -0.924 438 HB3 MET 8 3HB MET 8 12.188 19.002 -1.669 439 HG2 MET 8 2HG MET 8 10.583 19.601 0.103 440 HG3 MET 8 3HG MET 8 10.814 18.027 0.869 441 HE1 MET 8 3HE MET 8 14.349 18.171 2.384 442 HE2 MET 8 1HE MET 8 12.819 17.280 2.226 443 HE3 MET 8 2HE MET 8 13.908 17.435 0.827 444 H CYS 9 HN CYS 9 11.320 15.220 -1.708 445 HA CYS 9 HA CYS 9 8.947 14.051 -0.522 446 HB2 CYS 9 2HB CYS 9 10.411 12.606 -1.718 447 HB3 CYS 9 3HB CYS 9 11.829 13.150 -0.844 448 H ALA 10 HN ALA 10 8.703 13.212 1.647 449 HA ALA 10 HA ALA 10 10.095 14.905 3.681 450 HB1 ALA 10 1HB ALA 10 7.367 13.566 3.825 451 HB2 ALA 10 2HB ALA 10 8.071 14.659 5.035 452 HB3 ALA 10 3HB ALA 10 7.654 15.287 3.429 453 H TYR 11 HN TYR 11 9.937 11.689 2.502 454 HA TYR 11 HA TYR 11 10.019 10.251 5.026 455 HD1 TYR 11 1HD TYR 11 8.795 8.173 5.101 456 HD2 TYR 11 2HD TYR 11 12.314 7.340 2.763 457 HE1 TYR 11 1HE TYR 11 9.102 5.995 6.303 458 HE2 TYR 11 2HE TYR 11 12.531 5.122 3.877 459 HH TYR 11 HH TYR 11 10.159 3.864 6.141 460 HB2 TYR 11 2HB TYR 11 9.426 9.328 2.734 461 HB3 TYR 11 3HB TYR 11 11.148 9.346 2.360 462 HA PRO 12 HA PRO 12 14.061 11.724 6.072 463 HB2 PRO 12 2HB PRO 12 14.483 10.301 8.413 464 HB3 PRO 12 3HB PRO 12 13.289 11.604 8.248 465 HG2 PRO 12 2HG PRO 12 12.777 8.626 7.986 466 HG3 PRO 12 3HG PRO 12 11.911 9.814 9.015 467 HD2 PRO 12 2HD PRO 12 10.961 9.094 6.589 468 HD3 PRO 12 3HD PRO 12 10.847 10.799 7.135 469 H GLY 13 HN GLY 13 14.659 10.461 3.975 470 HA2 GLY 13 2HA GLY 13 17.117 9.086 4.341 471 HA3 GLY 13 3HA GLY 13 15.828 7.878 4.161 472 H CYS 14 HN CYS 14 14.266 9.884 2.458 473 HA CYS 14 HA CYS 14 15.808 9.582 -0.082 474 HB2 CYS 14 2HB CYS 14 13.656 8.493 -0.216 475 HB3 CYS 14 3HB CYS 14 12.849 9.868 0.533 476 H ASN 15 HN ASN 15 13.173 11.811 0.948 477 HA ASN 15 HA ASN 15 12.983 14.104 0.793 478 HB2 ASN 15 2HB ASN 15 15.845 13.937 1.841 479 HB3 ASN 15 3HB ASN 15 14.863 15.399 1.844 480 HD21 ASN 15 1HD2 ASN 15 12.357 14.710 2.760 481 HD22 ASN 15 2HD2 ASN 15 12.608 13.945 4.349 482 H LYS 16 HN LYS 16 13.508 12.954 -1.695 483 HA LYS 16 HA LYS 16 15.552 14.609 -3.065 484 HB2 LYS 16 2HB LYS 16 13.527 12.546 -4.027 485 HB3 LYS 16 3HB LYS 16 14.597 13.429 -5.126 486 HG2 LYS 16 2HG LYS 16 16.580 12.479 -4.137 487 HG3 LYS 16 3HG LYS 16 15.661 11.818 -2.784 488 HD2 LYS 16 2HD LYS 16 14.375 10.389 -4.469 489 HD3 LYS 16 3HD LYS 16 15.529 10.930 -5.694 490 HE2 LYS 16 2HE LYS 16 16.157 8.739 -4.806 491 HE3 LYS 16 3HE LYS 16 17.386 9.941 -4.368 492 HZ1 LYS 16 3HZ LYS 16 15.186 9.161 -2.565 493 HZ2 LYS 16 1HZ LYS 16 16.500 10.033 -2.189 494 HZ3 LYS 16 2HZ LYS 16 16.679 8.427 -2.536 495 H ARG 17 HN ARG 17 14.962 16.003 -4.869 496 HA ARG 17 HA ARG 17 12.559 17.550 -4.087 497 HE ARG 17 HE ARG 17 16.109 20.177 -1.920 498 HB2 ARG 17 2HB ARG 17 14.993 18.244 -5.810 499 HB3 ARG 17 3HB ARG 17 13.632 19.334 -5.505 500 HG2 ARG 17 2HG ARG 17 14.077 19.229 -3.063 501 HG3 ARG 17 3HG ARG 17 15.474 18.176 -3.364 502 HD2 ARG 17 2HD ARG 17 16.516 19.956 -4.738 503 HD3 ARG 17 3HD ARG 17 15.119 21.011 -4.427 504 HH11 ARG 17 1HH2 ARG 17 17.276 22.176 -4.566 505 HH12 ARG 17 2HH2 ARG 17 18.296 23.127 -3.506 506 HH21 ARG 17 2HH1 ARG 17 17.422 21.430 -0.642 507 HH22 ARG 17 1HH1 ARG 17 18.371 22.710 -1.358 508 H TYR 18 HN TYR 18 10.788 17.537 -5.222 509 HA TYR 18 HA TYR 18 10.797 16.610 -8.041 510 HD1 TYR 18 2HD TYR 18 10.222 15.299 -4.443 511 HD2 TYR 18 1HD TYR 18 8.771 14.053 -8.316 512 HE1 TYR 18 2HE TYR 18 11.086 13.020 -4.046 513 HE2 TYR 18 1HE TYR 18 9.736 11.813 -7.946 514 HH TYR 18 HH TYR 18 11.242 10.870 -4.917 515 HB2 TYR 18 2HB TYR 18 8.691 16.753 -5.866 516 HB3 TYR 18 3HB TYR 18 8.319 16.302 -7.512 517 H PHE 19 HN PHE 19 8.969 17.611 -9.379 518 HA PHE 19 HA PHE 19 8.943 20.581 -8.897 519 HD1 PHE 19 2HD PHE 19 10.846 22.125 -10.438 520 HD2 PHE 19 1HD PHE 19 11.238 17.870 -11.038 521 HE1 PHE 19 2HE PHE 19 13.309 22.314 -10.205 522 HE2 PHE 19 1HE PHE 19 13.695 18.064 -10.783 523 HZ PHE 19 HZ PHE 19 14.736 20.284 -10.377 524 HB2 PHE 19 2HB PHE 19 9.111 19.015 -11.516 525 HB3 PHE 19 3HB PHE 19 8.984 20.767 -11.386 526 H LYS 20 HN LYS 20 7.060 17.712 -9.838 527 HA LYS 20 HA LYS 20 4.632 19.435 -10.180 528 HB2 LYS 20 2HB LYS 20 5.463 16.737 -11.221 529 HB3 LYS 20 3HB LYS 20 3.723 17.083 -11.038 530 HG2 LYS 20 2HG LYS 20 3.976 19.072 -12.451 531 HG3 LYS 20 3HG LYS 20 5.714 18.806 -12.586 532 HD2 LYS 20 2HD LYS 20 3.541 16.917 -13.603 533 HD3 LYS 20 3HD LYS 20 4.438 18.062 -14.598 534 HE2 LYS 20 2HE LYS 20 5.654 15.708 -13.087 535 HE3 LYS 20 3HE LYS 20 5.291 15.753 -14.817 536 HZ1 LYS 20 3HZ LYS 20 6.845 17.576 -15.034 537 HZ2 LYS 20 1HZ LYS 20 7.590 16.248 -14.412 538 HZ3 LYS 20 2HZ LYS 20 7.202 17.511 -13.429 539 H LEU 21 HN LEU 21 3.180 19.487 -8.574 540 HA LEU 21 HA LEU 21 3.619 18.321 -6.063 541 HG LEU 21 HG LEU 21 -0.097 18.469 -7.444 542 HB2 LEU 21 2HB LEU 21 1.342 18.894 -5.535 543 HB3 LEU 21 3HB LEU 21 2.145 20.196 -6.361 544 HD11 LEU 21 1HD1 LEU 21 -1.334 20.588 -7.280 545 HD12 LEU 21 2HD1 LEU 21 0.115 21.414 -6.671 546 HD13 LEU 21 3HD1 LEU 21 -0.664 20.139 -5.707 547 HD21 LEU 21 3HD2 LEU 21 1.393 20.772 -8.795 548 HD22 LEU 21 1HD2 LEU 21 -0.175 20.133 -9.322 549 HD23 LEU 21 2HD2 LEU 21 1.239 19.097 -9.404 550 H SER 22 HN SER 22 1.378 17.163 -8.651 551 HA SER 22 HA SER 22 0.495 14.860 -7.215 552 HG SER 22 HG SER 22 -1.574 16.074 -9.804 553 HB2 SER 22 2HB SER 22 0.586 15.202 -10.227 554 HB3 SER 22 3HB SER 22 -0.503 14.166 -9.284 555 H HIS 23 HN HIS 23 3.271 15.391 -9.370 556 HA HIS 23 HA HIS 23 3.809 12.540 -9.761 557 HD1 HIS 23 1HD HIS 23 7.424 13.643 -12.251 558 HD2 HIS 23 2HD HIS 23 6.679 15.855 -8.778 559 HE1 HIS 23 1HE HIS 23 9.455 15.151 -11.881 560 HB2 HIS 23 2HB HIS 23 5.169 13.225 -11.300 561 HB3 HIS 23 3HB HIS 23 4.548 14.800 -11.116 562 H LEU 24 HN LEU 24 4.593 15.028 -7.449 563 HA LEU 24 HA LEU 24 6.662 13.465 -6.063 564 HG LEU 24 HG LEU 24 7.547 16.105 -4.008 565 HB2 LEU 24 2HB LEU 24 6.590 15.941 -6.005 566 HB3 LEU 24 3HB LEU 24 5.072 15.899 -5.189 567 HD11 LEU 24 1HD1 LEU 24 5.001 15.093 -2.719 568 HD12 LEU 24 2HD1 LEU 24 5.424 16.788 -3.031 569 HD13 LEU 24 3HD1 LEU 24 6.380 15.844 -1.877 570 HD21 LEU 24 3HD2 LEU 24 6.743 13.404 -2.964 571 HD22 LEU 24 1HD2 LEU 24 8.248 14.282 -2.811 572 HD23 LEU 24 2HD2 LEU 24 7.863 13.509 -4.348 573 H GLN 25 HN GLN 25 3.162 14.260 -5.657 574 HA GLN 25 HA GLN 25 2.705 12.746 -3.293 575 HB2 GLN 25 2HB GLN 25 0.983 13.606 -5.624 576 HB3 GLN 25 3HB GLN 25 0.320 12.498 -4.421 577 HG2 GLN 25 2HG GLN 25 0.632 14.007 -2.620 578 HG3 GLN 25 3HG GLN 25 1.714 15.051 -3.546 579 HE21 GLN 25 1HE2 GLN 25 0.828 16.258 -5.342 580 HE22 GLN 25 2HE2 GLN 25 -0.893 16.752 -5.239 581 H MET 26 HN MET 26 2.755 11.747 -6.750 582 HA MET 26 HA MET 26 2.036 9.006 -6.302 583 HB2 MET 26 2HB MET 26 2.793 10.637 -8.547 584 HB3 MET 26 3HB MET 26 3.900 9.268 -8.522 585 HG2 MET 26 2HG MET 26 0.869 9.111 -8.363 586 HG3 MET 26 3HG MET 26 1.828 8.803 -9.809 587 HE1 MET 26 3HE MET 26 -0.085 6.599 -9.457 588 HE2 MET 26 1HE MET 26 0.181 5.373 -8.195 589 HE3 MET 26 2HE MET 26 -0.385 7.000 -7.750 590 H HIS 27 HN HIS 27 5.241 10.694 -6.437 591 HA HIS 27 HA HIS 27 6.874 8.407 -6.019 592 HD1 HIS 27 1HD HIS 27 9.566 8.250 -5.224 593 HD2 HIS 27 2HD HIS 27 8.437 11.694 -3.074 594 HE1 HIS 27 1HE HIS 27 11.025 8.342 -3.092 595 HB2 HIS 27 2HB HIS 27 8.026 10.403 -6.547 596 HB3 HIS 27 3HB HIS 27 7.208 11.361 -5.327 597 H SER 28 HN SER 28 5.318 10.602 -3.613 598 HA SER 28 HA SER 28 6.282 9.465 -1.313 599 HG SER 28 HG SER 28 4.504 9.497 0.400 600 HB2 SER 28 2HB SER 28 4.842 11.505 -1.554 601 HB3 SER 28 3HB SER 28 3.415 10.443 -1.628 602 H ARG 29 HN ARG 29 3.840 8.059 -3.472 603 HA ARG 29 HA ARG 29 2.509 6.323 -1.628 604 HE ARG 29 HE ARG 29 1.012 7.233 -1.633 605 HB2 ARG 29 2HB ARG 29 3.230 5.791 -4.534 606 HB3 ARG 29 3HB ARG 29 2.038 4.907 -3.611 607 HG2 ARG 29 2HG ARG 29 1.750 7.898 -4.101 608 HG3 ARG 29 3HG ARG 29 1.224 6.687 -5.255 609 HD2 ARG 29 2HD ARG 29 -0.661 7.365 -3.990 610 HD3 ARG 29 3HD ARG 29 -0.283 5.689 -3.569 611 HH11 ARG 29 1HH1 ARG 29 -2.308 7.192 -2.718 612 HH12 ARG 29 2HH1 ARG 29 -2.949 7.467 -1.108 613 HH21 ARG 29 2HH2 ARG 29 0.138 7.476 0.468 614 HH22 ARG 29 1HH2 ARG 29 -1.556 7.913 0.544 615 H LYS 30 HN LYS 30 5.647 6.031 -3.312 616 HA LYS 30 HA LYS 30 6.239 3.292 -2.647 617 HB2 LYS 30 2HB LYS 30 7.496 4.697 -4.251 618 HB3 LYS 30 3HB LYS 30 8.109 5.698 -2.946 619 HG2 LYS 30 2HG LYS 30 8.665 2.722 -2.927 620 HG3 LYS 30 3HG LYS 30 9.532 3.773 -4.049 621 HD2 LYS 30 2HD LYS 30 10.224 5.227 -2.093 622 HD3 LYS 30 3HD LYS 30 9.581 3.986 -1.016 623 HE2 LYS 30 2HE LYS 30 11.773 3.603 -3.092 624 HE3 LYS 30 3HE LYS 30 12.014 3.770 -1.344 625 HZ1 LYS 30 3HZ LYS 30 12.043 1.470 -2.038 626 HZ2 LYS 30 1HZ LYS 30 10.504 1.592 -2.628 627 HZ3 LYS 30 2HZ LYS 30 10.785 1.761 -1.013 628 H HIS 31 HN HIS 31 6.475 6.331 -0.813 629 HA HIS 31 HA HIS 31 7.862 5.016 1.449 630 HD1 HIS 31 1HD HIS 31 10.084 5.505 1.307 631 HD2 HIS 31 2HD HIS 31 8.972 9.314 -0.165 632 HE1 HIS 31 1HE HIS 31 12.172 6.565 0.305 633 HB2 HIS 31 2HB HIS 31 7.007 7.895 0.938 634 HB3 HIS 31 3HB HIS 31 7.785 7.341 2.420 635 H THR 32 HN THR 32 4.580 5.254 0.502 636 HA THR 32 HA THR 32 3.443 6.507 2.913 637 HB THR 32 HB THR 32 2.461 6.398 0.491 638 HG1 THR 32 1HG THR 32 0.821 5.917 2.737 639 HG21 THR 32 3HG2 THR 32 0.853 4.737 -0.022 640 HG22 THR 32 1HG2 THR 32 0.974 3.982 1.574 641 HG23 THR 32 2HG2 THR 32 2.298 3.810 0.420 642 H GLY 33 HN GLY 33 4.574 3.359 1.969 643 HA2 GLY 33 2HA GLY 33 3.337 2.209 4.440 644 HA3 GLY 33 3HA GLY 33 3.443 1.290 2.928 645 H GLU 34 HN GLU 34 5.918 3.493 4.300 646 HA GLU 34 HA GLU 34 7.724 1.119 4.627 647 HB2 GLU 34 2HB GLU 34 8.343 3.963 3.693 648 HB3 GLU 34 3HB GLU 34 9.592 2.784 4.191 649 HG2 GLU 34 2HG GLU 34 8.637 1.110 2.612 650 HG3 GLU 34 3HG GLU 34 7.599 2.375 1.962 651 H LYS 35 HN LYS 35 6.130 1.593 6.767 652 HA LYS 35 HA LYS 35 8.005 2.909 8.703 653 HB2 LYS 35 2HB LYS 35 5.040 2.918 8.473 654 HB3 LYS 35 3HB LYS 35 5.627 2.518 10.078 655 HG2 LYS 35 2HG LYS 35 5.236 4.924 9.843 656 HG3 LYS 35 3HG LYS 35 6.884 4.530 10.288 657 HD2 LYS 35 2HD LYS 35 6.763 6.399 8.695 658 HD3 LYS 35 3HD LYS 35 7.698 5.048 8.063 659 HE2 LYS 35 2HE LYS 35 5.681 4.319 6.754 660 HE3 LYS 35 3HE LYS 35 4.822 5.744 7.350 661 HZ1 LYS 35 3HZ LYS 35 7.308 5.835 5.783 662 HZ2 LYS 35 1HZ LYS 35 6.414 7.137 6.264 663 HZ3 LYS 35 2HZ LYS 35 5.823 6.064 5.154 664 HA PRO 36 HA PRO 36 8.645 -1.363 9.729 665 HB2 PRO 36 2HB PRO 36 10.702 -1.079 11.526 666 HB3 PRO 36 3HB PRO 36 10.886 -0.751 9.784 667 HG2 PRO 36 2HG PRO 36 10.373 1.267 11.989 668 HG3 PRO 36 3HG PRO 36 11.610 1.327 10.695 669 HD2 PRO 36 2HD PRO 36 9.199 2.613 10.505 670 HD3 PRO 36 3HD PRO 36 10.016 1.909 9.069 671 H TYR 37 HN TYR 37 6.645 -1.875 10.717 672 HA TYR 37 HA TYR 37 6.491 -1.452 13.698 673 HD1 TYR 37 2HD TYR 37 4.404 -1.473 9.965 674 HD2 TYR 37 1HD TYR 37 3.739 0.216 13.880 675 HE1 TYR 37 2HE TYR 37 3.464 0.578 8.932 676 HE2 TYR 37 1HE TYR 37 2.699 2.220 12.841 677 HH TYR 37 HH TYR 37 2.468 3.387 10.751 678 HB2 TYR 37 2HB TYR 37 4.407 -2.876 12.020 679 HB3 TYR 37 3HB TYR 37 4.277 -2.095 13.604 680 H GLN 38 HN GLN 38 6.260 -3.323 15.103 681 HA GLN 38 HA GLN 38 7.020 -5.933 13.874 682 HB2 GLN 38 2HB GLN 38 9.084 -4.681 14.853 683 HB3 GLN 38 3HB GLN 38 8.330 -4.930 16.428 684 HG2 GLN 38 2HG GLN 38 8.275 -7.490 15.614 685 HG3 GLN 38 3HG GLN 38 9.521 -6.942 14.509 686 HE21 GLN 38 1HE2 GLN 38 8.613 -7.473 17.913 687 HE22 GLN 38 2HE2 GLN 38 10.280 -7.471 18.511 688 H CYS 39 HN CYS 39 6.204 -7.727 14.926 689 HA CYS 39 HA CYS 39 4.001 -7.401 16.795 690 HB2 CYS 39 2HB CYS 39 5.543 -9.686 15.597 691 HB3 CYS 39 3HB CYS 39 4.698 -10.023 17.095 692 H ASP 40 HN ASP 40 3.934 -8.161 19.013 693 HA ASP 40 HA ASP 40 6.571 -8.219 20.428 694 HB2 ASP 40 2HB ASP 40 5.491 -5.929 20.547 695 HB3 ASP 40 3HB ASP 40 4.123 -6.666 21.382 696 H PHE 41 HN PHE 41 4.514 -10.274 19.574 697 HA PHE 41 HA PHE 41 3.114 -11.146 21.963 698 HD1 PHE 41 1HD PHE 41 0.510 -12.472 21.058 699 HD2 PHE 41 2HD PHE 41 2.956 -10.711 17.978 700 HE1 PHE 41 1HE PHE 41 -1.464 -11.216 20.201 701 HE2 PHE 41 2HE PHE 41 1.077 -9.433 17.194 702 HZ PHE 41 HZ PHE 41 -1.175 -9.625 18.291 703 HB2 PHE 41 2HB PHE 41 3.790 -12.523 19.335 704 HB3 PHE 41 3HB PHE 41 2.802 -13.246 20.589 705 H LYS 42 HN LYS 42 3.519 -13.320 22.934 706 HA LYS 42 HA LYS 42 6.390 -13.720 23.515 707 HB2 LYS 42 2HB LYS 42 3.973 -15.309 24.475 708 HB3 LYS 42 3HB LYS 42 5.612 -15.378 25.123 709 HG2 LYS 42 2HG LYS 42 3.639 -13.060 25.332 710 HG3 LYS 42 3HG LYS 42 4.234 -14.103 26.607 711 HD2 LYS 42 2HD LYS 42 5.416 -12.179 27.005 712 HD3 LYS 42 3HD LYS 42 6.595 -13.108 26.075 713 HE2 LYS 42 2HE LYS 42 6.052 -11.787 24.054 714 HE3 LYS 42 3HE LYS 42 4.732 -10.977 24.903 715 HZ1 LYS 42 3HZ LYS 42 7.594 -10.760 25.556 716 HZ2 LYS 42 1HZ LYS 42 6.370 -10.003 26.365 717 HZ3 LYS 42 2HZ LYS 42 6.675 -9.626 24.792 718 H ASP 43 HN ASP 43 4.357 -14.577 21.030 719 HA ASP 43 HA ASP 43 5.949 -17.034 20.427 720 HB2 ASP 43 2HB ASP 43 3.935 -17.972 19.334 721 HB3 ASP 43 3HB ASP 43 3.680 -17.693 21.049 722 H CYS 44 HN CYS 44 5.536 -13.863 19.582 723 HA CYS 44 HA CYS 44 6.515 -14.333 16.858 724 HB2 CYS 44 2HB CYS 44 4.030 -14.288 16.540 725 HB3 CYS 44 3HB CYS 44 3.983 -12.655 17.255 726 H GLU 45 HN GLU 45 7.708 -12.654 16.051 727 HA GLU 45 HA GLU 45 7.575 -10.013 17.259 728 HB2 GLU 45 2HB GLU 45 10.104 -11.714 17.501 729 HB3 GLU 45 3HB GLU 45 10.182 -9.957 17.423 730 HG2 GLU 45 2HG GLU 45 8.461 -9.933 19.354 731 HG3 GLU 45 3HG GLU 45 8.946 -11.621 19.600 732 H ARG 46 HN ARG 46 6.752 -11.052 14.765 733 HA ARG 46 HA ARG 46 8.880 -10.741 12.771 734 HE ARG 46 HE ARG 46 5.046 -13.254 13.123 735 HB2 ARG 46 2HB ARG 46 5.887 -11.284 12.669 736 HB3 ARG 46 3HB ARG 46 6.795 -10.926 11.197 737 HG2 ARG 46 2HG ARG 46 8.275 -12.788 11.494 738 HG3 ARG 46 3HG ARG 46 7.650 -13.136 13.109 739 HD2 ARG 46 2HD ARG 46 5.922 -13.298 10.605 740 HD3 ARG 46 3HD ARG 46 6.856 -14.665 11.247 741 HH11 ARG 46 2HH2 ARG 46 5.561 -16.276 11.409 742 HH12 ARG 46 1HH2 ARG 46 4.515 -17.130 12.540 743 HH21 ARG 46 1HH1 ARG 46 3.893 -14.285 14.398 744 HH22 ARG 46 2HH1 ARG 46 3.542 -16.010 14.257 745 H ARG 47 HN ARG 47 8.896 -9.165 11.101 746 HA ARG 47 HA ARG 47 7.864 -6.544 12.076 747 HE ARG 47 HE ARG 47 8.881 -3.810 9.792 748 HB2 ARG 47 2HB ARG 47 10.438 -7.365 11.350 749 HB3 ARG 47 3HB ARG 47 9.884 -6.623 9.877 750 HG2 ARG 47 2HG ARG 47 9.270 -4.757 11.969 751 HG3 ARG 47 3HG ARG 47 10.819 -5.453 12.382 752 HD2 ARG 47 2HD ARG 47 11.249 -3.511 11.072 753 HD3 ARG 47 3HD ARG 47 11.616 -4.909 10.049 754 HH11 ARG 47 1HH2 ARG 47 12.126 -3.684 8.408 755 HH12 ARG 47 2HH2 ARG 47 11.530 -2.929 6.941 756 HH21 ARG 47 1HH1 ARG 47 8.260 -2.818 8.014 757 HH22 ARG 47 2HH1 ARG 47 9.376 -2.429 6.708 758 H PHE 48 HN PHE 48 6.869 -5.097 10.666 759 HA PHE 48 HA PHE 48 6.166 -6.036 7.924 760 HD1 PHE 48 1HD PHE 48 3.763 -7.697 7.509 761 HD2 PHE 48 2HD PHE 48 4.577 -6.733 11.630 762 HE1 PHE 48 1HE PHE 48 3.570 -10.088 8.120 763 HE2 PHE 48 2HE PHE 48 4.380 -9.127 12.244 764 HZ PHE 48 HZ PHE 48 3.991 -10.808 10.460 765 HB2 PHE 48 2HB PHE 48 4.183 -4.948 9.971 766 HB3 PHE 48 3HB PHE 48 3.817 -5.340 8.295 767 H SER 49 HN SER 49 5.198 -4.212 6.614 768 HA SER 49 HA SER 49 6.758 -1.740 7.277 769 HG SER 49 HG SER 49 6.594 -0.585 4.439 770 HB2 SER 49 2HB SER 49 7.227 -3.206 5.200 771 HB3 SER 49 3HB SER 49 5.723 -2.551 4.530 772 H ARG 50 HN ARG 50 3.521 -2.957 6.707 773 HA ARG 50 HA ARG 50 2.506 -0.138 6.892 774 HE ARG 50 HE ARG 50 -0.363 -2.420 3.325 775 HB2 ARG 50 2HB ARG 50 1.187 -2.555 5.563 776 HB3 ARG 50 3HB ARG 50 0.417 -1.009 5.892 777 HG2 ARG 50 2HG ARG 50 2.377 0.019 4.545 778 HG3 ARG 50 3HG ARG 50 2.576 -1.598 3.869 779 HD2 ARG 50 2HD ARG 50 -0.050 -0.018 3.848 780 HD3 ARG 50 3HD ARG 50 1.141 0.070 2.565 781 HH11 ARG 50 1HH2 ARG 50 0.934 -0.383 0.750 782 HH12 ARG 50 2HH2 ARG 50 0.426 -1.547 -0.468 783 HH21 ARG 50 1HH1 ARG 50 -0.986 -3.747 1.692 784 HH22 ARG 50 2HH1 ARG 50 -0.666 -3.296 0.040 785 H SER 51 HN SER 51 0.889 0.289 8.377 786 HA SER 51 HA SER 51 0.788 -1.277 10.749 787 HG SER 51 HG SER 51 -1.665 0.947 11.958 788 HB2 SER 51 2HB SER 51 0.231 1.180 10.535 789 HB3 SER 51 3HB SER 51 -1.293 0.712 9.765 790 H ASP 52 HN ASP 52 -1.308 -1.159 7.851 791 HA ASP 52 HA ASP 52 -3.367 -2.875 8.852 792 HB2 ASP 52 2HB ASP 52 -3.917 -3.194 6.427 793 HB3 ASP 52 3HB ASP 52 -3.806 -1.528 6.987 794 H GLN 53 HN GLN 53 -0.248 -3.554 7.208 795 HA GLN 53 HA GLN 53 -0.665 -6.371 6.798 796 HB2 GLN 53 2HB GLN 53 1.820 -4.666 7.169 797 HB3 GLN 53 3HB GLN 53 1.898 -6.402 7.021 798 HG2 GLN 53 2HG GLN 53 0.965 -6.338 4.786 799 HG3 GLN 53 3HG GLN 53 0.828 -4.578 4.854 800 HE21 GLN 53 1HE2 GLN 53 2.732 -6.750 3.373 801 HE22 GLN 53 2HE2 GLN 53 4.289 -5.952 3.618 802 H LEU 54 HN LEU 54 0.930 -4.500 9.442 803 HA LEU 54 HA LEU 54 1.455 -6.742 11.129 804 HG LEU 54 HG LEU 54 0.737 -5.239 13.851 805 HB2 LEU 54 2HB LEU 54 2.490 -4.532 11.462 806 HB3 LEU 54 3HB LEU 54 0.920 -3.819 11.796 807 HD11 LEU 54 1HD1 LEU 54 3.684 -5.887 13.371 808 HD12 LEU 54 2HD1 LEU 54 2.365 -7.062 13.182 809 HD13 LEU 54 3HD1 LEU 54 2.712 -6.351 14.761 810 HD21 LEU 54 3HD2 LEU 54 1.947 -2.855 13.659 811 HD22 LEU 54 1HD2 LEU 54 3.340 -3.840 14.201 812 HD23 LEU 54 2HD2 LEU 54 1.885 -3.787 15.170 813 H LYS 55 HN LYS 55 -1.417 -4.540 10.934 814 HA LYS 55 HA LYS 55 -2.833 -5.626 13.196 815 HB2 LYS 55 2HB LYS 55 -3.479 -3.823 10.897 816 HB3 LYS 55 3HB LYS 55 -4.820 -4.776 11.467 817 HG2 LYS 55 2HG LYS 55 -5.071 -2.905 12.708 818 HG3 LYS 55 3HG LYS 55 -4.282 -3.981 13.846 819 HD2 LYS 55 2HD LYS 55 -2.934 -1.756 12.246 820 HD3 LYS 55 3HD LYS 55 -3.491 -1.623 13.914 821 HE2 LYS 55 2HE LYS 55 -1.910 -3.456 14.567 822 HE3 LYS 55 3HE LYS 55 -1.292 -3.456 12.903 823 HZ1 LYS 55 3HZ LYS 55 -0.712 -1.148 13.181 824 HZ2 LYS 55 1HZ LYS 55 0.067 -2.090 14.295 825 HZ3 LYS 55 2HZ LYS 55 -1.223 -1.168 14.745 826 H ARG 56 HN ARG 56 -3.059 -6.382 9.676 827 HA ARG 56 HA ARG 56 -4.973 -8.498 9.897 828 HE ARG 56 HE ARG 56 -1.849 -9.248 6.233 829 HB2 ARG 56 2HB ARG 56 -4.245 -7.482 7.764 830 HB3 ARG 56 3HB ARG 56 -2.628 -8.145 7.970 831 HG2 ARG 56 2HG ARG 56 -3.557 -10.456 7.775 832 HG3 ARG 56 3HG ARG 56 -5.183 -9.773 7.631 833 HD2 ARG 56 2HD ARG 56 -4.391 -10.322 5.415 834 HD3 ARG 56 3HD ARG 56 -4.456 -8.561 5.553 835 HH11 ARG 56 2HH2 ARG 56 -3.800 -9.803 3.333 836 HH12 ARG 56 1HH2 ARG 56 -2.395 -9.790 2.288 837 HH21 ARG 56 1HH1 ARG 56 -0.132 -9.318 4.863 838 HH22 ARG 56 2HH1 ARG 56 -0.379 -9.589 3.143 839 H HIS 57 HN HIS 57 -1.392 -8.495 10.024 840 HA HIS 57 HA HIS 57 -1.042 -11.269 10.355 841 HD1 HIS 57 1HD HIS 57 1.353 -12.421 9.922 842 HD2 HIS 57 2HD HIS 57 1.875 -10.069 13.310 843 HE1 HIS 57 1HE HIS 57 2.766 -13.843 11.560 844 HB2 HIS 57 2HB HIS 57 0.772 -9.725 9.785 845 HB3 HIS 57 3HB HIS 57 0.673 -8.956 11.372 846 H GLN 58 HN GLN 58 -1.674 -8.717 12.820 847 HA GLN 58 HA GLN 58 -1.179 -10.155 15.187 848 HB2 GLN 58 2HB GLN 58 -3.464 -8.195 14.664 849 HB3 GLN 58 3HB GLN 58 -2.952 -8.775 16.221 850 HG2 GLN 58 2HG GLN 58 -1.671 -6.695 14.508 851 HG3 GLN 58 3HG GLN 58 -2.178 -6.638 16.163 852 HE21 GLN 58 1HE2 GLN 58 0.203 -8.155 14.000 853 HE22 GLN 58 2HE2 GLN 58 1.502 -8.311 15.202 854 H ARG 59 HN ARG 59 -3.960 -10.335 12.960 855 HA ARG 59 HA ARG 59 -5.817 -11.697 14.636 856 HE ARG 59 HE ARG 59 -7.500 -7.979 11.894 857 HB2 ARG 59 2HB ARG 59 -5.450 -11.991 11.622 858 HB3 ARG 59 3HB ARG 59 -6.881 -12.411 12.552 859 HG2 ARG 59 2HG ARG 59 -7.170 -10.053 13.267 860 HG3 ARG 59 3HG ARG 59 -5.700 -9.595 12.428 861 HD2 ARG 59 2HD ARG 59 -6.757 -10.306 10.281 862 HD3 ARG 59 3HD ARG 59 -8.295 -10.473 11.166 863 HH11 ARG 59 1HH1 ARG 59 -7.860 -9.338 8.674 864 HH12 ARG 59 2HH1 ARG 59 -7.801 -7.744 7.914 865 HH21 ARG 59 1HH2 ARG 59 -7.611 -6.013 10.876 866 HH22 ARG 59 2HH2 ARG 59 -7.734 -5.942 9.133 867 H ARG 60 HN ARG 60 -2.992 -12.888 12.837 868 HA ARG 60 HA ARG 60 -3.573 -15.668 12.742 869 HE ARG 60 HE ARG 60 0.987 -18.108 12.371 870 HB2 ARG 60 2HB ARG 60 -1.677 -14.558 11.585 871 HB3 ARG 60 3HB ARG 60 -0.886 -14.276 13.142 872 HG2 ARG 60 2HG ARG 60 -0.578 -16.659 13.497 873 HG3 ARG 60 3HG ARG 60 -1.472 -17.031 12.016 874 HD2 ARG 60 2HD ARG 60 0.279 -15.792 10.699 875 HD3 ARG 60 3HD ARG 60 1.122 -15.430 12.209 876 HH11 ARG 60 2HH1 ARG 60 2.162 -16.171 9.627 877 HH12 ARG 60 1HH1 ARG 60 3.340 -17.395 9.229 878 HH21 ARG 60 1HH2 ARG 60 2.463 -19.583 11.715 879 HH22 ARG 60 2HH2 ARG 60 3.487 -19.256 10.337 880 H HIS 61 HN HIS 61 -2.390 -13.651 15.457 881 HA HIS 61 HA HIS 61 -2.101 -16.116 17.150 882 HD1 HIS 61 1HD HIS 61 -1.336 -11.810 16.305 883 HD2 HIS 61 2HD HIS 61 1.682 -14.669 16.741 884 HE1 HIS 61 1HE HIS 61 0.803 -10.874 15.164 885 HB2 HIS 61 2HB HIS 61 -1.315 -13.664 18.490 886 HB3 HIS 61 3HB HIS 61 -0.386 -15.097 18.146 887 H THR 62 HN THR 62 -3.879 -13.078 16.808 888 HA THR 62 HA THR 62 -5.032 -13.249 19.503 889 HB THR 62 HB THR 62 -6.279 -11.189 18.793 890 HG1 THR 62 1HG THR 62 -4.691 -11.330 16.476 891 HG21 THR 62 3HG2 THR 62 -3.286 -11.108 18.167 892 HG22 THR 62 1HG2 THR 62 -4.048 -10.883 19.749 893 HG23 THR 62 2HG2 THR 62 -4.337 -9.704 18.460 894 H GLY 63 HN GLY 63 -5.747 -14.855 16.627 895 HA2 GLY 63 2HA GLY 63 -7.582 -16.081 15.947 896 HA3 GLY 63 3HA GLY 63 -8.223 -15.865 17.586 897 H VAL 64 HN VAL 64 -7.654 -12.838 16.138 898 HA VAL 64 HA VAL 64 -10.444 -12.190 16.172 899 HB VAL 64 HB VAL 64 -7.948 -10.722 15.234 900 HG11 VAL 64 1HG1 VAL 64 -9.593 -9.618 13.896 901 HG12 VAL 64 2HG1 VAL 64 -10.814 -9.679 15.199 902 HG13 VAL 64 3HG1 VAL 64 -9.396 -8.615 15.318 903 HG21 VAL 64 3HG2 VAL 64 -8.308 -9.417 17.254 904 HG22 VAL 64 1HG2 VAL 64 -9.855 -10.238 17.562 905 HG23 VAL 64 2HG2 VAL 64 -8.331 -11.128 17.685 906 H LYS 65 HN LYS 65 -11.810 -13.109 14.743 907 HA LYS 65 HA LYS 65 -11.178 -12.823 11.829 908 HB2 LYS 65 2HB LYS 65 -12.930 -14.872 13.242 909 HB3 LYS 65 3HB LYS 65 -12.814 -14.694 11.489 910 HG2 LYS 65 2HG LYS 65 -10.453 -15.304 11.522 911 HG3 LYS 65 3HG LYS 65 -10.456 -15.359 13.293 912 HD2 LYS 65 2HD LYS 65 -12.169 -17.204 13.185 913 HD3 LYS 65 3HD LYS 65 -12.053 -17.158 11.419 914 HE2 LYS 65 2HE LYS 65 -10.662 -18.960 12.199 915 HE3 LYS 65 3HE LYS 65 -9.605 -17.672 11.601 916 HZ1 LYS 65 3HZ LYS 65 -9.311 -16.967 13.898 917 HZ2 LYS 65 1HZ LYS 65 -8.829 -18.532 13.699 918 HZ3 LYS 65 2HZ LYS 65 -10.265 -18.191 14.431 919 HA PRO 66 HA PRO 66 -14.642 -10.060 12.962 920 HB2 PRO 66 2HB PRO 66 -13.860 -7.784 11.679 921 HB3 PRO 66 3HB PRO 66 -13.056 -8.361 13.168 922 HG2 PRO 66 2HG PRO 66 -12.165 -8.748 10.300 923 HG3 PRO 66 3HG PRO 66 -11.185 -8.199 11.695 924 HD2 PRO 66 2HD PRO 66 -11.263 -10.790 10.813 925 HD3 PRO 66 3HD PRO 66 -11.000 -10.372 12.532 926 H PHE 67 HN PHE 67 -13.562 -11.219 9.844 927 HA PHE 67 HA PHE 67 -15.906 -10.011 8.426 928 HD1 PHE 67 2HD PHE 67 -14.775 -8.535 6.215 929 HD2 PHE 67 1HD PHE 67 -11.752 -10.890 8.176 930 HE1 PHE 67 2HE PHE 67 -13.219 -6.603 6.135 931 HE2 PHE 67 1HE PHE 67 -10.186 -8.970 8.069 932 HZ PHE 67 HZ PHE 67 -10.919 -6.819 7.050 933 HB2 PHE 67 2HB PHE 67 -13.794 -11.949 7.357 934 HB3 PHE 67 3HB PHE 67 -14.936 -10.990 6.427 935 H GLN 68 HN GLN 68 -17.796 -11.110 8.080 936 HA GLN 68 HA GLN 68 -17.809 -14.054 8.696 937 HB2 GLN 68 2HB GLN 68 -18.896 -12.549 10.490 938 HB3 GLN 68 3HB GLN 68 -20.106 -12.141 9.269 939 HG2 GLN 68 2HG GLN 68 -20.246 -14.866 9.107 940 HG3 GLN 68 3HG GLN 68 -19.637 -14.731 10.740 941 HE21 GLN 68 1HE2 GLN 68 -22.388 -14.088 8.558 942 HE22 GLN 68 2HE2 GLN 68 -23.471 -13.702 9.916 943 H CYS 69 HN CYS 69 -18.899 -15.368 7.293 944 HA CYS 69 HA CYS 69 -19.666 -14.392 4.713 945 HB2 CYS 69 2HB CYS 69 -18.988 -16.740 5.116 946 HB3 CYS 69 3HB CYS 69 -20.423 -16.996 6.118 947 H LYS 70 HN LYS 70 -21.757 -14.292 3.746 948 HA LYS 70 HA LYS 70 -23.881 -13.362 5.640 949 HB2 LYS 70 2HB LYS 70 -24.934 -12.411 3.518 950 HB3 LYS 70 3HB LYS 70 -23.425 -11.698 4.037 951 HG2 LYS 70 2HG LYS 70 -23.275 -11.791 1.711 952 HG3 LYS 70 3HG LYS 70 -22.200 -13.045 2.292 953 HD2 LYS 70 2HD LYS 70 -24.153 -14.688 1.816 954 HD3 LYS 70 3HD LYS 70 -24.929 -13.355 0.968 955 HE2 LYS 70 2HE LYS 70 -23.074 -13.213 -0.601 956 HE3 LYS 70 3HE LYS 70 -22.087 -14.297 0.399 957 HZ1 LYS 70 3HZ LYS 70 -24.564 -15.097 -0.970 958 HZ2 LYS 70 1HZ LYS 70 -23.597 -16.058 -0.035 959 HZ3 LYS 70 2HZ LYS 70 -23.030 -15.456 -1.465 960 H THR 71 HN THR 71 -22.889 -16.184 4.364 961 HA THR 71 HA THR 71 -25.649 -17.130 3.647 962 HB THR 71 HB THR 71 -23.522 -18.815 2.575 963 HG1 THR 71 1HG THR 71 -22.289 -16.957 2.465 964 HG21 THR 71 3HG2 THR 71 -24.657 -18.454 0.472 965 HG22 THR 71 1HG2 THR 71 -25.593 -17.115 1.174 966 HG23 THR 71 2HG2 THR 71 -25.832 -18.780 1.758 967 H CYS 72 HN CYS 72 -22.425 -18.550 4.548 968 HA CYS 72 HA CYS 72 -23.872 -20.618 6.127 969 HB2 CYS 72 2HB CYS 72 -21.731 -21.786 6.136 970 HB3 CYS 72 3HB CYS 72 -22.115 -21.289 4.471 971 H GLN 73 HN GLN 73 -22.533 -17.567 6.677 972 HA GLN 73 HA GLN 73 -21.993 -16.398 8.579 973 HB2 GLN 73 2HB GLN 73 -22.730 -18.776 10.305 974 HB3 GLN 73 3HB GLN 73 -22.827 -17.094 10.683 975 HG2 GLN 73 2HG GLN 73 -24.913 -16.839 9.897 976 HG3 GLN 73 3HG GLN 73 -24.644 -17.762 8.434 977 HE21 GLN 73 1HE2 GLN 73 -23.994 -20.332 9.300 978 HE22 GLN 73 2HE2 GLN 73 -25.394 -20.915 10.242 979 H ARG 74 HN ARG 74 -20.045 -18.438 7.286 980 HA ARG 74 HA ARG 74 -18.298 -19.259 9.495 981 HE ARG 74 HE ARG 74 -14.955 -23.033 7.634 982 HB2 ARG 74 2HB ARG 74 -18.441 -20.492 7.319 983 HB3 ARG 74 3HB ARG 74 -17.676 -19.108 6.497 984 HG2 ARG 74 2HG ARG 74 -15.671 -19.401 7.940 985 HG3 ARG 74 3HG ARG 74 -16.503 -20.673 8.852 986 HD2 ARG 74 2HD ARG 74 -16.688 -21.953 6.649 987 HD3 ARG 74 3HD ARG 74 -15.553 -20.791 5.967 988 HH11 ARG 74 1HH1 ARG 74 -13.785 -19.719 7.292 989 HH12 ARG 74 2HH1 ARG 74 -12.196 -20.141 7.876 990 HH21 ARG 74 1HH2 ARG 74 -12.944 -23.470 8.400 991 HH22 ARG 74 2HH2 ARG 74 -11.737 -22.211 8.475 992 H LYS 75 HN LYS 75 -16.763 -18.083 10.449 993 HA LYS 75 HA LYS 75 -16.357 -15.345 9.502 994 HB2 LYS 75 2HB LYS 75 -15.541 -16.838 12.038 995 HB3 LYS 75 3HB LYS 75 -15.054 -15.168 11.681 996 HG2 LYS 75 2HG LYS 75 -17.414 -14.505 11.412 997 HG3 LYS 75 3HG LYS 75 -17.929 -16.141 11.878 998 HD2 LYS 75 2HD LYS 75 -16.868 -15.836 14.095 999 HD3 LYS 75 3HD LYS 75 -16.324 -14.211 13.612 1000 HE2 LYS 75 2HE LYS 75 -18.691 -13.536 13.244 1001 HE3 LYS 75 3HE LYS 75 -19.229 -15.144 13.750 1002 HZ1 LYS 75 3HZ LYS 75 -17.735 -13.231 15.425 1003 HZ2 LYS 75 1HZ LYS 75 -18.237 -14.725 15.903 1004 HZ3 LYS 75 2HZ LYS 75 -19.345 -13.560 15.546 1005 H PHE 76 HN PHE 76 -14.451 -14.405 8.933 1006 HA PHE 76 HA PHE 76 -12.018 -16.113 8.752 1007 HD1 PHE 76 1HD PHE 76 -11.628 -17.654 6.086 1008 HD2 PHE 76 2HD PHE 76 -15.213 -15.247 6.118 1009 HE1 PHE 76 1HE PHE 76 -12.870 -19.470 4.936 1010 HE2 PHE 76 2HE PHE 76 -16.452 -17.078 5.011 1011 HZ PHE 76 HZ PHE 76 -15.284 -19.187 4.412 1012 HB2 PHE 76 2HB PHE 76 -12.997 -14.248 6.549 1013 HB3 PHE 76 3HB PHE 76 -11.539 -15.214 6.517 1014 H SER 77 HN SER 77 -10.027 -14.843 8.586 1015 HA SER 77 HA SER 77 -10.264 -12.326 10.132 1016 HG SER 77 HG SER 77 -6.962 -14.687 9.704 1017 HB2 SER 77 2HB SER 77 -7.758 -12.680 10.408 1018 HB3 SER 77 3HB SER 77 -8.763 -13.970 11.086 1019 H ARG 78 HN ARG 78 -10.166 -13.112 6.910 1020 HA ARG 78 HA ARG 78 -8.770 -10.562 6.232 1021 HE ARG 78 HE ARG 78 -6.033 -12.665 3.295 1022 HB2 ARG 78 2HB ARG 78 -8.267 -13.345 5.149 1023 HB3 ARG 78 3HB ARG 78 -8.007 -11.940 4.109 1024 HG2 ARG 78 2HG ARG 78 -6.450 -10.958 5.666 1025 HG3 ARG 78 3HG ARG 78 -6.809 -12.163 6.901 1026 HD2 ARG 78 2HD ARG 78 -4.670 -12.621 5.956 1027 HD3 ARG 78 3HD ARG 78 -5.791 -13.928 5.601 1028 HH11 ARG 78 2HH1 ARG 78 -2.999 -13.097 5.036 1029 HH12 ARG 78 1HH1 ARG 78 -2.112 -13.197 3.511 1030 HH21 ARG 78 2HH2 ARG 78 -4.891 -12.851 1.528 1031 HH22 ARG 78 1HH2 ARG 78 -3.150 -13.133 1.543 1032 H SER 79 HN SER 79 -9.760 -9.328 4.751 1033 HA SER 79 HA SER 79 -12.481 -9.889 3.968 1034 HG SER 79 HG SER 79 -10.133 -6.739 2.873 1035 HB2 SER 79 2HB SER 79 -12.126 -7.834 2.507 1036 HB3 SER 79 3HB SER 79 -11.805 -7.590 4.231 1037 H ASP 80 HN ASP 80 -9.304 -10.028 2.322 1038 HA ASP 80 HA ASP 80 -10.298 -10.612 -0.267 1039 HB2 ASP 80 2HB ASP 80 -7.973 -11.484 -0.680 1040 HB3 ASP 80 3HB ASP 80 -8.084 -9.870 0.040 1041 H HIS 81 HN HIS 81 -9.244 -12.925 2.375 1042 HA HIS 81 HA HIS 81 -9.934 -15.324 1.002 1043 HD1 HIS 81 1HD HIS 81 -7.428 -15.275 1.357 1044 HD2 HIS 81 2HD HIS 81 -8.155 -16.033 5.428 1045 HE1 HIS 81 1HE HIS 81 -5.234 -15.788 2.346 1046 HB2 HIS 81 2HB HIS 81 -10.049 -14.645 3.980 1047 HB3 HIS 81 3HB HIS 81 -10.251 -16.255 3.328 1048 H LEU 82 HN LEU 82 -11.947 -13.136 3.079 1049 HA LEU 82 HA LEU 82 -14.275 -14.798 3.057 1050 HG LEU 82 HG LEU 82 -16.325 -13.687 3.394 1051 HB2 LEU 82 2HB LEU 82 -13.973 -12.962 4.642 1052 HB3 LEU 82 3HB LEU 82 -14.039 -11.756 3.357 1053 HD11 LEU 82 1HD1 LEU 82 -16.666 -11.550 5.430 1054 HD12 LEU 82 2HD1 LEU 82 -15.838 -13.083 5.895 1055 HD13 LEU 82 3HD1 LEU 82 -17.448 -13.097 5.183 1056 HD21 LEU 82 3HD2 LEU 82 -17.683 -11.663 3.023 1057 HD22 LEU 82 1HD2 LEU 82 -16.365 -11.730 1.859 1058 HD23 LEU 82 2HD2 LEU 82 -16.249 -10.639 3.250 1059 H LYS 83 HN LYS 83 -13.315 -12.034 0.930 1060 HA LYS 83 HA LYS 83 -15.621 -12.153 -0.796 1061 HB2 LYS 83 2HB LYS 83 -13.979 -10.260 -0.672 1062 HB3 LYS 83 3HB LYS 83 -12.763 -11.269 -1.473 1063 HG2 LYS 83 2HG LYS 83 -14.196 -11.443 -3.477 1064 HG3 LYS 83 3HG LYS 83 -15.497 -10.571 -2.646 1065 HD2 LYS 83 2HD LYS 83 -14.046 -8.555 -2.515 1066 HD3 LYS 83 3HD LYS 83 -12.759 -9.437 -3.377 1067 HE2 LYS 83 2HE LYS 83 -14.305 -9.793 -5.293 1068 HE3 LYS 83 3HE LYS 83 -15.579 -8.916 -4.428 1069 HZ1 LYS 83 3HZ LYS 83 -14.470 -7.493 -5.982 1070 HZ2 LYS 83 1HZ LYS 83 -13.002 -7.795 -5.300 1071 HZ3 LYS 83 2HZ LYS 83 -14.154 -6.965 -4.454 1072 H THR 84 HN THR 84 -12.520 -13.918 -0.736 1073 HA THR 84 HA THR 84 -12.830 -15.238 -3.279 1074 HB THR 84 HB THR 84 -11.320 -15.964 -0.744 1075 HG1 THR 84 1HG THR 84 -10.533 -14.192 -1.632 1076 HG21 THR 84 3HG2 THR 84 -9.904 -17.423 -1.993 1077 HG22 THR 84 1HG2 THR 84 -11.010 -17.315 -3.406 1078 HG23 THR 84 2HG2 THR 84 -11.540 -18.073 -1.880 1079 H HIS 85 HN HIS 85 -13.559 -16.279 0.105 1080 HA HIS 85 HA HIS 85 -14.786 -18.775 -0.576 1081 HD1 HIS 85 1HD HIS 85 -15.983 -20.636 1.626 1082 HD2 HIS 85 2HD HIS 85 -17.354 -16.775 2.634 1083 HE1 HIS 85 1HE HIS 85 -18.413 -20.882 2.478 1084 HB2 HIS 85 2HB HIS 85 -14.120 -18.478 1.685 1085 HB3 HIS 85 3HB HIS 85 -14.903 -16.909 1.809 1086 H THR 86 HN THR 86 -16.015 -15.454 -0.378 1087 HA THR 86 HA THR 86 -18.787 -15.902 -0.470 1088 HB THR 86 HB THR 86 -17.169 -13.732 -1.874 1089 HG1 THR 86 1HG THR 86 -16.939 -13.874 0.420 1090 HG21 THR 86 3HG2 THR 86 -19.094 -12.305 -1.663 1091 HG22 THR 86 1HG2 THR 86 -20.100 -13.697 -1.170 1092 HG23 THR 86 2HG2 THR 86 -19.384 -13.621 -2.807 1093 H ARG 87 HN ARG 87 -16.336 -16.043 -3.102 1094 HA ARG 87 HA ARG 87 -18.220 -16.158 -5.279 1095 HE ARG 87 HE ARG 87 -14.725 -13.335 -7.344 1096 HB2 ARG 87 2HB ARG 87 -15.411 -17.307 -5.072 1097 HB3 ARG 87 3HB ARG 87 -16.351 -17.133 -6.533 1098 HG2 ARG 87 2HG ARG 87 -16.384 -14.637 -6.199 1099 HG3 ARG 87 3HG ARG 87 -15.313 -14.857 -4.812 1100 HD2 ARG 87 2HD ARG 87 -13.592 -15.840 -6.164 1101 HD3 ARG 87 3HD ARG 87 -14.639 -15.885 -7.591 1102 HH11 ARG 87 1HH1 ARG 87 -11.808 -15.268 -6.951 1103 HH12 ARG 87 2HH1 ARG 87 -10.770 -13.844 -7.010 1104 HH21 ARG 87 1HH2 ARG 87 -13.380 -11.670 -7.626 1105 HH22 ARG 87 2HH2 ARG 87 -11.641 -11.860 -7.498 1106 H THR 88 HN THR 88 -16.970 -18.626 -3.006 1107 HA THR 88 HA THR 88 -17.801 -20.949 -4.415 1108 HB THR 88 HB THR 88 -17.778 -20.463 -1.397 1109 HG1 THR 88 1HG THR 88 -15.842 -21.662 -3.076 1110 HG21 THR 88 3HG2 THR 88 -17.342 -22.895 -1.222 1111 HG22 THR 88 1HG2 THR 88 -17.815 -23.055 -2.933 1112 HG23 THR 88 2HG2 THR 88 -18.985 -22.479 -1.729 1113 H HIS 89 HN HIS 89 -19.651 -18.642 -2.403 1114 HA HIS 89 HA HIS 89 -22.102 -20.320 -2.596 1115 HD1 HIS 89 1HD HIS 89 -22.967 -21.158 -0.430 1116 HD2 HIS 89 2HD HIS 89 -20.614 -18.030 1.127 1117 HE1 HIS 89 1HE HIS 89 -22.342 -21.816 1.969 1118 HB2 HIS 89 2HB HIS 89 -21.485 -17.634 -1.297 1119 HB3 HIS 89 3HB HIS 89 -23.109 -18.306 -1.399 1120 H THR 90 HN THR 90 -20.556 -17.528 -4.082 1121 HA THR 90 HA THR 90 -22.982 -16.646 -5.427 1122 HB THR 90 HB THR 90 -20.109 -15.768 -5.918 1123 HG1 THR 90 1HG THR 90 -20.514 -15.611 -3.716 1124 HG21 THR 90 3HG2 THR 90 -21.066 -13.523 -6.293 1125 HG22 THR 90 1HG2 THR 90 -22.699 -14.215 -6.186 1126 HG23 THR 90 2HG2 THR 90 -21.603 -14.679 -7.510 1127 H GLY 91 HN GLY 91 -20.763 -19.123 -6.115 1128 HA2 GLY 91 2HA GLY 91 -20.343 -20.391 -8.014 1129 HA3 GLY 91 3HA GLY 91 -21.768 -19.644 -8.760 1130 H GLU 92 HN GLU 92 -19.354 -17.426 -7.627 1131 HA GLU 92 HA GLU 92 -18.996 -16.419 -10.325 1132 HB2 GLU 92 2HB GLU 92 -19.233 -14.988 -8.310 1133 HB3 GLU 92 3HB GLU 92 -17.701 -15.574 -7.696 1134 HG2 GLU 92 2HG GLU 92 -16.565 -14.578 -9.716 1135 HG3 GLU 92 3HG GLU 92 -18.134 -13.980 -10.263 1136 H LYS 93 HN LYS 93 -17.896 -18.060 -11.475 1137 HA LYS 93 HA LYS 93 -15.029 -18.430 -10.691 1138 HB2 LYS 93 2HB LYS 93 -16.921 -20.243 -12.227 1139 HB3 LYS 93 3HB LYS 93 -15.178 -20.528 -12.109 1140 HG2 LYS 93 2HG LYS 93 -15.306 -20.852 -9.731 1141 HG3 LYS 93 3HG LYS 93 -16.999 -20.322 -9.672 1142 HD2 LYS 93 2HD LYS 93 -17.673 -22.277 -11.013 1143 HD3 LYS 93 3HD LYS 93 -15.979 -22.801 -11.115 1144 HE2 LYS 93 2HE LYS 93 -15.883 -22.967 -8.639 1145 HE3 LYS 93 3HE LYS 93 -17.588 -22.488 -8.549 1146 HZ1 LYS 93 3HZ LYS 93 -16.555 -24.885 -9.922 1147 HZ2 LYS 93 1HZ LYS 93 -18.140 -24.450 -9.818 1148 HZ3 LYS 93 2HZ LYS 93 -17.312 -24.876 -8.459 1149 HA PRO 94 HA PRO 94 -15.074 -16.078 -14.633 1150 HB2 PRO 94 2HB PRO 94 -13.352 -14.070 -13.999 1151 HB3 PRO 94 3HB PRO 94 -15.017 -14.122 -13.343 1152 HG2 PRO 94 2HG PRO 94 -12.458 -15.041 -11.994 1153 HG3 PRO 94 3HG PRO 94 -13.741 -13.988 -11.322 1154 HD2 PRO 94 2HD PRO 94 -13.609 -16.695 -10.872 1155 HD3 PRO 94 3HD PRO 94 -15.158 -15.797 -10.940 1156 H PHE 95 HN PHE 95 -12.481 -17.631 -12.822 1157 HA PHE 95 HA PHE 95 -10.420 -17.080 -14.866 1158 HD1 PHE 95 2HD PHE 95 -8.144 -16.135 -13.523 1159 HD2 PHE 95 1HD PHE 95 -11.103 -17.470 -10.706 1160 HE1 PHE 95 2HE PHE 95 -7.691 -14.140 -12.111 1161 HE2 PHE 95 1HE PHE 95 -10.679 -15.458 -9.305 1162 HZ PHE 95 HZ PHE 95 -8.963 -13.799 -10.002 1163 HB2 PHE 95 2HB PHE 95 -10.370 -18.935 -12.442 1164 HB3 PHE 95 3HB PHE 95 -9.003 -18.491 -13.447 1165 H SER 96 HN SER 96 -11.757 -18.025 -16.665 1166 HA SER 96 HA SER 96 -12.035 -20.939 -16.772 1167 HG SER 96 HG SER 96 -14.524 -19.167 -18.545 1168 HB2 SER 96 2HB SER 96 -12.288 -18.828 -18.947 1169 HB3 SER 96 3HB SER 96 -12.772 -20.533 -19.087 1170 H CYS 97 HN CYS 97 -10.762 -22.435 -17.770 1171 HA CYS 97 HA CYS 97 -8.022 -21.784 -18.275 1172 HB2 CYS 97 2HB CYS 97 -8.950 -24.027 -17.515 1173 HB3 CYS 97 3HB CYS 97 -9.535 -24.262 -19.163 1174 H ARG 98 HN ARG 98 -6.869 -21.484 -20.114 1175 HA ARG 98 HA ARG 98 -8.489 -20.850 -22.531 1176 HE ARG 98 HE ARG 98 -9.503 -19.383 -20.362 1177 HB2 ARG 98 2HB ARG 98 -6.257 -19.547 -21.124 1178 HB3 ARG 98 3HB ARG 98 -5.844 -19.816 -22.798 1179 HG2 ARG 98 2HG ARG 98 -6.783 -17.705 -22.787 1180 HG3 ARG 98 3HG ARG 98 -8.060 -18.717 -23.447 1181 HD2 ARG 98 2HD ARG 98 -7.881 -17.764 -20.547 1182 HD3 ARG 98 3HD ARG 98 -8.807 -16.945 -21.801 1183 HH11 ARG 98 1HH1 ARG 98 -10.432 -17.384 -23.130 1184 HH12 ARG 98 2HH1 ARG 98 -11.932 -18.277 -23.325 1185 HH21 ARG 98 1HH2 ARG 98 -11.165 -20.635 -21.016 1186 HH22 ARG 98 2HH2 ARG 98 -12.392 -20.045 -22.118 1187 H TRP 99 HN TRP 99 -6.963 -23.500 -21.493 1188 HA TRP 99 HA TRP 99 -4.993 -24.069 -23.501 1189 HD1 TRP 99 1HD TRP 99 -4.880 -23.783 -20.276 1190 HE1 TRP 99 1HE TRP 99 -2.532 -24.183 -19.343 1191 HE3 TRP 99 3HE TRP 99 -3.698 -27.998 -22.912 1192 HZ2 TRP 99 2HZ TRP 99 -0.369 -26.059 -19.750 1193 HZ3 TRP 99 3HZ TRP 99 -1.470 -29.063 -22.638 1194 HH2 TRP 99 2HH TRP 99 0.202 -28.098 -21.077 1195 HB2 TRP 99 2HB TRP 99 -6.621 -25.700 -21.546 1196 HB3 TRP 99 3HB TRP 99 -5.758 -26.535 -22.821 1197 HA PRO 100 HA PRO 100 -7.379 -24.799 -27.078 1198 HB2 PRO 100 2HB PRO 100 -5.896 -26.694 -28.441 1199 HB3 PRO 100 3HB PRO 100 -5.343 -25.021 -28.158 1200 HG2 PRO 100 2HG PRO 100 -4.674 -27.491 -26.525 1201 HG3 PRO 100 3HG PRO 100 -3.540 -26.279 -27.211 1202 HD2 PRO 100 2HD PRO 100 -4.358 -26.132 -24.638 1203 HD3 PRO 100 3HD PRO 100 -4.195 -24.643 -25.621 1204 H SER 101 HN SER 101 -7.443 -27.037 -24.625 1205 HA SER 101 HA SER 101 -9.533 -28.645 -25.992 1206 HG SER 101 HG SER 101 -7.858 -30.111 -23.310 1207 HB2 SER 101 2HB SER 101 -8.615 -30.740 -25.316 1208 HB3 SER 101 3HB SER 101 -7.275 -29.862 -26.071 1209 H CYS 102 HN CYS 102 -9.404 -26.441 -23.880 1210 HA CYS 102 HA CYS 102 -11.133 -27.789 -21.903 1211 HB2 CYS 102 2HB CYS 102 -8.832 -28.055 -20.988 1212 HB3 CYS 102 3HB CYS 102 -8.613 -26.295 -21.079 1213 H GLN 103 HN GLN 103 -12.275 -26.303 -20.538 1214 HA GLN 103 HA GLN 103 -11.944 -23.426 -20.950 1215 HB2 GLN 103 2HB GLN 103 -14.531 -24.850 -21.728 1216 HB3 GLN 103 3HB GLN 103 -14.486 -23.140 -21.327 1217 HG2 GLN 103 2HG GLN 103 -13.030 -24.375 -23.679 1218 HG3 GLN 103 3HG GLN 103 -14.540 -23.486 -23.720 1219 HE21 GLN 103 1HE2 GLN 103 -11.047 -23.165 -23.357 1220 HE22 GLN 103 2HE2 GLN 103 -11.054 -21.395 -23.470 1221 H LYS 104 HN LYS 104 -11.716 -25.609 -18.827 1222 HA LYS 104 HA LYS 104 -13.989 -25.462 -17.047 1223 HB2 LYS 104 2HB LYS 104 -11.090 -26.329 -16.664 1224 HB3 LYS 104 3HB LYS 104 -12.291 -26.390 -15.367 1225 HG2 LYS 104 2HG LYS 104 -13.779 -27.796 -16.760 1226 HG3 LYS 104 3HG LYS 104 -12.582 -27.828 -18.053 1227 HD2 LYS 104 2HD LYS 104 -12.117 -28.855 -15.220 1228 HD3 LYS 104 3HD LYS 104 -12.625 -29.875 -16.566 1229 HE2 LYS 104 2HE LYS 104 -10.065 -28.231 -16.609 1230 HE3 LYS 104 3HE LYS 104 -10.147 -29.903 -16.011 1231 HZ1 LYS 104 3HZ LYS 104 -10.680 -28.921 -18.716 1232 HZ2 LYS 104 1HZ LYS 104 -11.026 -30.481 -18.250 1233 HZ3 LYS 104 2HZ LYS 104 -9.472 -29.899 -18.260 1234 H LYS 105 HN LYS 105 -14.459 -24.135 -15.382 1235 HA LYS 105 HA LYS 105 -12.781 -21.694 -15.224 1236 HB2 LYS 105 2HB LYS 105 -14.855 -20.543 -14.642 1237 HB3 LYS 105 3HB LYS 105 -14.949 -21.359 -16.189 1238 HG2 LYS 105 2HG LYS 105 -16.153 -23.290 -14.908 1239 HG3 LYS 105 3HG LYS 105 -16.365 -22.116 -13.614 1240 HD2 LYS 105 2HD LYS 105 -17.329 -21.877 -16.500 1241 HD3 LYS 105 3HD LYS 105 -18.331 -22.219 -15.082 1242 HE2 LYS 105 2HE LYS 105 -17.773 -19.982 -14.150 1243 HE3 LYS 105 3HE LYS 105 -16.771 -19.642 -15.562 1244 HZ1 LYS 105 3HZ LYS 105 -18.950 -18.695 -15.788 1245 HZ2 LYS 105 1HZ LYS 105 -19.672 -20.164 -15.608 1246 HZ3 LYS 105 2HZ LYS 105 -18.738 -19.862 -16.932 1247 H PHE 106 HN PHE 106 -12.014 -20.895 -13.390 1248 HA PHE 106 HA PHE 106 -12.816 -22.252 -10.830 1249 HD1 PHE 106 1HD PHE 106 -10.840 -24.306 -9.982 1250 HD2 PHE 106 2HD PHE 106 -9.753 -22.267 -13.620 1251 HE1 PHE 106 1HE PHE 106 -10.395 -26.485 -11.086 1252 HE2 PHE 106 2HE PHE 106 -9.355 -24.436 -14.733 1253 HZ PHE 106 HZ PHE 106 -9.690 -26.556 -13.470 1254 HB2 PHE 106 2HB PHE 106 -10.115 -21.011 -11.540 1255 HB3 PHE 106 3HB PHE 106 -10.532 -21.831 -10.041 1256 H ALA 107 HN ALA 107 -12.449 -20.865 -8.861 1257 HA ALA 107 HA ALA 107 -13.441 -18.120 -9.467 1258 HB1 ALA 107 1HB ALA 107 -14.186 -18.176 -7.068 1259 HB2 ALA 107 2HB ALA 107 -14.916 -19.457 -8.031 1260 HB3 ALA 107 3HB ALA 107 -13.567 -19.830 -6.932 1261 H ARG 108 HN ARG 108 -10.538 -19.620 -8.871 1262 HA ARG 108 HA ARG 108 -9.445 -17.128 -7.658 1263 HE ARG 108 HE ARG 108 -7.355 -19.875 -4.806 1264 HB2 ARG 108 2HB ARG 108 -8.725 -19.978 -6.901 1265 HB3 ARG 108 3HB ARG 108 -7.826 -18.522 -6.436 1266 HG2 ARG 108 2HG ARG 108 -9.450 -17.744 -5.004 1267 HG3 ARG 108 3HG ARG 108 -10.739 -18.738 -5.700 1268 HD2 ARG 108 2HD ARG 108 -10.016 -19.545 -3.491 1269 HD3 ARG 108 3HD ARG 108 -9.873 -20.748 -4.765 1270 HH11 ARG 108 1HH2 ARG 108 -9.283 -20.412 -1.932 1271 HH12 ARG 108 2HH2 ARG 108 -7.940 -21.137 -1.066 1272 HH21 ARG 108 2HH1 ARG 108 -5.688 -20.768 -3.689 1273 HH22 ARG 108 1HH1 ARG 108 -5.951 -21.340 -2.049 1274 H SER 109 HN SER 109 -7.568 -16.417 -8.509 1275 HA SER 109 HA SER 109 -6.823 -17.212 -11.115 1276 HG SER 109 HG SER 109 -5.691 -14.578 -8.483 1277 HB2 SER 109 2HB SER 109 -4.750 -15.786 -10.608 1278 HB3 SER 109 3HB SER 109 -6.308 -14.983 -10.403 1279 H ASP 110 HN ASP 110 -5.457 -18.061 -7.904 1280 HA ASP 110 HA ASP 110 -3.164 -19.471 -8.986 1281 HB2 ASP 110 2HB ASP 110 -2.704 -20.123 -6.787 1282 HB3 ASP 110 3HB ASP 110 -3.292 -18.476 -6.684 1283 H GLU 111 HN GLU 111 -6.525 -20.380 -8.112 1284 HA GLU 111 HA GLU 111 -6.189 -23.241 -8.257 1285 HB2 GLU 111 2HB GLU 111 -8.565 -21.380 -8.630 1286 HB3 GLU 111 3HB GLU 111 -8.685 -23.082 -9.035 1287 HG2 GLU 111 2HG GLU 111 -8.007 -23.744 -6.782 1288 HG3 GLU 111 3HG GLU 111 -7.910 -22.053 -6.292 1289 H LEU 112 HN LEU 112 -6.958 -20.721 -10.717 1290 HA LEU 112 HA LEU 112 -7.100 -22.560 -12.932 1291 HG LEU 112 HG LEU 112 -5.608 -20.559 -14.942 1292 HB2 LEU 112 2HB LEU 112 -8.014 -20.344 -13.081 1293 HB3 LEU 112 3HB LEU 112 -6.439 -19.584 -12.815 1294 HD11 LEU 112 1HD1 LEU 112 -7.142 -21.566 -16.512 1295 HD12 LEU 112 2HD1 LEU 112 -8.484 -21.504 -15.371 1296 HD13 LEU 112 3HD1 LEU 112 -7.078 -22.571 -15.093 1297 HD21 LEU 112 3HD2 LEU 112 -8.190 -19.065 -15.454 1298 HD22 LEU 112 1HD2 LEU 112 -6.749 -19.141 -16.471 1299 HD23 LEU 112 2HD2 LEU 112 -6.672 -18.298 -14.914 1300 H VAL 113 HN VAL 113 -4.367 -20.638 -11.520 1301 HA VAL 113 HA VAL 113 -2.353 -21.391 -13.395 1302 HB VAL 113 HB VAL 113 -2.150 -20.853 -10.397 1303 HG11 VAL 113 1HG1 VAL 113 -0.138 -22.061 -11.016 1304 HG12 VAL 113 2HG1 VAL 113 0.081 -21.032 -12.448 1305 HG13 VAL 113 3HG1 VAL 113 0.255 -20.357 -10.814 1306 HG21 VAL 113 3HG2 VAL 113 -1.271 -18.978 -12.594 1307 HG22 VAL 113 1HG2 VAL 113 -2.900 -18.918 -11.974 1308 HG23 VAL 113 2HG2 VAL 113 -1.537 -18.628 -10.875 1309 H ARG 114 HN ARG 114 -3.265 -22.940 -10.278 1310 HA ARG 114 HA ARG 114 -1.600 -25.183 -10.456 1311 HE ARG 114 HE ARG 114 -2.149 -25.938 -6.677 1312 HB2 ARG 114 2HB ARG 114 -2.883 -24.643 -8.453 1313 HB3 ARG 114 3HB ARG 114 -4.413 -24.965 -9.273 1314 HG2 ARG 114 2HG ARG 114 -3.853 -27.338 -9.530 1315 HG3 ARG 114 3HG ARG 114 -2.236 -27.067 -8.861 1316 HD2 ARG 114 2HD ARG 114 -4.833 -26.561 -7.348 1317 HD3 ARG 114 3HD ARG 114 -3.922 -28.082 -7.288 1318 HH11 ARG 114 1HH2 ARG 114 -4.885 -27.602 -5.174 1319 HH12 ARG 114 2HH2 ARG 114 -4.263 -27.359 -3.571 1320 HH21 ARG 114 1HH1 ARG 114 -1.455 -25.575 -4.561 1321 HH22 ARG 114 2HH1 ARG 114 -2.502 -26.135 -3.253 1322 H HIS 115 HN HIS 115 -4.989 -24.849 -11.690 1323 HA HIS 115 HA HIS 115 -5.276 -27.415 -12.772 1324 HD1 HIS 115 1HD HIS 115 -7.169 -28.549 -13.932 1325 HD2 HIS 115 2HD HIS 115 -7.109 -25.092 -16.338 1326 HE1 HIS 115 1HE HIS 115 -7.853 -29.258 -16.299 1327 HB2 HIS 115 2HB HIS 115 -7.114 -25.821 -12.699 1328 HB3 HIS 115 3HB HIS 115 -6.315 -24.756 -13.859 1329 H HIS 116 HN HIS 116 -3.948 -24.485 -14.424 1330 HA HIS 116 HA HIS 116 -3.252 -25.747 -16.867 1331 HD1 HIS 116 1HD HIS 116 -4.965 -24.192 -17.753 1332 HD2 HIS 116 2HD HIS 116 -2.489 -21.023 -16.409 1333 HE1 HIS 116 1HE HIS 116 -5.987 -22.083 -18.554 1334 HB2 HIS 116 2HB HIS 116 -1.929 -23.447 -15.374 1335 HB3 HIS 116 3HB HIS 116 -1.516 -23.931 -17.008 1336 H ASN 117 HN ASN 117 -1.552 -25.645 -13.703 1337 HA ASN 117 HA ASN 117 0.973 -26.692 -14.711 1338 HB2 ASN 117 2HB ASN 117 0.399 -25.382 -12.494 1339 HB3 ASN 117 3HB ASN 117 0.028 -26.971 -11.835 1340 HD21 ASN 117 1HD2 ASN 117 2.169 -28.497 -13.097 1341 HD22 ASN 117 2HD2 ASN 117 3.661 -27.815 -12.399 1342 H MET 118 HN MET 118 -2.116 -28.101 -14.047 1343 HA MET 118 HA MET 118 -0.903 -30.845 -13.942 1344 HB2 MET 118 2HB MET 118 -3.620 -29.843 -12.967 1345 HB3 MET 118 3HB MET 118 -3.086 -31.531 -12.922 1346 HG2 MET 118 2HG MET 118 -1.250 -30.960 -11.418 1347 HG3 MET 118 3HG MET 118 -1.686 -29.251 -11.477 1348 HE1 MET 118 3HE MET 118 -2.508 -30.352 -7.798 1349 HE2 MET 118 1HE MET 118 -1.251 -31.089 -8.818 1350 HE3 MET 118 2HE MET 118 -1.496 -29.329 -8.845 1351 H HIS 119 HN HIS 119 -1.940 -28.779 -16.212 1352 HA HIS 119 HA HIS 119 -4.161 -30.179 -17.410 1353 HD1 HIS 119 1HD HIS 119 -4.490 -30.086 -20.360 1354 HD2 HIS 119 2HD HIS 119 -5.504 -26.720 -18.071 1355 HE1 HIS 119 1HE HIS 119 -6.977 -29.526 -20.880 1356 HB2 HIS 119 2HB HIS 119 -3.204 -27.689 -17.650 1357 HB3 HIS 119 3HB HIS 119 -2.396 -28.387 -19.054 Start of MODEL 13 1 H5 DC 124 5H C 124 -3.978 -31.426 -5.107 2 H6 DC 124 6H C 124 -5.914 -31.111 -6.565 3 H5' DC 124 H5' C 124 -8.891 -32.452 -9.846 4 H5'' DC 124 H5" C 124 -7.477 -32.394 -8.768 5 H4' DC 124 H4' C 124 -10.367 -32.438 -7.800 6 H3' DC 124 H3' C 124 -9.068 -30.255 -8.989 7 H2' DC 124 H2' C 124 -7.404 -30.002 -7.407 8 H2'' DC 124 H2" C 124 -8.652 -29.036 -6.588 9 H1' DC 124 H1' C 124 -9.406 -30.850 -5.241 10 H41 DC 124 1H4 C 124 -4.443 -32.265 -1.555 11 H42 DC 124 2H4 C 124 -3.310 -32.019 -2.871 12 H8 DG 125 8H G 125 -9.113 -26.880 -5.685 13 H1 DG 125 1H G 125 -6.414 -29.035 -0.252 14 H5' DG 125 H5' G 125 -12.842 -29.627 -6.386 15 H5'' DG 125 H5" G 125 -13.919 -28.301 -6.867 16 H4' DG 125 H4' G 125 -13.810 -28.550 -4.408 17 H3' DG 125 H3' G 125 -13.413 -26.074 -5.691 18 H2' DG 125 H2' G 125 -11.121 -25.967 -5.323 19 H2'' DG 125 H2" G 125 -11.625 -25.255 -3.761 20 H1' DG 125 H1' G 125 -11.517 -27.364 -2.641 21 H21 DG 125 1H2 G 125 -7.917 -29.286 1.284 22 H22 DG 125 2H2 G 125 -9.621 -28.991 0.970 23 H5 DC 126 5H C 126 -8.019 -23.949 -4.320 24 H6 DC 126 6H C 126 -10.005 -23.544 -2.948 25 H5' DC 126 H5' C 126 -13.576 -26.184 -1.181 26 H5'' DC 126 H5" C 126 -14.605 -24.922 -0.476 27 H4' DC 126 H4' C 126 -12.674 -25.204 0.941 28 H3' DC 126 H3' C 126 -13.288 -22.690 -0.241 29 H2' DC 126 H2' C 126 -11.416 -22.772 -1.674 30 H2'' DC 126 H2" C 126 -10.652 -21.957 -0.273 31 H1' DC 126 H1' C 126 -10.052 -24.150 0.734 32 H41 DC 126 1H4 C 126 -4.987 -25.431 -2.853 33 H42 DC 126 2H4 C 126 -5.779 -24.859 -4.306 34 H8 DG 127 8H G 127 -9.668 -21.682 1.654 35 H1 DG 127 1H G 127 -3.453 -22.962 0.640 36 H5' DG 127 H5' G 127 -12.109 -23.636 3.925 37 H5'' DG 127 H5" G 127 -12.618 -22.583 5.256 38 H4' DG 127 H4' G 127 -10.525 -23.696 5.863 39 H3' DG 127 H3' G 127 -10.737 -20.857 5.787 40 H2' DG 127 H2' G 127 -9.243 -20.518 4.048 41 H2'' DG 127 H2" G 127 -7.997 -20.742 5.311 42 H1' DG 127 H1' G 127 -7.641 -22.997 4.726 43 H21 DG 127 1H2 G 127 -2.468 -23.367 2.544 44 H22 DG 127 2H2 G 127 -3.313 -23.198 4.072 45 H8 DG 128 8H G 128 -7.458 -18.619 4.313 46 H1 DG 128 1H G 128 -2.738 -19.647 0.062 47 H5' DG 128 H5' G 128 -6.725 -21.933 7.578 48 H5'' DG 128 H5" G 128 -6.574 -21.126 9.147 49 H4' DG 128 H4' G 128 -4.533 -20.707 8.043 50 H3' DG 128 H3' G 128 -6.197 -18.490 8.612 51 H2' DG 128 H2' G 128 -6.706 -18.040 6.352 52 H2'' DG 128 H2" G 128 -5.181 -17.092 6.502 53 H1' DG 128 H1' G 128 -3.855 -18.998 5.747 54 H21 DG 128 1H2 G 128 -0.849 -19.906 1.099 55 H22 DG 128 2H2 G 128 -0.767 -20.013 2.846 56 H8 DG 129 8H G 129 -3.464 -16.198 5.604 57 H1 DG 129 1H G 129 -0.999 -16.440 -0.317 58 H5' DG 129 H5' G 129 -1.556 -18.414 8.778 59 H5'' DG 129 H5" G 129 -0.916 -17.335 10.001 60 H4' DG 129 H4' G 129 0.649 -17.349 8.182 61 H3' DG 129 H3' G 129 -0.639 -14.875 8.776 62 H2' DG 129 H2' G 129 -1.933 -14.916 6.846 63 H2'' DG 129 H2" G 129 -0.509 -14.085 6.171 64 H1' DG 129 H1' G 129 0.438 -16.179 5.379 65 H21 DG 129 1H2 G 129 1.166 -16.429 -0.239 66 H22 DG 129 2H2 G 129 2.040 -16.405 1.283 67 H8 DG 130 8H G 130 0.616 -13.543 4.218 68 H1 DG 130 1H G 130 -0.700 -12.815 -2.005 69 H5' DG 130 H5' G 130 2.961 -15.473 5.580 70 H5'' DG 130 H5" G 130 4.065 -14.571 6.632 71 H4' DG 130 H4' G 130 5.065 -14.425 4.562 72 H3' DG 130 H3' G 130 4.153 -12.064 5.759 73 H2' DG 130 H2' G 130 2.352 -11.686 4.352 74 H2'' DG 130 H2" G 130 3.562 -10.964 3.288 75 H1' DG 130 H1' G 130 3.659 -12.843 1.885 76 H21 DG 130 1H2 G 130 1.097 -12.388 -3.156 77 H22 DG 130 2H2 G 130 2.647 -12.139 -2.362 78 H8 DG 131 8H G 131 2.554 -9.409 2.383 79 H1 DG 131 1H G 131 -1.925 -9.396 -2.221 80 H5' DG 131 H5' G 131 5.850 -11.752 1.672 81 H5'' DG 131 H5" G 131 7.341 -10.801 1.796 82 H4' DG 131 H4' G 131 6.602 -10.341 -0.340 83 H3' DG 131 H3' G 131 6.573 -8.204 1.417 84 H2' DG 131 H2' G 131 4.281 -8.157 1.700 85 H2'' DG 131 H2" G 131 4.384 -7.055 0.314 86 H1' DG 131 H1' G 131 3.836 -8.797 -1.258 87 H21 DG 131 1H2 G 131 -1.048 -8.940 -4.159 88 H22 DG 131 2H2 G 131 0.676 -8.640 -4.339 89 H5 DC 132 5H C 132 1.241 -6.494 1.627 90 H6 DC 132 6H C 132 2.799 -5.803 -0.166 91 H5' DC 132 H5' C 132 5.317 -7.665 -2.799 92 H5'' DC 132 H5" C 132 6.380 -6.423 -3.495 93 H4' DC 132 H4' C 132 4.313 -6.248 -4.644 94 H3' DC 132 H3' C 132 5.250 -4.024 -3.116 95 H2' DC 132 H2' C 132 3.570 -4.320 -1.548 96 H2'' DC 132 H2" C 132 2.676 -3.290 -2.640 97 H1' DC 132 H1' C 132 1.624 -5.172 -3.704 98 H41 DC 132 1H4 C 132 -2.380 -6.569 1.023 99 H42 DC 132 2H4 C 132 -1.075 -6.833 2.177 100 H8 DG 133 8H G 133 1.278 -1.974 -3.147 101 H1 DG 133 1H G 133 -4.859 -2.872 -1.549 102 H5' DG 133 H5' G 133 2.672 -3.262 -6.723 103 H5'' DG 133 H5" G 133 3.292 -1.790 -7.495 104 H4' DG 133 H4' G 133 0.993 -2.068 -7.972 105 H3' DG 133 H3' G 133 2.101 0.212 -6.901 106 H2' DG 133 H2' G 133 1.290 -0.080 -4.737 107 H2'' DG 133 H2" G 133 -0.048 0.885 -5.389 108 H1' DG 133 H1' G 133 -1.343 -1.061 -5.901 109 H21 DG 133 1H2 G 133 -6.159 -2.056 -3.091 110 H22 DG 133 2H2 G 133 -5.527 -1.341 -4.556 111 H5' DT 134 H5' T 134 -2.481 -0.101 -7.661 112 H5'' DT 134 H5" T 134 -2.959 1.297 -8.653 113 H4' DT 134 H4' T 134 -4.770 0.964 -7.066 114 H3' DT 134 H3' T 134 -3.064 3.261 -7.185 115 H2' DT 134 H2' T 134 -2.290 3.029 -5.141 116 H2'' DT 134 H2" T 134 -3.731 3.943 -4.716 117 H1' DT 134 H1' T 134 -5.075 1.898 -4.285 118 H3 DT 134 3H T 134 -4.098 0.100 -0.296 119 H71 DT 134 1H7 T 134 0.558 0.614 -1.788 120 H72 DT 134 2H7 T 134 0.456 2.314 -2.292 121 H73 DT 134 3H7 T 134 0.342 1.889 -0.570 122 H6 DT 134 6H T 134 -1.440 2.049 -3.710 123 H5 DC 135 5H C 135 -3.636 4.904 -2.839 124 H6 DC 135 6H C 135 -5.539 5.288 -4.331 125 H5' DC 135 H5' C 135 -7.571 3.556 -7.428 126 H5'' DC 135 H5" C 135 -8.279 5.015 -8.187 127 H4' DC 135 H4' C 135 -9.656 4.280 -6.209 128 H3' DC 135 H3' C 135 -8.669 6.970 -6.501 129 H2' DC 135 H2' C 135 -7.135 6.654 -4.794 130 H2'' DC 135 H2" C 135 -8.440 7.164 -3.784 131 H1' DC 135 H1' C 135 -9.074 4.809 -3.306 132 H41 DC 135 1H4 C 135 -4.195 3.614 0.582 133 H42 DC 135 2H4 C 135 -3.027 4.052 -0.631 134 H5' DT 136 H5' T 136 -10.977 5.201 -2.598 135 H5'' DT 136 H5" T 136 -12.467 6.103 -2.988 136 H4' DT 136 H4' T 136 -12.477 5.941 -0.640 137 H3' DT 136 H3' T 136 -12.346 8.501 -1.853 138 H2' DT 136 H2' T 136 -10.176 9.028 -1.235 139 H2'' DT 136 H2" T 136 -10.785 9.454 0.323 140 H1' DT 136 H1' T 136 -10.271 7.410 1.321 141 H3 DT 136 3H T 136 -5.921 6.656 1.843 142 H71 DT 136 1H7 T 136 -5.203 7.836 -2.797 143 H72 DT 136 2H7 T 136 -6.698 8.712 -3.211 144 H73 DT 136 3H7 T 136 -5.426 9.522 -2.267 145 H6 DT 136 6H T 136 -8.529 8.083 -1.912 146 H8 DG 137 8H G 137 -9.647 10.464 1.715 147 H1 DG 137 1H G 137 -3.805 9.445 4.084 148 H5' DG 137 H5' G 137 -12.088 7.445 2.491 149 H5'' DG 137 H5" G 137 -13.584 8.144 3.114 150 H4' DG 137 H4' G 137 -12.335 7.879 5.017 151 H3' DG 137 H3' G 137 -13.005 10.457 4.235 152 H2' DG 137 H2' G 137 -10.989 11.073 3.326 153 H2'' DG 137 H2" G 137 -10.646 11.570 4.978 154 H1' DG 137 H1' G 137 -9.484 9.581 5.489 155 H21 DG 137 1H2 G 137 -3.901 8.791 6.178 156 H22 DG 137 2H2 G 137 -5.436 8.656 7.023 157 H5 DC 138 5H C 138 -8.641 13.024 4.034 158 H6 DC 138 6H C 138 -9.214 12.264 6.288 159 H5' DC 138 H5' C 138 -10.342 9.230 7.640 160 H5'' DC 138 H5" C 138 -11.298 9.744 9.035 161 H4' DC 138 H4' C 138 -9.094 9.496 9.868 162 H3' DC 138 H3' C 138 -10.375 11.984 9.969 163 H2' DC 138 H2' C 138 -9.279 13.011 8.254 164 H2'' DC 138 H2" C 138 -8.093 13.411 9.468 165 H1' DC 138 H1' C 138 -6.648 11.621 8.918 166 H41 DC 138 1H4 C 138 -5.131 13.241 2.966 167 H42 DC 138 2H4 C 138 -6.817 13.338 2.499 168 H8 DG 139 8H G 139 -6.435 14.548 9.663 169 H1 DG 139 1H G 139 -2.175 15.793 5.045 170 H5' DG 139 H5' G 139 -6.196 11.081 11.252 171 H5'' DG 139 H5" G 139 -6.269 11.423 12.988 172 H4' DG 139 H4' G 139 -3.979 11.491 12.425 173 H3' DG 139 H3' G 139 -5.215 13.727 13.543 174 H2' DG 139 H2' G 139 -5.412 14.955 11.602 175 H2'' DG 139 H2" G 139 -3.809 15.528 12.039 176 H1' DG 139 H1' G 139 -2.706 14.018 10.584 177 H21 DG 139 1H2 G 139 -0.157 15.354 5.719 178 H22 DG 139 2H2 G 139 0.173 14.845 7.370 179 H5 DC 140 5H C 140 -4.177 17.627 10.558 180 H6 DC 140 6H C 140 -2.133 16.844 11.643 181 H5' DC 140 H5' C 140 -0.835 13.438 12.068 182 H5'' DC 140 H5" C 140 0.068 13.705 13.563 183 H4' DC 140 H4' C 140 1.536 14.172 11.729 184 H3' DC 140 H3' C 140 1.187 16.052 13.733 185 H2' DC 140 H2' C 140 -0.316 17.447 12.598 186 H2'' DC 140 H2" C 140 1.196 18.197 12.024 187 H1' DC 140 H1' C 140 1.211 16.988 9.992 188 H41 DC 140 1H4 C 140 -4.106 18.975 7.148 189 H42 DC 140 2H4 C 140 -5.088 18.475 8.510 190 H8 DG 141 8H G 141 -3.484 21.560 0.826 191 H1 DG 141 1H G 141 -1.674 18.835 6.360 192 H5' DG 141 H5' G 141 -0.878 24.561 -0.521 193 H5'' DG 141 H5" G 141 -0.991 24.001 -2.198 194 H4' DG 141 H4' G 141 0.824 22.904 -0.929 195 H3' DG 141 H3' G 141 -0.912 21.432 -2.559 196 H2' DG 141 H2' G 141 -2.196 20.577 -0.843 197 H2'' DG 141 H2" G 141 -0.978 19.297 -0.853 198 H1' DG 141 H1' G 141 0.209 20.273 0.985 199 H21 DG 141 1H2 G 141 0.433 18.304 6.314 200 H22 DG 141 2H2 G 141 1.391 18.471 4.848 201 H5 DC 142 5H C 142 -2.712 17.697 0.428 202 H6 DC 142 6H C 142 -0.355 17.253 -0.024 203 H5' DC 142 H5' C 142 2.037 19.663 0.421 204 H5'' DC 142 H5" C 142 3.265 19.256 -0.753 205 H4' DC 142 H4' C 142 3.915 18.049 1.043 206 H3' DC 142 H3' C 142 3.160 16.650 -1.229 207 H2' DC 142 H2' C 142 1.097 15.979 -0.513 208 H2'' DC 142 H2" C 142 1.916 14.645 0.183 209 H1' DC 142 H1' C 142 1.890 15.520 2.399 210 H41 DC 142 1H4 C 142 -4.213 16.816 3.651 211 H42 DC 142 2H4 C 142 -4.426 17.594 2.096 212 H8 DG 143 8H G 143 1.491 12.994 1.290 213 H1 DG 143 1H G 143 -3.726 12.445 4.973 214 H5' DG 143 H5' G 143 3.903 15.376 3.291 215 H5'' DG 143 H5" G 143 5.480 14.694 2.868 216 H4' DG 143 H4' G 143 4.892 13.589 4.859 217 H3' DG 143 H3' G 143 5.311 12.020 2.612 218 H2' DG 143 H2' G 143 3.094 11.765 1.943 219 H2'' DG 143 H2" G 143 3.114 10.368 2.978 220 H1' DG 143 H1' G 143 2.088 11.482 4.790 221 H21 DG 143 1H2 G 143 -3.197 11.662 6.950 222 H22 DG 143 2H2 G 143 -1.535 11.270 7.368 223 H5 DC 144 5H C 144 0.806 9.701 1.998 224 H6 DC 144 6H C 144 1.781 8.947 4.116 225 H5' DC 144 H5' C 144 3.048 10.978 6.412 226 H5'' DC 144 H5" C 144 4.316 10.004 7.122 227 H4' DC 144 H4' C 144 2.505 9.447 8.350 228 H3' DC 144 H3' C 144 3.687 7.419 6.875 229 H2' DC 144 H2' C 144 2.047 7.135 5.254 230 H2'' DC 144 H2" C 144 1.274 6.135 6.458 231 H1' DC 144 H1' C 144 -0.306 7.769 7.005 232 H41 DC 144 1H4 C 144 -2.816 9.963 1.625 233 H42 DC 144 2H4 C 144 -1.240 10.273 0.932 234 H8 DA 145 8H A 145 -0.268 4.980 5.958 235 H2 DA 145 2H A 145 -6.331 6.246 4.471 236 H5' DA 145 H5' A 145 -0.142 7.357 9.691 237 H5'' DA 145 H5" A 145 0.123 6.000 10.806 238 H4' DA 145 H4' A 145 -2.254 6.255 10.365 239 H3' DA 145 H3' A 145 -0.894 3.812 10.069 240 H2' DA 145 H2' A 145 -0.878 3.937 7.721 241 H2'' DA 145 H2" A 145 -2.421 3.116 7.884 242 H1' DA 145 H1' A 145 -3.674 5.202 7.780 243 H61 DA 145 2H6 A 145 -2.065 5.805 1.581 244 H62 DA 145 1H6 A 145 -3.632 6.320 0.991 245 H8 DG 146 8H G 146 -3.873 1.664 7.239 246 H1 DG 146 1H G 146 -5.755 3.303 1.329 247 H5' DG 146 H5' G 146 -5.249 4.544 9.851 248 H5'' DG 146 H5" G 146 -6.433 4.325 11.099 249 H4' DG 146 H4' G 146 -7.804 3.871 9.512 250 H3' DG 146 H3' G 146 -6.738 1.340 10.289 251 H2' DG 146 H2' G 146 -5.714 0.834 8.373 252 H2'' DG 146 H2" G 146 -7.342 0.414 7.788 253 H1' DG 146 H1' G 146 -7.672 2.490 6.785 254 H21 DG 146 1H2 G 146 -7.919 3.828 1.321 255 H22 DG 146 2H2 G 146 -8.860 3.802 2.788 256 H8 DA 147 8H A 147 -6.860 -1.357 6.422 257 H2 DA 147 2H A 147 -6.554 0.340 0.225 258 H5' DA 147 H5' A 147 -10.218 1.864 7.470 259 H5'' DA 147 H5" A 147 -11.624 0.820 7.738 260 H4' DA 147 H4' A 147 -11.279 1.092 5.350 261 H3' DA 147 H3' A 147 -11.291 -1.463 6.619 262 H2' DA 147 H2' A 147 -9.062 -1.893 6.223 263 H2'' DA 147 H2" A 147 -9.676 -2.468 4.637 264 H1' DA 147 H1' A 147 -9.384 -0.297 3.642 265 H61 DA 147 2H6 A 147 -2.787 -0.581 3.732 266 H62 DA 147 1H6 A 147 -2.546 -0.266 2.023 267 H5 DC 148 5H C 148 -7.063 -3.521 3.245 268 H6 DC 148 6H C 148 -9.362 -3.412 2.409 269 H5' DC 148 H5' C 148 -12.211 -0.760 1.978 270 H5'' DC 148 H5" C 148 -13.723 -1.674 1.811 271 H4' DC 148 H4' C 148 -12.715 -1.635 -0.356 272 H3' DC 148 H3' C 148 -13.203 -4.119 0.817 273 H2' DC 148 H2' C 148 -10.970 -4.404 1.497 274 H2'' DC 148 H2" C 148 -10.885 -5.246 -0.056 275 H1' DC 148 H1' C 148 -10.160 -3.225 -1.245 276 H41 DC 148 1H4 C 148 -4.217 -3.029 0.979 277 H42 DC 148 2H4 C 148 -4.761 -3.286 2.625 278 H8 DG 149 8H G 149 -9.180 -7.039 -1.014 279 H1 DG 149 1H G 149 -2.866 -5.801 -1.106 280 H5' DG 149 H5' G 149 -10.979 -3.558 -3.164 281 H5'' DG 149 H5" G 149 -12.166 -4.340 -4.202 282 H4' DG 149 H4' G 149 -10.143 -4.462 -5.409 283 H3' DG 149 H3' G 149 -11.522 -6.757 -4.607 284 H2' DG 149 H2' G 149 -10.071 -7.371 -2.944 285 H2'' DG 149 H2" G 149 -9.253 -8.246 -4.221 286 H1' DG 149 H1' G 149 -7.631 -6.435 -4.536 287 H21 DG 149 1H2 G 149 -2.192 -5.607 -3.136 288 H22 DG 149 2H2 G 149 -3.317 -5.549 -4.479 289 H5 DC 150 5H C 150 -7.011 -9.623 -1.655 290 H6 DC 150 6H C 150 -7.186 -9.818 -4.071 291 H5' DC 150 H5' C 150 -8.165 -9.086 -5.734 292 H5'' DC 150 H5" C 150 -8.022 -7.422 -6.348 293 H4' DC 150 H4' C 150 -6.713 -8.218 -8.247 294 H3' DC 150 H3' C 150 -7.777 -10.693 -7.753 295 H2' DC 150 H2' C 150 -6.912 -11.059 -5.671 296 H2'' DC 150 H2" C 150 -5.606 -11.753 -6.575 297 H1' DC 150 H1' C 150 -4.168 -9.865 -6.306 298 H41 DC 150 1H4 C 150 -3.743 -9.305 -0.023 299 H42 DC 150 2H4 C 150 -5.485 -9.289 0.190 300 H5 DC 151 5H C 151 -5.162 -12.763 -4.407 301 H6 DC 151 6H C 151 -3.944 -12.806 -6.526 302 H5' DC 151 H5' C 151 -3.490 -10.235 -9.153 303 H5'' DC 151 H5" C 151 -3.263 -11.307 -10.546 304 H4' DC 151 H4' C 151 -1.146 -10.949 -9.469 305 H3' DC 151 H3' C 151 -2.130 -13.485 -10.034 306 H2' DC 151 H2' C 151 -2.738 -13.973 -7.823 307 H2'' DC 151 H2" C 151 -1.108 -14.597 -7.758 308 H1' DC 151 H1' C 151 -0.236 -12.600 -6.709 309 H41 DC 151 1H4 C 151 -3.346 -12.913 -1.232 310 H42 DC 151 2H4 C 151 -4.901 -12.834 -2.029 311 H5 DC 152 5H C 152 -3.112 -15.808 -5.037 312 H6 DC 152 6H C 152 -0.910 -15.869 -6.110 313 H5' DC 152 H5' C 152 1.594 -13.254 -7.452 314 H5'' DC 152 H5" C 152 2.873 -13.941 -8.452 315 H4' DC 152 H4' C 152 3.570 -14.583 -6.363 316 H3' DC 152 H3' C 152 2.571 -16.671 -8.009 317 H2' DC 152 H2' C 152 0.713 -17.130 -6.729 318 H2'' DC 152 H2" C 152 1.845 -18.134 -5.797 319 H1' DC 152 H1' C 152 2.265 -16.402 -4.186 320 H41 DC 152 1H4 C 152 -3.440 -16.215 -1.390 321 H42 DC 152 2H4 C 152 -4.263 -16.006 -2.925 322 H5 DC 153 5H C 153 -1.345 -19.695 -4.711 323 H6 DC 153 6H C 153 1.065 -20.026 -4.477 324 H5' DC 153 H5' C 153 4.643 -17.581 -4.103 325 H5'' DC 153 H5" C 153 5.928 -18.750 -4.449 326 H4' DC 153 H4' C 153 5.195 -19.209 -2.257 327 H3' DC 153 H3' C 153 4.842 -21.178 -4.320 328 H2' DC 153 H2' C 153 2.594 -21.323 -4.123 329 H2'' DC 153 H2" C 153 2.940 -22.327 -2.718 330 H1' DC 153 H1' C 153 2.726 -20.484 -1.159 331 H41 DC 153 1H4 C 153 -3.472 -19.111 -1.779 332 H42 DC 153 2H4 C 153 -3.436 -19.539 -3.478 333 H5 DC 154 5H C 154 -0.143 -22.823 -3.115 334 H6 DC 154 6H C 154 1.687 -23.411 -1.593 335 H5' DC 154 H5' C 154 4.616 -21.794 0.085 336 H5'' DC 154 H5" C 154 5.743 -23.073 0.554 337 H4' DC 154 H4' C 154 4.038 -23.005 2.210 338 H3' DC 154 H3' C 154 4.468 -25.333 0.614 339 H2' DC 154 H2' C 154 2.395 -25.379 -0.359 340 H2'' DC 154 H2" C 154 1.889 -26.071 1.212 341 H1' DC 154 H1' C 154 1.139 -24.000 2.046 342 H41 DC 154 1H4 C 154 -3.621 -22.728 -1.897 343 H42 DC 154 2H4 C 154 -2.531 -22.452 -3.242 344 H8 DG 155 8H G 155 0.540 -27.591 0.937 345 H1 DG 155 1H G 155 -5.520 -25.816 -0.307 346 H5' DG 155 H5' G 155 2.307 -25.525 4.578 347 H5'' DG 155 H5" G 155 2.777 -26.912 5.592 348 H4' DG 155 H4' G 155 0.379 -26.490 5.850 349 H3' DG 155 H3' G 155 1.433 -28.994 5.004 350 H2' DG 155 H2' G 155 0.495 -28.931 2.876 351 H2'' DG 155 H2" G 155 -0.930 -29.565 3.754 352 H1' DG 155 H1' G 155 -1.868 -27.366 4.023 353 H21 DG 155 1H2 G 155 -6.721 -25.872 1.493 354 H22 DG 155 2H2 G 155 -6.029 -26.301 3.051 355 H5 DC 156 5H C 156 -1.584 -30.550 1.119 356 H6 DC 156 6H C 156 -2.466 -30.951 3.371 357 H5' DC 156 H5' C 156 -2.680 -28.760 6.982 358 H5'' DC 156 H5" C 156 -3.020 -30.078 8.117 359 H4' DC 156 H4' C 156 -5.082 -29.411 6.985 360 H3' DC 156 H3' C 156 -4.016 -32.055 6.969 361 H2' DC 156 H2' C 156 -3.651 -32.151 4.707 362 H2'' DC 156 H2" C 156 -5.396 -32.512 4.688 363 H1' DC 156 H1' C 156 -6.041 -30.280 4.279 364 H41 DC 156 1H4 C 156 -3.810 -29.371 -1.573 365 H42 DC 156 2H4 C 156 -2.170 -29.769 -1.104 366 H8 DG 157 8H G 157 -6.408 -34.825 4.658 367 H1 DG 157 1H G 157 -6.880 -32.266 -1.189 368 H5' DG 157 H5' G 157 -8.692 -31.525 7.262 369 H5'' DG 157 H5" G 157 -9.498 -32.725 8.294 370 H4' DG 157 H4' G 157 -10.771 -32.337 6.210 371 H3' DG 157 H3' G 157 -10.190 -34.903 7.076 372 H2' DG 157 H2' G 157 -8.314 -35.246 5.661 373 H2'' DG 157 H2" G 157 -9.617 -35.910 4.609 374 H1' DG 157 H1' G 157 -9.968 -33.802 3.534 375 H21 DG 157 1H2 G 157 -8.961 -31.764 -1.601 376 H22 DG 157 2H2 G 157 -10.205 -31.919 -0.377 377 HA ALA 1 HA ALA 1 8.504 16.961 -21.083 378 H1 ALA 1 HN ALA 1 9.567 19.748 -21.017 379 HB1 ALA 1 1HB ALA 1 10.893 16.304 -20.957 380 HB2 ALA 1 2HB ALA 1 10.587 17.376 -22.338 381 HB3 ALA 1 3HB ALA 1 11.366 18.018 -20.877 382 H SER 2 HN SER 2 10.231 19.311 -18.968 383 HA SER 2 HA SER 2 8.939 18.154 -16.590 384 HG SER 2 HG SER 2 9.972 16.266 -17.432 385 HB2 SER 2 2HB SER 2 11.933 17.882 -17.061 386 HB3 SER 2 3HB SER 2 11.196 17.785 -15.444 387 H GLU 3 HN GLU 3 9.825 20.786 -18.283 388 HA GLU 3 HA GLU 3 10.999 22.468 -16.228 389 HB2 GLU 3 2HB GLU 3 9.513 23.301 -18.770 390 HB3 GLU 3 3HB GLU 3 10.586 24.285 -17.782 391 HG2 GLU 3 2HG GLU 3 12.092 23.748 -19.375 392 HG3 GLU 3 3HG GLU 3 12.339 22.318 -18.379 393 H LYS 4 HN LYS 4 7.700 22.211 -17.680 394 HA LYS 4 HA LYS 4 6.557 24.091 -15.752 395 HB2 LYS 4 2HB LYS 4 5.802 23.767 -18.154 396 HB3 LYS 4 3HB LYS 4 5.116 22.215 -17.696 397 HG2 LYS 4 2HG LYS 4 3.632 23.450 -16.039 398 HG3 LYS 4 3HG LYS 4 4.341 24.970 -16.612 399 HD2 LYS 4 2HD LYS 4 3.523 24.458 -18.918 400 HD3 LYS 4 3HD LYS 4 2.798 22.953 -18.311 401 HE2 LYS 4 2HE LYS 4 1.385 24.274 -16.756 402 HE3 LYS 4 3HE LYS 4 2.090 25.774 -17.389 403 HZ1 LYS 4 3HZ LYS 4 0.552 23.807 -18.958 404 HZ2 LYS 4 1HZ LYS 4 1.200 25.202 -19.548 405 HZ3 LYS 4 2HZ LYS 4 -0.008 25.262 -18.432 406 H ARG 5 HN ARG 5 7.527 22.667 -13.933 407 HA ARG 5 HA ARG 5 5.400 20.769 -13.003 408 HE ARG 5 HE ARG 5 6.865 16.849 -16.008 409 HB2 ARG 5 2HB ARG 5 8.397 20.290 -12.795 410 HB3 ARG 5 3HB ARG 5 7.106 19.231 -12.215 411 HG2 ARG 5 2HG ARG 5 7.622 19.868 -15.136 412 HG3 ARG 5 3HG ARG 5 8.319 18.500 -14.268 413 HD2 ARG 5 2HD ARG 5 6.148 17.536 -13.867 414 HD3 ARG 5 3HD ARG 5 5.346 18.948 -14.556 415 HH11 ARG 5 1HH2 ARG 5 4.967 19.844 -16.377 416 HH12 ARG 5 2HH2 ARG 5 4.741 19.517 -18.084 417 HH21 ARG 5 1HH1 ARG 5 6.781 16.769 -18.209 418 HH22 ARG 5 2HH1 ARG 5 5.704 17.844 -19.074 419 HA PRO 6 HA PRO 6 6.456 23.882 -9.752 420 HB2 PRO 6 2HB PRO 6 3.899 24.435 -8.915 421 HB3 PRO 6 3HB PRO 6 4.612 25.131 -10.399 422 HG2 PRO 6 2HG PRO 6 2.782 22.727 -10.172 423 HG3 PRO 6 3HG PRO 6 2.648 24.116 -11.294 424 HD2 PRO 6 2HD PRO 6 3.798 21.746 -12.006 425 HD3 PRO 6 3HD PRO 6 4.389 23.304 -12.654 426 H PHE 7 HN PHE 7 4.868 20.789 -9.722 427 HA PHE 7 HA PHE 7 4.953 20.662 -6.713 428 HD1 PHE 7 1HD PHE 7 2.323 19.763 -5.556 429 HD2 PHE 7 2HD PHE 7 2.231 20.346 -9.798 430 HE1 PHE 7 1HE PHE 7 0.156 20.962 -5.325 431 HE2 PHE 7 2HE PHE 7 0.068 21.559 -9.592 432 HZ PHE 7 HZ PHE 7 -0.945 21.914 -7.355 433 HB2 PHE 7 2HB PHE 7 3.772 18.728 -8.756 434 HB3 PHE 7 3HB PHE 7 3.777 18.501 -7.018 435 H MET 8 HN MET 8 6.426 19.364 -5.650 436 HA MET 8 HA MET 8 7.808 17.272 -7.285 437 HB2 MET 8 2HB MET 8 9.926 17.695 -6.273 438 HB3 MET 8 3HB MET 8 9.351 19.190 -6.999 439 HG2 MET 8 2HG MET 8 8.680 20.038 -4.786 440 HG3 MET 8 3HG MET 8 9.225 18.540 -4.024 441 HE1 MET 8 3HE MET 8 11.977 17.780 -5.335 442 HE2 MET 8 1HE MET 8 13.077 18.659 -4.253 443 HE3 MET 8 2HE MET 8 11.645 17.843 -3.591 444 H CYS 9 HN CYS 9 8.478 15.425 -6.243 445 HA CYS 9 HA CYS 9 7.002 14.676 -3.826 446 HB2 CYS 9 2HB CYS 9 7.550 13.034 -5.609 447 HB3 CYS 9 3HB CYS 9 9.272 13.282 -5.334 448 H ALA 10 HN ALA 10 8.271 13.705 -1.935 449 HA ALA 10 HA ALA 10 10.713 15.327 -1.330 450 HB1 ALA 10 1HB ALA 10 8.663 16.212 -0.143 451 HB2 ALA 10 2HB ALA 10 8.535 14.638 0.682 452 HB3 ALA 10 3HB ALA 10 9.956 15.661 0.943 453 H TYR 11 HN TYR 11 9.463 12.247 -1.837 454 HA TYR 11 HA TYR 11 10.772 10.779 0.279 455 HD1 TYR 11 1HD TYR 11 9.820 8.755 1.073 456 HD2 TYR 11 2HD TYR 11 11.262 7.850 -2.874 457 HE1 TYR 11 1HE TYR 11 11.128 6.890 1.966 458 HE2 TYR 11 2HE TYR 11 12.326 5.760 -2.011 459 HH TYR 11 HH TYR 11 12.303 4.941 1.458 460 HB2 TYR 11 2HB TYR 11 8.922 9.899 -1.150 461 HB3 TYR 11 3HB TYR 11 10.046 9.859 -2.515 462 HA PRO 12 HA PRO 12 14.955 11.680 -0.865 463 HB2 PRO 12 2HB PRO 12 15.389 8.967 0.431 464 HB3 PRO 12 3HB PRO 12 16.332 10.471 0.651 465 HG2 PRO 12 2HG PRO 12 14.507 9.762 2.503 466 HG3 PRO 12 3HG PRO 12 14.578 11.467 1.945 467 HD2 PRO 12 2HD PRO 12 12.631 9.306 1.154 468 HD3 PRO 12 3HD PRO 12 12.358 11.052 1.483 469 H GLY 13 HN GLY 13 13.443 8.568 -1.738 470 HA2 GLY 13 2HA GLY 13 15.637 7.855 -3.601 471 HA3 GLY 13 3HA GLY 13 14.183 6.903 -3.258 472 H CYS 14 HN CYS 14 13.073 9.991 -3.739 473 HA CYS 14 HA CYS 14 12.756 9.622 -6.695 474 HB2 CYS 14 2HB CYS 14 10.729 8.857 -5.646 475 HB3 CYS 14 3HB CYS 14 10.666 10.261 -4.578 476 H ASN 15 HN ASN 15 11.282 12.103 -4.603 477 HA ASN 15 HA ASN 15 11.506 14.395 -4.512 478 HB2 ASN 15 2HB ASN 15 14.309 14.318 -5.639 479 HB3 ASN 15 3HB ASN 15 13.639 15.338 -4.391 480 HD21 ASN 15 1HD2 ASN 15 15.018 12.233 -5.139 481 HD22 ASN 15 2HD2 ASN 15 15.480 11.783 -3.484 482 H LYS 16 HN LYS 16 10.692 12.963 -7.105 483 HA LYS 16 HA LYS 16 11.769 14.646 -9.266 484 HB2 LYS 16 2HB LYS 16 10.107 12.181 -9.058 485 HB3 LYS 16 3HB LYS 16 9.556 13.261 -10.292 486 HG2 LYS 16 2HG LYS 16 11.068 11.770 -11.325 487 HG3 LYS 16 3HG LYS 16 11.804 13.364 -11.302 488 HD2 LYS 16 2HD LYS 16 13.468 11.640 -10.802 489 HD3 LYS 16 3HD LYS 16 13.253 12.709 -9.416 490 HE2 LYS 16 2HE LYS 16 13.422 10.418 -8.648 491 HE3 LYS 16 3HE LYS 16 11.812 11.045 -8.326 492 HZ1 LYS 16 3HZ LYS 16 12.522 9.256 -10.553 493 HZ2 LYS 16 1HZ LYS 16 11.020 9.887 -10.269 494 HZ3 LYS 16 2HZ LYS 16 11.686 8.853 -9.183 495 H ARG 17 HN ARG 17 10.206 15.663 -10.842 496 HA ARG 17 HA ARG 17 8.388 17.344 -9.200 497 HE ARG 17 HE ARG 17 9.741 21.078 -10.651 498 HB2 ARG 17 2HB ARG 17 9.766 17.971 -11.853 499 HB3 ARG 17 3HB ARG 17 8.770 19.063 -10.866 500 HG2 ARG 17 2HG ARG 17 10.372 19.126 -9.092 501 HG3 ARG 17 3HG ARG 17 11.381 17.899 -9.871 502 HD2 ARG 17 2HD ARG 17 12.297 20.160 -10.203 503 HD3 ARG 17 3HD ARG 17 11.863 19.378 -11.732 504 HH11 ARG 17 2HH1 ARG 17 12.551 21.129 -12.792 505 HH12 ARG 17 1HH1 ARG 17 11.847 22.427 -13.741 506 HH21 ARG 17 1HH2 ARG 17 9.000 22.625 -11.835 507 HH22 ARG 17 2HH2 ARG 17 9.809 23.192 -13.306 508 H TYR 18 HN TYR 18 6.305 17.538 -9.647 509 HA TYR 18 HA TYR 18 5.191 16.183 -12.064 510 HD1 TYR 18 2HD TYR 18 6.169 15.235 -8.420 511 HD2 TYR 18 1HD TYR 18 3.270 13.602 -11.174 512 HE1 TYR 18 2HE TYR 18 7.078 12.964 -8.062 513 HE2 TYR 18 1HE TYR 18 4.294 11.373 -10.920 514 HH TYR 18 HH TYR 18 6.939 10.761 -8.664 515 HB2 TYR 18 2HB TYR 18 4.145 16.556 -9.247 516 HB3 TYR 18 3HB TYR 18 3.164 15.934 -10.546 517 H PHE 19 HN PHE 19 2.949 17.027 -12.657 518 HA PHE 19 HA PHE 19 2.890 20.021 -12.412 519 HD1 PHE 19 1HD PHE 19 2.519 21.859 -13.948 520 HD2 PHE 19 2HD PHE 19 0.100 18.855 -15.875 521 HE1 PHE 19 1HE PHE 19 0.941 23.613 -14.695 522 HE2 PHE 19 2HE PHE 19 -1.449 20.620 -16.669 523 HZ PHE 19 HZ PHE 19 -1.045 22.998 -16.071 524 HB2 PHE 19 2HB PHE 19 3.329 19.336 -14.707 525 HB3 PHE 19 3HB PHE 19 2.009 18.181 -14.679 526 H LYS 20 HN LYS 20 0.750 17.146 -12.918 527 HA LYS 20 HA LYS 20 -1.621 18.624 -12.087 528 HB2 LYS 20 2HB LYS 20 -0.976 15.825 -12.942 529 HB3 LYS 20 3HB LYS 20 -2.497 16.089 -12.039 530 HG2 LYS 20 2HG LYS 20 -3.144 17.807 -13.683 531 HG3 LYS 20 3HG LYS 20 -1.642 17.547 -14.580 532 HD2 LYS 20 2HD LYS 20 -3.769 15.409 -14.098 533 HD3 LYS 20 3HD LYS 20 -3.655 16.407 -15.554 534 HE2 LYS 20 2HE LYS 20 -1.380 15.528 -15.999 535 HE3 LYS 20 3HE LYS 20 -1.493 14.502 -14.560 536 HZ1 LYS 20 3HZ LYS 20 -3.271 14.361 -16.908 537 HZ2 LYS 20 1HZ LYS 20 -3.385 13.408 -15.571 538 HZ3 LYS 20 2HZ LYS 20 -2.066 13.297 -16.551 539 H LEU 21 HN LEU 21 -2.178 19.071 -10.080 540 HA LEU 21 HA LEU 21 -0.815 18.343 -7.730 541 HG LEU 21 HG LEU 21 -2.106 18.669 -5.609 542 HB2 LEU 21 2HB LEU 21 -2.448 20.168 -7.877 543 HB3 LEU 21 3HB LEU 21 -3.776 19.049 -8.084 544 HD11 LEU 21 1HD1 LEU 21 -4.028 21.015 -5.914 545 HD12 LEU 21 2HD1 LEU 21 -2.279 21.118 -5.637 546 HD13 LEU 21 3HD1 LEU 21 -3.318 20.441 -4.386 547 HD21 LEU 21 3HD2 LEU 21 -4.211 17.322 -6.091 548 HD22 LEU 21 1HD2 LEU 21 -5.133 18.826 -6.017 549 HD23 LEU 21 2HD2 LEU 21 -4.278 18.229 -4.581 550 H SER 22 HN SER 22 -3.777 16.805 -9.111 551 HA SER 22 HA SER 22 -4.016 14.765 -7.098 552 HG SER 22 HG SER 22 -5.974 14.994 -10.649 553 HB2 SER 22 2HB SER 22 -5.551 13.695 -8.804 554 HB3 SER 22 3HB SER 22 -5.940 15.370 -8.370 555 H HIS 23 HN HIS 23 -2.099 14.960 -10.025 556 HA HIS 23 HA HIS 23 -1.819 12.021 -10.299 557 HD1 HIS 23 1HD HIS 23 0.679 12.596 -14.009 558 HD2 HIS 23 2HD HIS 23 1.117 15.479 -11.005 559 HE1 HIS 23 1HE HIS 23 2.565 14.160 -14.738 560 HB2 HIS 23 2HB HIS 23 -1.013 12.380 -12.252 561 HB3 HIS 23 3HB HIS 23 -1.653 13.944 -12.173 562 H LEU 24 HN LEU 24 0.050 14.867 -9.165 563 HA LEU 24 HA LEU 24 2.175 13.332 -8.067 564 HG LEU 24 HG LEU 24 3.750 16.298 -6.982 565 HB2 LEU 24 2HB LEU 24 2.200 15.754 -8.489 566 HB3 LEU 24 3HB LEU 24 1.086 16.037 -7.202 567 HD11 LEU 24 1HD1 LEU 24 2.125 17.044 -5.325 568 HD12 LEU 24 2HD1 LEU 24 3.521 16.274 -4.556 569 HD13 LEU 24 3HD1 LEU 24 1.993 15.383 -4.684 570 HD21 LEU 24 3HD2 LEU 24 3.641 13.745 -5.442 571 HD22 LEU 24 1HD2 LEU 24 4.996 14.649 -6.061 572 HD23 LEU 24 2HD2 LEU 24 4.028 13.676 -7.174 573 H GLN 25 HN GLN 25 -0.994 14.310 -6.649 574 HA GLN 25 HA GLN 25 -0.520 13.378 -3.977 575 HB2 GLN 25 2HB GLN 25 -3.082 13.475 -5.647 576 HB3 GLN 25 3HB GLN 25 -3.028 12.948 -3.999 577 HG2 GLN 25 2HG GLN 25 -3.141 15.650 -5.013 578 HG3 GLN 25 3HG GLN 25 -3.577 15.006 -3.453 579 HE21 GLN 25 1HE2 GLN 25 -0.943 16.367 -5.381 580 HE22 GLN 25 2HE2 GLN 25 0.006 16.861 -3.950 581 H MET 26 HN MET 26 -1.866 11.703 -6.872 582 HA MET 26 HA MET 26 -2.126 9.123 -5.720 583 HB2 MET 26 2HB MET 26 -3.007 9.860 -7.933 584 HB3 MET 26 3HB MET 26 -1.380 9.837 -8.606 585 HG2 MET 26 2HG MET 26 -2.576 7.403 -7.273 586 HG3 MET 26 3HG MET 26 -2.979 7.808 -8.941 587 HE1 MET 26 3HE MET 26 -0.640 4.706 -9.316 588 HE2 MET 26 1HE MET 26 -2.271 5.366 -9.558 589 HE3 MET 26 2HE MET 26 -1.692 5.000 -7.909 590 H HIS 27 HN HIS 27 0.666 10.635 -7.461 591 HA HIS 27 HA HIS 27 2.405 8.429 -7.365 592 HD1 HIS 27 1HD HIS 27 5.093 8.240 -7.928 593 HD2 HIS 27 2HD HIS 27 5.041 11.990 -6.000 594 HE1 HIS 27 1HE HIS 27 7.321 8.491 -6.677 595 HB2 HIS 27 2HB HIS 27 3.078 10.310 -8.693 596 HB3 HIS 27 3HB HIS 27 2.914 11.437 -7.340 597 H SER 28 HN SER 28 1.825 10.977 -4.918 598 HA SER 28 HA SER 28 3.948 10.366 -3.191 599 HG SER 28 HG SER 28 2.167 12.640 -4.130 600 HB2 SER 28 2HB SER 28 1.155 11.383 -2.451 601 HB3 SER 28 3HB SER 28 2.636 11.567 -1.493 602 H ARG 29 HN ARG 29 0.733 8.819 -3.539 603 HA ARG 29 HA ARG 29 0.693 7.398 -1.031 604 HE ARG 29 HE ARG 29 -3.456 9.190 -0.797 605 HB2 ARG 29 2HB ARG 29 -0.679 6.955 -3.719 606 HB3 ARG 29 3HB ARG 29 -0.725 5.727 -2.477 607 HG2 ARG 29 2HG ARG 29 -2.696 7.030 -2.189 608 HG3 ARG 29 3HG ARG 29 -1.624 7.363 -0.829 609 HD2 ARG 29 2HD ARG 29 -0.877 9.441 -2.084 610 HD3 ARG 29 3HD ARG 29 -2.179 9.118 -3.248 611 HH11 ARG 29 1HH1 ARG 29 -1.298 11.439 -2.442 612 HH12 ARG 29 2HH1 ARG 29 -1.850 12.819 -1.483 613 HH21 ARG 29 2HH2 ARG 29 -4.144 11.023 0.346 614 HH22 ARG 29 1HH2 ARG 29 -3.405 12.573 0.036 615 H LYS 30 HN LYS 30 2.283 6.755 -4.162 616 HA LYS 30 HA LYS 30 2.791 3.974 -3.827 617 HB2 LYS 30 2HB LYS 30 4.551 6.049 -5.230 618 HB3 LYS 30 3HB LYS 30 4.619 4.308 -5.413 619 HG2 LYS 30 2HG LYS 30 2.155 4.441 -6.191 620 HG3 LYS 30 3HG LYS 30 2.434 6.179 -6.380 621 HD2 LYS 30 2HD LYS 30 4.435 5.632 -7.846 622 HD3 LYS 30 3HD LYS 30 4.038 3.919 -7.670 623 HE2 LYS 30 2HE LYS 30 3.142 4.498 -9.751 624 HE3 LYS 30 3HE LYS 30 1.748 4.453 -8.661 625 HZ1 LYS 30 3HZ LYS 30 1.872 6.840 -8.509 626 HZ2 LYS 30 1HZ LYS 30 1.733 6.389 -10.076 627 HZ3 LYS 30 2HZ LYS 30 3.196 6.887 -9.503 628 H HIS 31 HN HIS 31 4.482 6.830 -2.443 629 HA HIS 31 HA HIS 31 6.856 5.257 -1.733 630 HD1 HIS 31 1HD HIS 31 8.750 5.870 -2.675 631 HD2 HIS 31 2HD HIS 31 6.899 9.632 -3.112 632 HE1 HIS 31 1HE HIS 31 9.803 6.982 -4.713 633 HB2 HIS 31 2HB HIS 31 5.958 8.094 -1.104 634 HB3 HIS 31 3HB HIS 31 7.419 7.382 -0.395 635 H THR 32 HN THR 32 3.823 6.138 -0.062 636 HA THR 32 HA THR 32 4.436 5.612 2.533 637 HB THR 32 HB THR 32 2.151 4.850 2.887 638 HG1 THR 32 1HG THR 32 1.853 4.702 0.050 639 HG21 THR 32 3HG2 THR 32 0.882 6.648 1.857 640 HG22 THR 32 1HG2 THR 32 2.178 6.960 0.681 641 HG23 THR 32 2HG2 THR 32 2.460 7.249 2.406 642 H GLY 33 HN GLY 33 4.768 3.256 0.002 643 HA2 GLY 33 2HA GLY 33 4.634 0.939 1.853 644 HA3 GLY 33 3HA GLY 33 4.930 0.886 0.107 645 H GLU 34 HN GLU 34 6.924 3.300 1.351 646 HA GLU 34 HA GLU 34 9.300 1.690 0.884 647 HB2 GLU 34 2HB GLU 34 10.468 3.703 0.966 648 HB3 GLU 34 3HB GLU 34 8.916 4.209 0.373 649 HG2 GLU 34 2HG GLU 34 9.158 5.811 2.040 650 HG3 GLU 34 3HG GLU 34 8.385 4.597 2.982 651 H LYS 35 HN LYS 35 7.405 2.269 3.717 652 HA LYS 35 HA LYS 35 9.616 2.419 5.621 653 HB2 LYS 35 2HB LYS 35 6.610 2.241 5.885 654 HB3 LYS 35 3HB LYS 35 7.663 2.282 7.302 655 HG2 LYS 35 2HG LYS 35 8.407 4.468 6.902 656 HG3 LYS 35 3HG LYS 35 7.954 4.429 5.199 657 HD2 LYS 35 2HD LYS 35 5.918 4.511 7.442 658 HD3 LYS 35 3HD LYS 35 6.504 5.906 6.507 659 HE2 LYS 35 2HE LYS 35 5.878 4.616 4.391 660 HE3 LYS 35 3HE LYS 35 5.043 3.456 5.429 661 HZ1 LYS 35 3HZ LYS 35 3.550 5.063 4.602 662 HZ2 LYS 35 1HZ LYS 35 4.437 6.322 5.216 663 HZ3 LYS 35 2HZ LYS 35 3.683 5.248 6.230 664 HA PRO 36 HA PRO 36 9.640 -2.061 6.225 665 HB2 PRO 36 2HB PRO 36 12.107 -2.296 7.347 666 HB3 PRO 36 3HB PRO 36 11.897 -1.855 5.627 667 HG2 PRO 36 2HG PRO 36 12.491 -0.010 7.960 668 HG3 PRO 36 3HG PRO 36 13.205 -0.012 6.325 669 HD2 PRO 36 2HD PRO 36 11.070 1.615 7.173 670 HD3 PRO 36 3HD PRO 36 11.462 1.218 5.470 671 H TYR 37 HN TYR 37 8.026 -2.381 7.778 672 HA TYR 37 HA TYR 37 8.644 -1.723 10.645 673 HD1 TYR 37 1HD TYR 37 6.297 -1.625 7.409 674 HD2 TYR 37 2HD TYR 37 5.306 -0.130 11.320 675 HE1 TYR 37 1HE TYR 37 5.405 0.415 6.404 676 HE2 TYR 37 2HE TYR 37 4.292 1.884 10.294 677 HH TYR 37 HH TYR 37 3.870 3.047 8.224 678 HB2 TYR 37 2HB TYR 37 6.124 -3.108 9.670 679 HB3 TYR 37 3HB TYR 37 6.431 -2.166 11.137 680 H GLN 38 HN GLN 38 8.324 -3.478 12.278 681 HA GLN 38 HA GLN 38 8.543 -6.245 11.187 682 HB2 GLN 38 2HB GLN 38 10.208 -6.894 12.701 683 HB3 GLN 38 3HB GLN 38 10.852 -5.525 11.819 684 HG2 GLN 38 2HG GLN 38 10.952 -4.173 13.722 685 HG3 GLN 38 3HG GLN 38 9.655 -5.021 14.564 686 HE21 GLN 38 1HE2 GLN 38 10.058 -7.247 15.451 687 HE22 GLN 38 2HE2 GLN 38 11.751 -7.642 15.809 688 H CYS 39 HN CYS 39 7.690 -7.871 12.520 689 HA CYS 39 HA CYS 39 5.588 -7.102 14.343 690 HB2 CYS 39 2HB CYS 39 5.604 -9.235 13.045 691 HB3 CYS 39 3HB CYS 39 6.962 -9.815 14.029 692 H ASP 40 HN ASP 40 5.453 -7.243 16.603 693 HA ASP 40 HA ASP 40 8.013 -6.911 18.055 694 HB2 ASP 40 2HB ASP 40 6.612 -6.296 19.948 695 HB3 ASP 40 3HB ASP 40 6.099 -5.400 18.521 696 H PHE 41 HN PHE 41 5.603 -9.364 17.402 697 HA PHE 41 HA PHE 41 5.939 -11.003 19.711 698 HD1 PHE 41 1HD PHE 41 3.161 -11.824 19.907 699 HD2 PHE 41 2HD PHE 41 5.322 -14.349 17.172 700 HE1 PHE 41 1HE PHE 41 1.828 -13.782 20.661 701 HE2 PHE 41 2HE PHE 41 4.000 -16.306 17.931 702 HZ PHE 41 HZ PHE 41 2.248 -16.025 19.675 703 HB2 PHE 41 2HB PHE 41 4.206 -11.032 17.780 704 HB3 PHE 41 3HB PHE 41 5.337 -12.002 16.906 705 H LYS 42 HN LYS 42 7.816 -11.862 20.420 706 HA LYS 42 HA LYS 42 10.178 -11.984 18.830 707 HB2 LYS 42 2HB LYS 42 9.512 -13.325 21.485 708 HB3 LYS 42 3HB LYS 42 11.126 -13.257 20.785 709 HG2 LYS 42 2HG LYS 42 9.474 -10.853 21.681 710 HG3 LYS 42 3HG LYS 42 10.856 -11.568 22.496 711 HD2 LYS 42 2HD LYS 42 11.954 -9.857 21.467 712 HD3 LYS 42 3HD LYS 42 12.098 -11.055 20.175 713 HE2 LYS 42 2HE LYS 42 9.986 -10.044 19.149 714 HE3 LYS 42 3HE LYS 42 10.030 -8.816 20.409 715 HZ1 LYS 42 3HZ LYS 42 11.070 -8.027 18.436 716 HZ2 LYS 42 1HZ LYS 42 12.089 -9.312 18.364 717 HZ3 LYS 42 2HZ LYS 42 12.243 -8.203 19.584 718 H ASP 43 HN ASP 43 7.574 -14.253 19.052 719 HA ASP 43 HA ASP 43 9.222 -16.510 18.040 720 HB2 ASP 43 2HB ASP 43 6.237 -16.306 18.585 721 HB3 ASP 43 3HB ASP 43 7.090 -17.774 18.123 722 H CYS 44 HN CYS 44 8.023 -13.727 16.730 723 HA CYS 44 HA CYS 44 7.399 -15.005 14.090 724 HB2 CYS 44 2HB CYS 44 5.514 -13.727 14.905 725 HB3 CYS 44 3HB CYS 44 6.525 -12.330 15.264 726 H GLU 45 HN GLU 45 8.260 -11.605 14.851 727 HA GLU 45 HA GLU 45 10.178 -10.366 14.482 728 HB2 GLU 45 2HB GLU 45 11.294 -12.733 15.232 729 HB3 GLU 45 3HB GLU 45 11.840 -12.707 13.564 730 HG2 GLU 45 2HG GLU 45 13.558 -11.786 14.929 731 HG3 GLU 45 3HG GLU 45 12.877 -10.460 13.997 732 H ARG 46 HN ARG 46 8.149 -11.316 12.380 733 HA ARG 46 HA ARG 46 9.702 -11.301 9.860 734 HE ARG 46 HE ARG 46 6.097 -12.823 7.223 735 HB2 ARG 46 2HB ARG 46 6.698 -11.288 10.443 736 HB3 ARG 46 3HB ARG 46 7.397 -11.261 8.828 737 HG2 ARG 46 2HG ARG 46 8.620 -13.416 9.365 738 HG3 ARG 46 3HG ARG 46 7.702 -13.498 10.866 739 HD2 ARG 46 2HD ARG 46 6.480 -14.831 9.332 740 HD3 ARG 46 3HD ARG 46 5.577 -13.325 9.456 741 HH11 ARG 46 1HH1 ARG 46 8.109 -15.539 8.185 742 HH12 ARG 46 2HH1 ARG 46 8.716 -15.779 6.561 743 HH21 ARG 46 1HH2 ARG 46 6.918 -13.194 5.162 744 HH22 ARG 46 2HH2 ARG 46 8.087 -14.477 4.933 745 H ARG 47 HN ARG 47 8.945 -9.708 8.136 746 HA ARG 47 HA ARG 47 8.661 -7.002 9.369 747 HE ARG 47 HE ARG 47 13.763 -6.943 9.818 748 HB2 ARG 47 2HB ARG 47 10.489 -7.982 7.139 749 HB3 ARG 47 3HB ARG 47 9.985 -6.305 7.233 750 HG2 ARG 47 2HG ARG 47 12.055 -6.324 8.231 751 HG3 ARG 47 3HG ARG 47 10.912 -6.162 9.554 752 HD2 ARG 47 2HD ARG 47 11.252 -8.537 10.152 753 HD3 ARG 47 3HD ARG 47 12.340 -8.743 8.765 754 HH11 ARG 47 1HH1 ARG 47 11.958 -9.055 12.036 755 HH12 ARG 47 2HH1 ARG 47 12.592 -8.166 13.415 756 HH21 ARG 47 1HH2 ARG 47 14.555 -6.008 11.646 757 HH22 ARG 47 2HH2 ARG 47 13.859 -6.462 13.193 758 H PHE 48 HN PHE 48 7.606 -5.399 8.109 759 HA PHE 48 HA PHE 48 6.026 -6.383 5.769 760 HD1 PHE 48 1HD PHE 48 3.210 -7.348 6.012 761 HD2 PHE 48 2HD PHE 48 5.395 -6.827 9.701 762 HE1 PHE 48 1HE PHE 48 2.805 -9.716 6.595 763 HE2 PHE 48 2HE PHE 48 5.007 -9.214 10.265 764 HZ PHE 48 HZ PHE 48 3.819 -10.676 8.647 765 HB2 PHE 48 2HB PHE 48 4.913 -4.899 8.192 766 HB3 PHE 48 3HB PHE 48 4.023 -5.145 6.691 767 H SER 49 HN SER 49 5.079 -4.543 4.512 768 HA SER 49 HA SER 49 7.028 -2.286 4.511 769 HG SER 49 HG SER 49 5.566 -4.464 1.600 770 HB2 SER 49 2HB SER 49 5.995 -2.015 2.107 771 HB3 SER 49 3HB SER 49 7.107 -3.346 2.442 772 H ARG 50 HN ARG 50 3.970 -2.842 5.714 773 HA ARG 50 HA ARG 50 3.416 0.056 5.749 774 HE ARG 50 HE ARG 50 -0.686 -1.593 3.041 775 HB2 ARG 50 2HB ARG 50 1.455 -1.975 4.625 776 HB3 ARG 50 3HB ARG 50 0.966 -0.409 5.279 777 HG2 ARG 50 2HG ARG 50 2.496 0.715 3.616 778 HG3 ARG 50 3HG ARG 50 2.695 -0.866 2.831 779 HD2 ARG 50 2HD ARG 50 0.049 0.587 3.300 780 HD3 ARG 50 3HD ARG 50 0.906 0.517 1.766 781 HH11 ARG 50 1HH1 ARG 50 1.644 -0.915 0.504 782 HH12 ARG 50 2HH1 ARG 50 1.044 -2.258 -0.464 783 HH21 ARG 50 2HH2 ARG 50 -1.249 -3.352 1.741 784 HH22 ARG 50 1HH2 ARG 50 -0.400 -3.598 0.260 785 H SER 51 HN SER 51 2.025 0.701 7.452 786 HA SER 51 HA SER 51 2.208 -0.821 9.862 787 HG SER 51 HG SER 51 0.521 2.728 9.032 788 HB2 SER 51 2HB SER 51 0.415 0.900 10.628 789 HB3 SER 51 3HB SER 51 1.992 1.513 10.105 790 H ASP 52 HN ASP 52 -0.529 -0.258 7.584 791 HA ASP 52 HA ASP 52 -2.454 -1.764 9.005 792 HB2 ASP 52 2HB ASP 52 -3.774 -1.656 7.097 793 HB3 ASP 52 3HB ASP 52 -2.784 -0.204 7.003 794 H GLN 53 HN GLN 53 0.098 -2.824 6.755 795 HA GLN 53 HA GLN 53 -0.947 -5.510 6.419 796 HB2 GLN 53 2HB GLN 53 1.771 -4.231 5.862 797 HB3 GLN 53 3HB GLN 53 1.422 -5.938 5.554 798 HG2 GLN 53 2HG GLN 53 -0.129 -3.592 4.364 799 HG3 GLN 53 3HG GLN 53 1.050 -4.604 3.519 800 HE21 GLN 53 1HE2 GLN 53 -2.323 -4.287 4.241 801 HE22 GLN 53 2HE2 GLN 53 -2.729 -5.942 3.767 802 H LEU 54 HN LEU 54 1.569 -3.996 8.452 803 HA LEU 54 HA LEU 54 2.323 -6.345 9.903 804 HG LEU 54 HG LEU 54 2.432 -4.294 12.759 805 HB2 LEU 54 2HB LEU 54 3.620 -4.328 9.973 806 HB3 LEU 54 3HB LEU 54 2.271 -3.381 10.545 807 HD11 LEU 54 1HD1 LEU 54 4.776 -5.989 11.737 808 HD12 LEU 54 2HD1 LEU 54 3.185 -6.612 12.218 809 HD13 LEU 54 3HD1 LEU 54 4.202 -5.824 13.411 810 HD21 LEU 54 3HD2 LEU 54 5.242 -3.747 11.779 811 HD22 LEU 54 1HD2 LEU 54 4.540 -3.288 13.325 812 HD23 LEU 54 2HD2 LEU 54 4.010 -2.440 11.856 813 H LYS 55 HN LYS 55 -0.253 -3.862 10.449 814 HA LYS 55 HA LYS 55 -1.326 -4.972 12.864 815 HB2 LYS 55 2HB LYS 55 -1.847 -2.730 12.113 816 HB3 LYS 55 3HB LYS 55 -2.610 -3.326 10.645 817 HG2 LYS 55 2HG LYS 55 -4.506 -4.164 11.820 818 HG3 LYS 55 3HG LYS 55 -3.691 -4.032 13.386 819 HD2 LYS 55 2HD LYS 55 -5.388 -2.241 13.031 820 HD3 LYS 55 3HD LYS 55 -3.766 -1.633 13.343 821 HE2 LYS 55 2HE LYS 55 -4.787 -0.280 11.631 822 HE3 LYS 55 3HE LYS 55 -3.441 -1.185 10.932 823 HZ1 LYS 55 3HZ LYS 55 -6.310 -1.832 10.674 824 HZ2 LYS 55 1HZ LYS 55 -5.089 -2.773 10.088 825 HZ3 LYS 55 2HZ LYS 55 -5.329 -1.256 9.490 826 H ARG 56 HN ARG 56 -2.221 -5.536 9.402 827 HA ARG 56 HA ARG 56 -4.322 -7.426 9.871 828 HE ARG 56 HE ARG 56 -2.265 -8.019 5.339 829 HB2 ARG 56 2HB ARG 56 -3.840 -6.326 7.683 830 HB3 ARG 56 3HB ARG 56 -2.356 -7.265 7.523 831 HG2 ARG 56 2HG ARG 56 -3.679 -9.360 7.403 832 HG3 ARG 56 3HG ARG 56 -5.158 -8.443 7.704 833 HD2 ARG 56 2HD ARG 56 -5.131 -8.855 5.380 834 HD3 ARG 56 3HD ARG 56 -4.714 -7.154 5.562 835 HH11 ARG 56 1HH1 ARG 56 -4.911 -9.558 3.448 836 HH12 ARG 56 2HH1 ARG 56 -3.710 -10.134 2.315 837 HH21 ARG 56 1HH2 ARG 56 -1.020 -8.613 3.665 838 HH22 ARG 56 2HH2 ARG 56 -1.649 -9.652 2.408 839 H HIS 57 HN HIS 57 -0.797 -7.852 9.373 840 HA HIS 57 HA HIS 57 -0.731 -10.684 9.549 841 HD1 HIS 57 1HD HIS 57 2.159 -12.198 10.016 842 HD2 HIS 57 2HD HIS 57 2.386 -8.603 12.212 843 HE1 HIS 57 1HE HIS 57 3.584 -12.677 12.081 844 HB2 HIS 57 2HB HIS 57 1.237 -9.801 8.790 845 HB3 HIS 57 3HB HIS 57 1.227 -8.429 9.891 846 H GLN 58 HN GLN 58 -0.573 -8.147 12.089 847 HA GLN 58 HA GLN 58 -0.009 -9.722 14.330 848 HB2 GLN 58 2HB GLN 58 -0.895 -7.070 13.853 849 HB3 GLN 58 3HB GLN 58 -2.109 -7.756 14.928 850 HG2 GLN 58 2HG GLN 58 -0.306 -6.692 16.198 851 HG3 GLN 58 3HG GLN 58 -0.305 -8.432 16.505 852 HE21 GLN 58 1HE2 GLN 58 1.784 -9.319 16.495 853 HE22 GLN 58 2HE2 GLN 58 3.093 -8.750 15.495 854 H ARG 59 HN ARG 59 -3.062 -9.431 12.503 855 HA ARG 59 HA ARG 59 -4.877 -10.444 14.426 856 HE ARG 59 HE ARG 59 -7.060 -10.836 14.989 857 HB2 ARG 59 2HB ARG 59 -5.381 -9.470 12.109 858 HB3 ARG 59 3HB ARG 59 -4.889 -11.024 11.449 859 HG2 ARG 59 2HG ARG 59 -7.128 -11.242 11.399 860 HG3 ARG 59 3HG ARG 59 -6.774 -12.056 12.917 861 HD2 ARG 59 2HD ARG 59 -7.645 -9.140 12.641 862 HD3 ARG 59 3HD ARG 59 -8.755 -10.491 12.921 863 HH11 ARG 59 1HH2 ARG 59 -8.744 -7.914 13.984 864 HH12 ARG 59 2HH2 ARG 59 -8.849 -7.337 15.636 865 HH21 ARG 59 1HH1 ARG 59 -7.209 -10.089 16.935 866 HH22 ARG 59 2HH1 ARG 59 -8.009 -8.560 17.312 867 H ARG 60 HN ARG 60 -2.514 -12.136 12.356 868 HA ARG 60 HA ARG 60 -3.410 -14.838 12.680 869 HE ARG 60 HE ARG 60 0.923 -17.771 12.368 870 HB2 ARG 60 2HB ARG 60 -1.622 -14.213 11.107 871 HB3 ARG 60 3HB ARG 60 -0.602 -13.678 12.451 872 HG2 ARG 60 2HG ARG 60 -0.495 -16.003 13.327 873 HG3 ARG 60 3HG ARG 60 -1.431 -16.543 11.928 874 HD2 ARG 60 2HD ARG 60 0.408 -15.604 10.461 875 HD3 ARG 60 3HD ARG 60 1.285 -15.126 11.912 876 HH11 ARG 60 1HH2 ARG 60 2.264 -16.167 9.495 877 HH12 ARG 60 2HH2 ARG 60 3.359 -17.501 9.216 878 HH21 ARG 60 1HH1 ARG 60 2.302 -19.406 11.864 879 HH22 ARG 60 2HH1 ARG 60 3.353 -19.275 10.476 880 H HIS 61 HN HIS 61 -1.253 -12.795 14.732 881 HA HIS 61 HA HIS 61 -0.692 -14.955 16.599 882 HD1 HIS 61 1HD HIS 61 1.595 -15.299 16.272 883 HD2 HIS 61 2HD HIS 61 1.879 -11.174 15.476 884 HE1 HIS 61 1HE HIS 61 3.666 -14.953 14.807 885 HB2 HIS 61 2HB HIS 61 -0.308 -11.931 16.807 886 HB3 HIS 61 3HB HIS 61 0.275 -13.105 17.991 887 H THR 62 HN THR 62 -3.082 -12.302 16.415 888 HA THR 62 HA THR 62 -4.161 -12.694 19.059 889 HB THR 62 HB THR 62 -5.968 -11.344 18.386 890 HG1 THR 62 1HG THR 62 -5.409 -12.223 15.750 891 HG21 THR 62 3HG2 THR 62 -5.036 -9.379 17.493 892 HG22 THR 62 1HG2 THR 62 -3.824 -10.242 16.564 893 HG23 THR 62 2HG2 THR 62 -3.699 -10.180 18.335 894 H GLY 63 HN GLY 63 -4.426 -14.565 16.133 895 HA2 GLY 63 2HA GLY 63 -5.589 -16.507 15.659 896 HA3 GLY 63 3HA GLY 63 -6.012 -16.585 17.379 897 H VAL 64 HN VAL 64 -7.199 -13.637 16.492 898 HA VAL 64 HA VAL 64 -9.932 -14.605 16.527 899 HB VAL 64 HB VAL 64 -8.871 -11.789 16.033 900 HG11 VAL 64 1HG1 VAL 64 -11.266 -11.982 15.431 901 HG12 VAL 64 2HG1 VAL 64 -11.604 -12.741 17.000 902 HG13 VAL 64 3HG1 VAL 64 -11.072 -11.051 16.907 903 HG21 VAL 64 3HG2 VAL 64 -8.057 -12.575 18.210 904 HG22 VAL 64 1HG2 VAL 64 -9.347 -11.406 18.454 905 HG23 VAL 64 2HG2 VAL 64 -9.679 -13.142 18.643 906 H LYS 65 HN LYS 65 -11.411 -14.797 14.925 907 HA LYS 65 HA LYS 65 -10.608 -13.962 12.161 908 HB2 LYS 65 2HB LYS 65 -12.215 -16.392 13.075 909 HB3 LYS 65 3HB LYS 65 -12.101 -15.855 11.396 910 HG2 LYS 65 2HG LYS 65 -9.620 -16.090 11.501 911 HG3 LYS 65 3HG LYS 65 -9.770 -16.726 13.147 912 HD2 LYS 65 2HD LYS 65 -11.234 -18.564 12.245 913 HD3 LYS 65 3HD LYS 65 -10.906 -17.984 10.605 914 HE2 LYS 65 2HE LYS 65 -8.799 -18.898 12.618 915 HE3 LYS 65 3HE LYS 65 -9.456 -19.902 11.318 916 HZ1 LYS 65 3HZ LYS 65 -7.378 -18.907 10.690 917 HZ2 LYS 65 1HZ LYS 65 -7.967 -17.388 10.942 918 HZ3 LYS 65 2HZ LYS 65 -8.583 -18.324 9.731 919 HA PRO 66 HA PRO 66 -14.329 -11.670 13.537 920 HB2 PRO 66 2HB PRO 66 -13.688 -9.184 12.594 921 HB3 PRO 66 3HB PRO 66 -12.900 -9.897 14.031 922 HG2 PRO 66 2HG PRO 66 -11.865 -9.856 11.178 923 HG3 PRO 66 3HG PRO 66 -10.999 -9.390 12.675 924 HD2 PRO 66 2HD PRO 66 -10.764 -11.861 11.539 925 HD3 PRO 66 3HD PRO 66 -10.701 -11.628 13.309 926 H PHE 67 HN PHE 67 -13.018 -12.083 10.274 927 HA PHE 67 HA PHE 67 -15.290 -10.763 8.935 928 HD1 PHE 67 2HD PHE 67 -14.489 -9.421 6.448 929 HD2 PHE 67 1HD PHE 67 -11.242 -11.024 8.773 930 HE1 PHE 67 2HE PHE 67 -13.287 -7.259 6.269 931 HE2 PHE 67 1HE PHE 67 -10.005 -8.890 8.533 932 HZ PHE 67 HZ PHE 67 -11.037 -6.992 7.289 933 HB2 PHE 67 2HB PHE 67 -12.986 -12.489 7.932 934 HB3 PHE 67 3HB PHE 67 -14.210 -11.883 6.872 935 H GLN 68 HN GLN 68 -16.980 -12.008 10.135 936 HA GLN 68 HA GLN 68 -17.323 -14.809 9.422 937 HB2 GLN 68 2HB GLN 68 -18.014 -13.959 11.595 938 HB3 GLN 68 3HB GLN 68 -19.055 -12.745 10.857 939 HG2 GLN 68 2HG GLN 68 -20.580 -14.499 10.037 940 HG3 GLN 68 3HG GLN 68 -19.498 -15.728 10.716 941 HE21 GLN 68 1HE2 GLN 68 -21.546 -12.883 11.685 942 HE22 GLN 68 2HE2 GLN 68 -21.843 -13.593 13.279 943 H CYS 69 HN CYS 69 -18.422 -15.702 7.796 944 HA CYS 69 HA CYS 69 -19.305 -14.166 5.605 945 HB2 CYS 69 2HB CYS 69 -18.582 -16.476 5.334 946 HB3 CYS 69 3HB CYS 69 -19.884 -17.062 6.368 947 H LYS 70 HN LYS 70 -21.093 -13.019 5.237 948 HA LYS 70 HA LYS 70 -23.367 -12.917 6.913 949 HB2 LYS 70 2HB LYS 70 -24.437 -11.690 4.971 950 HB3 LYS 70 3HB LYS 70 -22.879 -11.089 5.494 951 HG2 LYS 70 2HG LYS 70 -22.790 -10.927 3.181 952 HG3 LYS 70 3HG LYS 70 -21.807 -12.333 3.542 953 HD2 LYS 70 2HD LYS 70 -23.880 -13.749 2.935 954 HD3 LYS 70 3HD LYS 70 -24.615 -12.255 2.355 955 HE2 LYS 70 2HE LYS 70 -22.860 -11.982 0.699 956 HE3 LYS 70 3HE LYS 70 -21.885 -13.261 1.454 957 HZ1 LYS 70 3HZ LYS 70 -23.504 -14.855 0.867 958 HZ2 LYS 70 1HZ LYS 70 -23.044 -14.053 -0.500 959 HZ3 LYS 70 2HZ LYS 70 -24.503 -13.722 0.197 960 H THR 71 HN THR 71 -22.493 -15.457 4.823 961 HA THR 71 HA THR 71 -25.331 -16.223 4.268 962 HB THR 71 HB THR 71 -23.297 -17.978 3.064 963 HG1 THR 71 1HG THR 71 -21.998 -16.230 2.966 964 HG21 THR 71 3HG2 THR 71 -24.520 -17.466 1.033 965 HG22 THR 71 1HG2 THR 71 -25.390 -16.148 1.850 966 HG23 THR 71 2HG2 THR 71 -25.645 -17.838 2.355 967 H CYS 72 HN CYS 72 -22.241 -17.988 5.013 968 HA CYS 72 HA CYS 72 -23.893 -19.963 6.551 969 HB2 CYS 72 2HB CYS 72 -22.157 -21.562 6.027 970 HB3 CYS 72 3HB CYS 72 -22.606 -20.733 4.516 971 H GLN 73 HN GLN 73 -21.996 -17.318 7.188 972 HA GLN 73 HA GLN 73 -21.021 -16.502 9.102 973 HB2 GLN 73 2HB GLN 73 -22.365 -18.954 10.384 974 HB3 GLN 73 3HB GLN 73 -21.394 -17.807 11.275 975 HG2 GLN 73 2HG GLN 73 -23.618 -17.096 11.512 976 HG3 GLN 73 3HG GLN 73 -22.813 -15.925 10.480 977 HE21 GLN 73 1HE2 GLN 73 -23.440 -15.878 8.099 978 HE22 GLN 73 2HE2 GLN 73 -24.984 -16.689 7.709 979 H ARG 74 HN ARG 74 -19.766 -18.946 7.401 980 HA ARG 74 HA ARG 74 -17.599 -19.945 8.863 981 HE ARG 74 HE ARG 74 -15.233 -20.152 7.686 982 HB2 ARG 74 2HB ARG 74 -18.067 -19.222 5.987 983 HB3 ARG 74 3HB ARG 74 -16.429 -19.331 6.463 984 HG2 ARG 74 2HG ARG 74 -18.404 -21.603 6.791 985 HG3 ARG 74 3HG ARG 74 -17.170 -21.438 5.543 986 HD2 ARG 74 2HD ARG 74 -16.836 -22.080 8.465 987 HD3 ARG 74 3HD ARG 74 -16.173 -22.905 7.055 988 HH11 ARG 74 1HH2 ARG 74 -14.267 -23.530 7.554 989 HH12 ARG 74 2HH2 ARG 74 -12.594 -23.110 7.860 990 HH21 ARG 74 1HH1 ARG 74 -13.177 -19.723 8.205 991 HH22 ARG 74 2HH1 ARG 74 -11.990 -20.987 8.085 992 H LYS 75 HN LYS 75 -16.242 -18.879 10.176 993 HA LYS 75 HA LYS 75 -15.753 -16.063 9.794 994 HB2 LYS 75 2HB LYS 75 -14.635 -18.069 11.823 995 HB3 LYS 75 3HB LYS 75 -14.375 -16.333 11.846 996 HG2 LYS 75 2HG LYS 75 -16.131 -16.273 13.227 997 HG3 LYS 75 3HG LYS 75 -17.071 -16.288 11.736 998 HD2 LYS 75 2HD LYS 75 -17.155 -18.848 11.967 999 HD3 LYS 75 3HD LYS 75 -16.435 -18.652 13.568 1000 HE2 LYS 75 2HE LYS 75 -19.039 -17.372 12.616 1001 HE3 LYS 75 3HE LYS 75 -18.944 -18.857 13.568 1002 HZ1 LYS 75 3HZ LYS 75 -17.955 -17.614 15.351 1003 HZ2 LYS 75 1HZ LYS 75 -19.367 -16.878 14.887 1004 HZ3 LYS 75 2HZ LYS 75 -17.931 -16.235 14.440 1005 H PHE 76 HN PHE 76 -13.974 -14.998 9.156 1006 HA PHE 76 HA PHE 76 -11.516 -16.572 8.477 1007 HD1 PHE 76 1HD PHE 76 -11.215 -17.679 6.009 1008 HD2 PHE 76 2HD PHE 76 -14.899 -15.425 6.174 1009 HE1 PHE 76 1HE PHE 76 -12.435 -19.572 4.972 1010 HE2 PHE 76 2HE PHE 76 -16.099 -17.315 5.162 1011 HZ PHE 76 HZ PHE 76 -14.868 -19.415 4.581 1012 HB2 PHE 76 2HB PHE 76 -12.835 -14.393 6.782 1013 HB3 PHE 76 3HB PHE 76 -11.290 -15.158 6.435 1014 H SER 77 HN SER 77 -9.573 -15.167 8.251 1015 HA SER 77 HA SER 77 -9.656 -13.020 10.306 1016 HG SER 77 HG SER 77 -6.421 -15.174 9.016 1017 HB2 SER 77 2HB SER 77 -7.126 -13.282 10.186 1018 HB3 SER 77 3HB SER 77 -7.991 -14.746 10.693 1019 H ARG 78 HN ARG 78 -9.739 -13.336 6.915 1020 HA ARG 78 HA ARG 78 -8.716 -10.551 6.555 1021 HE ARG 78 HE ARG 78 -6.032 -12.741 3.456 1022 HB2 ARG 78 2HB ARG 78 -7.966 -13.050 5.004 1023 HB3 ARG 78 3HB ARG 78 -7.754 -11.436 4.325 1024 HG2 ARG 78 2HG ARG 78 -6.104 -10.822 5.856 1025 HG3 ARG 78 3HG ARG 78 -6.579 -12.022 7.053 1026 HD2 ARG 78 2HD ARG 78 -4.464 -12.584 6.014 1027 HD3 ARG 78 3HD ARG 78 -5.689 -13.832 5.786 1028 HH11 ARG 78 2HH1 ARG 78 -2.885 -12.917 5.009 1029 HH12 ARG 78 1HH1 ARG 78 -2.087 -13.099 3.449 1030 HH21 ARG 78 2HH2 ARG 78 -5.001 -12.958 1.622 1031 HH22 ARG 78 1HH2 ARG 78 -3.248 -13.142 1.534 1032 H SER 79 HN SER 79 -9.628 -9.381 4.852 1033 HA SER 79 HA SER 79 -12.378 -10.033 4.228 1034 HG SER 79 HG SER 79 -10.213 -6.782 3.091 1035 HB2 SER 79 2HB SER 79 -12.199 -7.962 2.789 1036 HB3 SER 79 3HB SER 79 -11.750 -7.716 4.483 1037 H ASP 80 HN ASP 80 -9.290 -10.032 2.366 1038 HA ASP 80 HA ASP 80 -10.387 -10.761 -0.160 1039 HB2 ASP 80 2HB ASP 80 -8.081 -11.558 -0.674 1040 HB3 ASP 80 3HB ASP 80 -8.172 -9.945 0.045 1041 H HIS 81 HN HIS 81 -9.522 -12.748 2.663 1042 HA HIS 81 HA HIS 81 -9.909 -15.371 1.393 1043 HD1 HIS 81 1HD HIS 81 -7.573 -15.286 1.597 1044 HD2 HIS 81 2HD HIS 81 -8.025 -15.908 5.736 1045 HE1 HIS 81 1HE HIS 81 -5.355 -15.888 2.427 1046 HB2 HIS 81 2HB HIS 81 -9.962 -14.453 4.309 1047 HB3 HIS 81 3HB HIS 81 -10.274 -16.105 3.816 1048 H LEU 82 HN LEU 82 -11.977 -13.185 3.423 1049 HA LEU 82 HA LEU 82 -14.289 -14.859 3.377 1050 HG LEU 82 HG LEU 82 -16.354 -13.798 3.875 1051 HB2 LEU 82 2HB LEU 82 -13.951 -12.974 4.890 1052 HB3 LEU 82 3HB LEU 82 -14.107 -11.809 3.580 1053 HD11 LEU 82 1HD1 LEU 82 -16.007 -11.502 5.826 1054 HD12 LEU 82 2HD1 LEU 82 -15.836 -13.272 6.154 1055 HD13 LEU 82 3HD1 LEU 82 -17.386 -12.597 5.701 1056 HD21 LEU 82 3HD2 LEU 82 -17.769 -11.849 3.388 1057 HD22 LEU 82 1HD2 LEU 82 -16.514 -11.978 2.162 1058 HD23 LEU 82 2HD2 LEU 82 -16.358 -10.772 3.453 1059 H LYS 83 HN LYS 83 -13.344 -12.117 1.226 1060 HA LYS 83 HA LYS 83 -15.646 -12.230 -0.494 1061 HB2 LYS 83 2HB LYS 83 -13.933 -10.369 -0.318 1062 HB3 LYS 83 3HB LYS 83 -12.787 -11.380 -1.202 1063 HG2 LYS 83 2HG LYS 83 -14.358 -11.400 -3.154 1064 HG3 LYS 83 3HG LYS 83 -15.478 -10.377 -2.223 1065 HD2 LYS 83 2HD LYS 83 -13.709 -8.638 -2.044 1066 HD3 LYS 83 3HD LYS 83 -12.637 -9.619 -3.055 1067 HE2 LYS 83 2HE LYS 83 -15.383 -8.586 -3.903 1068 HE3 LYS 83 3HE LYS 83 -13.854 -7.778 -4.276 1069 HZ1 LYS 83 3HZ LYS 83 -13.163 -9.721 -5.480 1070 HZ2 LYS 83 1HZ LYS 83 -14.595 -9.177 -6.086 1071 HZ3 LYS 83 2HZ LYS 83 -14.565 -10.510 -5.119 1072 H THR 84 HN THR 84 -12.534 -13.999 -0.482 1073 HA THR 84 HA THR 84 -12.904 -15.320 -3.029 1074 HB THR 84 HB THR 84 -11.307 -15.950 -0.535 1075 HG1 THR 84 1HG THR 84 -10.499 -14.289 -1.471 1076 HG21 THR 84 3HG2 THR 84 -10.931 -17.443 -3.107 1077 HG22 THR 84 1HG2 THR 84 -11.551 -18.129 -1.574 1078 HG23 THR 84 2HG2 THR 84 -9.917 -17.468 -1.619 1079 H HIS 85 HN HIS 85 -13.489 -16.351 0.380 1080 HA HIS 85 HA HIS 85 -14.673 -18.874 -0.229 1081 HD1 HIS 85 1HD HIS 85 -15.929 -20.650 2.211 1082 HD2 HIS 85 2HD HIS 85 -17.193 -16.661 2.789 1083 HE1 HIS 85 1HE HIS 85 -18.379 -20.725 3.073 1084 HB2 HIS 85 2HB HIS 85 -14.011 -18.593 2.005 1085 HB3 HIS 85 3HB HIS 85 -14.701 -16.982 2.124 1086 H THR 86 HN THR 86 -15.986 -15.590 -0.121 1087 HA THR 86 HA THR 86 -18.746 -16.087 -0.073 1088 HB THR 86 HB THR 86 -17.253 -13.982 -1.674 1089 HG1 THR 86 1HG THR 86 -16.901 -14.034 0.655 1090 HG21 THR 86 3HG2 THR 86 -20.118 -13.923 -0.724 1091 HG22 THR 86 1HG2 THR 86 -19.544 -13.897 -2.420 1092 HG23 THR 86 2HG2 THR 86 -19.154 -12.548 -1.335 1093 H ARG 87 HN ARG 87 -16.431 -16.341 -2.817 1094 HA ARG 87 HA ARG 87 -18.388 -16.551 -4.917 1095 HE ARG 87 HE ARG 87 -16.096 -13.841 -3.809 1096 HB2 ARG 87 2HB ARG 87 -15.620 -17.808 -4.841 1097 HB3 ARG 87 3HB ARG 87 -16.586 -17.451 -6.261 1098 HG2 ARG 87 2HG ARG 87 -15.074 -15.523 -4.500 1099 HG3 ARG 87 3HG ARG 87 -14.890 -15.847 -6.208 1100 HD2 ARG 87 2HD ARG 87 -16.071 -13.987 -6.582 1101 HD3 ARG 87 3HD ARG 87 -17.514 -14.886 -6.085 1102 HH11 ARG 87 1HH2 ARG 87 -18.193 -12.538 -6.380 1103 HH12 ARG 87 2HH2 ARG 87 -18.759 -11.276 -5.310 1104 HH21 ARG 87 1HH1 ARG 87 -16.803 -12.232 -2.646 1105 HH22 ARG 87 2HH1 ARG 87 -17.977 -11.073 -3.266 1106 H THR 88 HN THR 88 -17.273 -18.803 -2.503 1107 HA THR 88 HA THR 88 -17.861 -21.327 -3.668 1108 HB THR 88 HB THR 88 -18.528 -20.577 -0.796 1109 HG1 THR 88 1HG THR 88 -16.629 -19.920 -0.883 1110 HG21 THR 88 3HG2 THR 88 -19.193 -22.850 -1.343 1111 HG22 THR 88 1HG2 THR 88 -17.768 -22.872 -0.290 1112 HG23 THR 88 2HG2 THR 88 -17.590 -23.178 -2.030 1113 H HIS 89 HN HIS 89 -20.073 -18.902 -2.181 1114 HA HIS 89 HA HIS 89 -22.412 -20.677 -2.771 1115 HD1 HIS 89 1HD HIS 89 -20.564 -17.248 -0.578 1116 HD2 HIS 89 2HD HIS 89 -22.715 -20.449 1.114 1117 HE1 HIS 89 1HE HIS 89 -19.851 -17.376 1.836 1118 HB2 HIS 89 2HB HIS 89 -22.908 -17.968 -1.682 1119 HB3 HIS 89 3HB HIS 89 -23.579 -19.508 -1.212 1120 H THR 90 HN THR 90 -20.680 -17.925 -3.996 1121 HA THR 90 HA THR 90 -22.982 -16.806 -5.398 1122 HB THR 90 HB THR 90 -20.079 -15.991 -5.745 1123 HG1 THR 90 1HG THR 90 -20.521 -15.992 -3.488 1124 HG21 THR 90 3HG2 THR 90 -21.000 -13.705 -5.922 1125 HG22 THR 90 1HG2 THR 90 -22.643 -14.379 -5.864 1126 HG23 THR 90 2HG2 THR 90 -21.560 -14.750 -7.228 1127 H GLY 91 HN GLY 91 -20.681 -19.278 -6.201 1128 HA2 GLY 91 2HA GLY 91 -20.580 -20.560 -8.134 1129 HA3 GLY 91 3HA GLY 91 -21.966 -19.660 -8.777 1130 H GLU 92 HN GLU 92 -19.458 -17.554 -7.806 1131 HA GLU 92 HA GLU 92 -19.059 -16.746 -10.560 1132 HB2 GLU 92 2HB GLU 92 -19.304 -15.226 -8.527 1133 HB3 GLU 92 3HB GLU 92 -17.663 -15.686 -8.074 1134 HG2 GLU 92 2HG GLU 92 -16.945 -14.874 -10.410 1135 HG3 GLU 92 3HG GLU 92 -18.577 -14.229 -10.590 1136 H LYS 93 HN LYS 93 -17.848 -18.210 -11.719 1137 HA LYS 93 HA LYS 93 -15.017 -18.576 -10.805 1138 HB2 LYS 93 2HB LYS 93 -16.772 -20.443 -12.459 1139 HB3 LYS 93 3HB LYS 93 -15.029 -20.647 -12.238 1140 HG2 LYS 93 2HG LYS 93 -15.311 -20.892 -9.825 1141 HG3 LYS 93 3HG LYS 93 -17.061 -20.626 -9.965 1142 HD2 LYS 93 2HD LYS 93 -17.259 -22.672 -11.347 1143 HD3 LYS 93 3HD LYS 93 -15.504 -22.920 -11.231 1144 HE2 LYS 93 2HE LYS 93 -15.702 -23.038 -8.748 1145 HE3 LYS 93 3HE LYS 93 -17.460 -22.869 -8.893 1146 HZ1 LYS 93 3HZ LYS 93 -15.850 -25.056 -10.047 1147 HZ2 LYS 93 1HZ LYS 93 -17.486 -24.911 -10.162 1148 HZ3 LYS 93 2HZ LYS 93 -16.783 -25.168 -8.694 1149 HA PRO 94 HA PRO 94 -15.014 -16.159 -14.698 1150 HB2 PRO 94 2HB PRO 94 -13.347 -14.129 -13.977 1151 HB3 PRO 94 3HB PRO 94 -15.034 -14.224 -13.388 1152 HG2 PRO 94 2HG PRO 94 -12.506 -15.060 -11.944 1153 HG3 PRO 94 3HG PRO 94 -13.879 -14.100 -11.314 1154 HD2 PRO 94 2HD PRO 94 -13.577 -16.819 -10.951 1155 HD3 PRO 94 3HD PRO 94 -15.167 -16.003 -10.965 1156 H PHE 95 HN PHE 95 -12.332 -17.514 -12.784 1157 HA PHE 95 HA PHE 95 -10.265 -16.915 -14.786 1158 HD1 PHE 95 2HD PHE 95 -8.031 -15.995 -13.418 1159 HD2 PHE 95 1HD PHE 95 -11.044 -17.402 -10.688 1160 HE1 PHE 95 2HE PHE 95 -7.655 -14.000 -11.984 1161 HE2 PHE 95 1HE PHE 95 -10.674 -15.398 -9.253 1162 HZ PHE 95 HZ PHE 95 -8.978 -13.707 -9.898 1163 HB2 PHE 95 2HB PHE 95 -10.240 -18.839 -12.416 1164 HB3 PHE 95 3HB PHE 95 -8.853 -18.374 -13.385 1165 H SER 96 HN SER 96 -11.316 -17.780 -16.695 1166 HA SER 96 HA SER 96 -11.757 -20.685 -16.854 1167 HG SER 96 HG SER 96 -13.250 -18.064 -17.338 1168 HB2 SER 96 2HB SER 96 -11.815 -18.618 -19.092 1169 HB3 SER 96 3HB SER 96 -12.567 -20.223 -19.087 1170 H CYS 97 HN CYS 97 -10.480 -22.185 -17.847 1171 HA CYS 97 HA CYS 97 -7.719 -21.567 -18.323 1172 HB2 CYS 97 2HB CYS 97 -8.741 -23.798 -17.577 1173 HB3 CYS 97 3HB CYS 97 -9.229 -24.021 -19.252 1174 H ARG 98 HN ARG 98 -6.539 -22.052 -20.333 1175 HA ARG 98 HA ARG 98 -8.064 -21.096 -22.735 1176 HE ARG 98 HE ARG 98 -3.502 -20.585 -23.620 1177 HB2 ARG 98 2HB ARG 98 -5.837 -20.028 -23.411 1178 HB3 ARG 98 3HB ARG 98 -6.711 -19.295 -22.091 1179 HG2 ARG 98 2HG ARG 98 -4.334 -19.272 -21.645 1180 HG3 ARG 98 3HG ARG 98 -5.193 -20.195 -20.431 1181 HD2 ARG 98 2HD ARG 98 -3.083 -21.262 -20.980 1182 HD3 ARG 98 3HD ARG 98 -4.421 -22.301 -21.462 1183 HH11 ARG 98 1HH1 ARG 98 -2.870 -23.732 -22.105 1184 HH12 ARG 98 2HH1 ARG 98 -2.015 -24.294 -23.518 1185 HH21 ARG 98 1HH2 ARG 98 -2.457 -21.432 -25.364 1186 HH22 ARG 98 2HH2 ARG 98 -1.812 -23.057 -25.300 1187 H TRP 99 HN TRP 99 -6.793 -23.813 -21.485 1188 HA TRP 99 HA TRP 99 -4.997 -24.699 -23.576 1189 HD1 TRP 99 1HD TRP 99 -4.673 -24.083 -20.183 1190 HE1 TRP 99 1HE TRP 99 -2.276 -24.433 -19.353 1191 HE3 TRP 99 3HE TRP 99 -3.556 -28.353 -22.767 1192 HZ2 TRP 99 2HZ TRP 99 -0.122 -26.279 -19.815 1193 HZ3 TRP 99 3HZ TRP 99 -1.308 -29.385 -22.553 1194 HH2 TRP 99 2HH TRP 99 0.413 -28.357 -21.091 1195 HB2 TRP 99 2HB TRP 99 -6.466 -25.991 -21.283 1196 HB3 TRP 99 3HB TRP 99 -5.700 -27.012 -22.477 1197 HA PRO 100 HA PRO 100 -7.377 -25.931 -26.968 1198 HB2 PRO 100 2HB PRO 100 -6.454 -28.791 -26.425 1199 HB3 PRO 100 3HB PRO 100 -6.521 -27.914 -27.984 1200 HG2 PRO 100 2HG PRO 100 -4.181 -28.113 -26.667 1201 HG3 PRO 100 3HG PRO 100 -4.667 -26.526 -27.350 1202 HD2 PRO 100 2HD PRO 100 -4.831 -27.479 -24.493 1203 HD3 PRO 100 3HD PRO 100 -4.342 -25.877 -25.137 1204 H SER 101 HN SER 101 -9.544 -25.730 -26.652 1205 HA SER 101 HA SER 101 -11.747 -26.317 -26.308 1206 HG SER 101 HG SER 101 -12.842 -28.694 -25.644 1207 HB2 SER 101 2HB SER 101 -11.122 -28.195 -27.823 1208 HB3 SER 101 3HB SER 101 -10.698 -29.190 -26.412 1209 H CYS 102 HN CYS 102 -9.755 -26.179 -23.905 1210 HA CYS 102 HA CYS 102 -11.034 -27.893 -21.900 1211 HB2 CYS 102 2HB CYS 102 -8.688 -27.376 -21.607 1212 HB3 CYS 102 3HB CYS 102 -8.970 -25.632 -21.708 1213 H GLN 103 HN GLN 103 -10.455 -24.405 -21.449 1214 HA GLN 103 HA GLN 103 -11.821 -22.647 -20.847 1215 HB2 GLN 103 2HB GLN 103 -14.275 -24.196 -21.762 1216 HB3 GLN 103 3HB GLN 103 -14.050 -22.484 -21.664 1217 HG2 GLN 103 2HG GLN 103 -13.265 -22.297 -23.740 1218 HG3 GLN 103 3HG GLN 103 -12.092 -23.580 -23.561 1219 HE21 GLN 103 1HE2 GLN 103 -13.758 -25.901 -23.138 1220 HE22 GLN 103 2HE2 GLN 103 -14.702 -26.045 -24.635 1221 H LYS 104 HN LYS 104 -11.400 -25.232 -19.130 1222 HA LYS 104 HA LYS 104 -13.682 -25.373 -17.319 1223 HB2 LYS 104 2HB LYS 104 -10.746 -26.186 -17.088 1224 HB3 LYS 104 3HB LYS 104 -11.876 -26.346 -15.742 1225 HG2 LYS 104 2HG LYS 104 -13.384 -27.735 -17.007 1226 HG3 LYS 104 3HG LYS 104 -12.462 -27.538 -18.491 1227 HD2 LYS 104 2HD LYS 104 -11.270 -28.866 -16.020 1228 HD3 LYS 104 3HD LYS 104 -12.241 -29.742 -17.220 1229 HE2 LYS 104 2HE LYS 104 -10.680 -28.892 -19.018 1230 HE3 LYS 104 3HE LYS 104 -9.645 -28.249 -17.763 1231 HZ1 LYS 104 3HZ LYS 104 -8.901 -30.391 -18.430 1232 HZ2 LYS 104 1HZ LYS 104 -10.371 -31.086 -18.161 1233 HZ3 LYS 104 2HZ LYS 104 -9.472 -30.539 -16.891 1234 H LYS 105 HN LYS 105 -14.181 -24.134 -15.580 1235 HA LYS 105 HA LYS 105 -12.581 -21.641 -15.339 1236 HB2 LYS 105 2HB LYS 105 -15.493 -22.103 -14.561 1237 HB3 LYS 105 3HB LYS 105 -14.600 -20.577 -14.692 1238 HG2 LYS 105 2HG LYS 105 -14.221 -21.197 -17.167 1239 HG3 LYS 105 3HG LYS 105 -15.474 -22.423 -16.938 1240 HD2 LYS 105 2HD LYS 105 -17.102 -20.691 -16.309 1241 HD3 LYS 105 3HD LYS 105 -15.841 -19.439 -16.425 1242 HE2 LYS 105 2HE LYS 105 -15.488 -19.982 -18.801 1243 HE3 LYS 105 3HE LYS 105 -16.750 -21.224 -18.721 1244 HZ1 LYS 105 3HZ LYS 105 -17.595 -19.158 -19.599 1245 HZ2 LYS 105 1HZ LYS 105 -17.131 -18.336 -18.249 1246 HZ3 LYS 105 2HZ LYS 105 -18.319 -19.473 -18.152 1247 H PHE 106 HN PHE 106 -11.985 -20.739 -13.440 1248 HA PHE 106 HA PHE 106 -12.651 -22.241 -10.924 1249 HD1 PHE 106 1HD PHE 106 -10.747 -24.195 -10.004 1250 HD2 PHE 106 2HD PHE 106 -9.581 -22.240 -13.662 1251 HE1 PHE 106 1HE PHE 106 -10.405 -26.405 -11.083 1252 HE2 PHE 106 2HE PHE 106 -9.285 -24.443 -14.755 1253 HZ PHE 106 HZ PHE 106 -9.746 -26.526 -13.473 1254 HB2 PHE 106 2HB PHE 106 -9.976 -20.943 -11.639 1255 HB3 PHE 106 3HB PHE 106 -10.378 -21.725 -10.112 1256 H ALA 107 HN ALA 107 -12.420 -20.904 -8.942 1257 HA ALA 107 HA ALA 107 -13.447 -18.170 -9.502 1258 HB1 ALA 107 1HB ALA 107 -14.224 -18.260 -7.142 1259 HB2 ALA 107 2HB ALA 107 -14.851 -19.622 -8.070 1260 HB3 ALA 107 3HB ALA 107 -13.489 -19.867 -6.953 1261 H ARG 108 HN ARG 108 -10.497 -19.610 -8.886 1262 HA ARG 108 HA ARG 108 -9.470 -17.079 -7.695 1263 HE ARG 108 HE ARG 108 -7.350 -19.722 -4.754 1264 HB2 ARG 108 2HB ARG 108 -8.670 -19.896 -6.887 1265 HB3 ARG 108 3HB ARG 108 -7.848 -18.398 -6.413 1266 HG2 ARG 108 2HG ARG 108 -9.548 -17.685 -5.017 1267 HG3 ARG 108 3HG ARG 108 -10.765 -18.746 -5.737 1268 HD2 ARG 108 2HD ARG 108 -10.057 -19.509 -3.510 1269 HD3 ARG 108 3HD ARG 108 -9.822 -20.705 -4.775 1270 HH11 ARG 108 1HH1 ARG 108 -9.324 -20.318 -1.933 1271 HH12 ARG 108 2HH1 ARG 108 -7.988 -21.021 -1.037 1272 HH21 ARG 108 2HH2 ARG 108 -5.699 -20.640 -3.627 1273 HH22 ARG 108 1HH2 ARG 108 -5.979 -21.217 -1.993 1274 H SER 109 HN SER 109 -7.582 -16.345 -8.524 1275 HA SER 109 HA SER 109 -6.755 -17.137 -11.102 1276 HG SER 109 HG SER 109 -5.728 -14.554 -8.411 1277 HB2 SER 109 2HB SER 109 -4.677 -15.745 -10.519 1278 HB3 SER 109 3HB SER 109 -6.230 -14.922 -10.368 1279 H ASP 110 HN ASP 110 -5.367 -17.902 -7.872 1280 HA ASP 110 HA ASP 110 -3.146 -19.390 -8.903 1281 HB2 ASP 110 2HB ASP 110 -2.716 -20.018 -6.695 1282 HB3 ASP 110 3HB ASP 110 -3.329 -18.378 -6.606 1283 H GLU 111 HN GLU 111 -6.515 -20.312 -8.078 1284 HA GLU 111 HA GLU 111 -6.158 -23.172 -8.195 1285 HB2 GLU 111 2HB GLU 111 -8.537 -21.324 -8.603 1286 HB3 GLU 111 3HB GLU 111 -8.641 -23.025 -9.021 1287 HG2 GLU 111 2HG GLU 111 -7.988 -23.689 -6.757 1288 HG3 GLU 111 3HG GLU 111 -7.929 -21.998 -6.260 1289 H LEU 112 HN LEU 112 -6.862 -20.663 -10.690 1290 HA LEU 112 HA LEU 112 -6.930 -22.525 -12.902 1291 HG LEU 112 HG LEU 112 -5.434 -20.594 -14.919 1292 HB2 LEU 112 2HB LEU 112 -7.851 -20.287 -13.080 1293 HB3 LEU 112 3HB LEU 112 -6.266 -19.548 -12.819 1294 HD11 LEU 112 1HD1 LEU 112 -8.331 -21.447 -15.383 1295 HD12 LEU 112 2HD1 LEU 112 -6.991 -22.568 -15.013 1296 HD13 LEU 112 3HD1 LEU 112 -6.951 -21.630 -16.473 1297 HD21 LEU 112 3HD2 LEU 112 -6.406 -18.309 -14.951 1298 HD22 LEU 112 1HD2 LEU 112 -7.979 -19.018 -15.403 1299 HD23 LEU 112 2HD2 LEU 112 -6.591 -19.181 -16.485 1300 H VAL 113 HN VAL 113 -4.265 -20.466 -11.528 1301 HA VAL 113 HA VAL 113 -2.184 -21.289 -13.233 1302 HB VAL 113 HB VAL 113 -2.079 -20.688 -10.247 1303 HG11 VAL 113 1HG1 VAL 113 0.319 -20.123 -10.602 1304 HG12 VAL 113 2HG1 VAL 113 -0.020 -21.843 -10.768 1305 HG13 VAL 113 3HG1 VAL 113 0.216 -20.844 -12.223 1306 HG21 VAL 113 3HG2 VAL 113 -1.199 -18.834 -12.469 1307 HG22 VAL 113 1HG2 VAL 113 -2.842 -18.800 -11.871 1308 HG23 VAL 113 2HG2 VAL 113 -1.503 -18.451 -10.764 1309 H ARG 114 HN ARG 114 -3.459 -22.906 -10.326 1310 HA ARG 114 HA ARG 114 -1.562 -25.103 -10.322 1311 HE ARG 114 HE ARG 114 -2.072 -26.155 -6.661 1312 HB2 ARG 114 2HB ARG 114 -2.845 -24.629 -8.330 1313 HB3 ARG 114 3HB ARG 114 -4.383 -24.824 -9.176 1314 HG2 ARG 114 2HG ARG 114 -3.998 -27.200 -9.522 1315 HG3 ARG 114 3HG ARG 114 -2.345 -27.079 -8.901 1316 HD2 ARG 114 2HD ARG 114 -4.835 -26.455 -7.266 1317 HD3 ARG 114 3HD ARG 114 -4.079 -28.057 -7.339 1318 HH11 ARG 114 1HH2 ARG 114 -4.939 -27.600 -5.212 1319 HH12 ARG 114 2HH2 ARG 114 -4.302 -27.514 -3.604 1320 HH21 ARG 114 1HH1 ARG 114 -1.327 -25.956 -4.521 1321 HH22 ARG 114 2HH1 ARG 114 -2.443 -26.412 -3.234 1322 H HIS 115 HN HIS 115 -4.943 -24.780 -11.566 1323 HA HIS 115 HA HIS 115 -5.229 -27.274 -12.709 1324 HD1 HIS 115 1HD HIS 115 -7.631 -28.181 -13.723 1325 HD2 HIS 115 2HD HIS 115 -6.708 -25.048 -16.380 1326 HE1 HIS 115 1HE HIS 115 -8.466 -28.890 -16.029 1327 HB2 HIS 115 2HB HIS 115 -7.015 -25.605 -12.667 1328 HB3 HIS 115 3HB HIS 115 -6.176 -24.600 -13.843 1329 H HIS 116 HN HIS 116 -3.783 -24.390 -14.330 1330 HA HIS 116 HA HIS 116 -3.102 -25.651 -16.774 1331 HD1 HIS 116 1HD HIS 116 -4.792 -24.048 -17.562 1332 HD2 HIS 116 2HD HIS 116 -2.016 -21.005 -16.550 1333 HE1 HIS 116 1HE HIS 116 -5.680 -21.916 -18.476 1334 HB2 HIS 116 2HB HIS 116 -1.761 -23.410 -15.218 1335 HB3 HIS 116 3HB HIS 116 -1.245 -23.912 -16.818 1336 H ASN 117 HN ASN 117 -1.387 -25.631 -13.606 1337 HA ASN 117 HA ASN 117 1.066 -26.827 -14.679 1338 HB2 ASN 117 2HB ASN 117 0.003 -26.183 -11.903 1339 HB3 ASN 117 3HB ASN 117 1.367 -27.279 -12.091 1340 HD21 ASN 117 1HD2 ASN 117 0.317 -23.892 -12.715 1341 HD22 ASN 117 2HD2 ASN 117 2.009 -23.363 -12.878 1342 H MET 118 HN MET 118 -2.071 -28.019 -13.831 1343 HA MET 118 HA MET 118 -1.017 -30.815 -13.583 1344 HB2 MET 118 2HB MET 118 -3.712 -29.593 -12.826 1345 HB3 MET 118 3HB MET 118 -3.336 -31.321 -12.729 1346 HG2 MET 118 2HG MET 118 -1.528 -30.879 -11.141 1347 HG3 MET 118 3HG MET 118 -1.850 -29.144 -11.213 1348 HE1 MET 118 3HE MET 118 -2.936 -30.376 -7.593 1349 HE2 MET 118 1HE MET 118 -1.696 -31.153 -8.602 1350 HE3 MET 118 2HE MET 118 -1.785 -29.380 -8.516 1351 H HIS 119 HN HIS 119 -1.993 -28.725 -15.957 1352 HA HIS 119 HA HIS 119 -4.121 -30.169 -17.216 1353 HD1 HIS 119 1HD HIS 119 -4.440 -30.128 -20.152 1354 HD2 HIS 119 2HD HIS 119 -5.360 -26.664 -17.966 1355 HE1 HIS 119 1HE HIS 119 -6.891 -29.463 -20.758 1356 HB2 HIS 119 2HB HIS 119 -3.117 -27.691 -17.491 1357 HB3 HIS 119 3HB HIS 119 -2.308 -28.438 -18.870 Start of MODEL 14 1 H5 DC 124 5H C 124 -3.985 -31.374 -5.030 2 H6 DC 124 6H C 124 -5.902 -30.970 -6.502 3 H5' DC 124 H5' C 124 -8.883 -32.494 -9.788 4 H5'' DC 124 H5" C 124 -7.505 -32.355 -8.673 5 H4' DC 124 H4' C 124 -10.437 -32.461 -7.767 6 H3' DC 124 H3' C 124 -9.176 -30.264 -8.959 7 H2' DC 124 H2' C 124 -7.433 -30.007 -7.438 8 H2'' DC 124 H2" C 124 -8.643 -28.995 -6.601 9 H1' DC 124 H1' C 124 -9.429 -30.800 -5.239 10 H41 DC 124 1H4 C 124 -4.504 -32.291 -1.498 11 H42 DC 124 2H4 C 124 -3.350 -32.019 -2.790 12 H8 DG 125 8H G 125 -9.152 -26.907 -5.681 13 H1 DG 125 1H G 125 -6.420 -29.128 -0.287 14 H5' DG 125 H5' G 125 -12.898 -29.666 -6.371 15 H5'' DG 125 H5" G 125 -13.977 -28.342 -6.853 16 H4' DG 125 H4' G 125 -13.850 -28.556 -4.404 17 H3' DG 125 H3' G 125 -13.405 -26.110 -5.757 18 H2' DG 125 H2' G 125 -11.114 -26.008 -5.318 19 H2'' DG 125 H2" G 125 -11.655 -25.289 -3.777 20 H1' DG 125 H1' G 125 -11.538 -27.380 -2.628 21 H21 DG 125 1H2 G 125 -7.901 -29.344 1.268 22 H22 DG 125 2H2 G 125 -9.600 -29.009 0.983 23 H5 DC 126 5H C 126 -8.012 -23.966 -4.351 24 H6 DC 126 6H C 126 -9.996 -23.554 -2.976 25 H5' DC 126 H5' C 126 -13.533 -26.248 -1.087 26 H5'' DC 126 H5" C 126 -14.603 -24.991 -0.418 27 H4' DC 126 H4' C 126 -12.632 -25.128 0.978 28 H3' DC 126 H3' C 126 -13.247 -22.649 -0.261 29 H2' DC 126 H2' C 126 -11.370 -22.759 -1.701 30 H2'' DC 126 H2" C 126 -10.609 -21.933 -0.304 31 H1' DC 126 H1' C 126 -10.018 -24.114 0.724 32 H41 DC 126 1H4 C 126 -4.976 -25.401 -2.882 33 H42 DC 126 2H4 C 126 -5.779 -24.855 -4.337 34 H8 DG 127 8H G 127 -9.660 -21.801 1.670 35 H1 DG 127 1H G 127 -3.414 -22.922 0.662 36 H5' DG 127 H5' G 127 -12.016 -23.670 3.827 37 H5'' DG 127 H5" G 127 -12.616 -22.629 5.123 38 H4' DG 127 H4' G 127 -10.578 -23.703 5.852 39 H3' DG 127 H3' G 127 -10.809 -20.885 5.786 40 H2' DG 127 H2' G 127 -9.321 -20.614 4.068 41 H2'' DG 127 H2" G 127 -8.099 -20.741 5.334 42 H1' DG 127 H1' G 127 -7.589 -22.992 4.778 43 H21 DG 127 1H2 G 127 -2.433 -23.384 2.555 44 H22 DG 127 2H2 G 127 -3.274 -23.244 4.089 45 H8 DG 128 8H G 128 -7.425 -18.525 4.210 46 H1 DG 128 1H G 128 -2.666 -19.666 0.021 47 H5' DG 128 H5' G 128 -6.743 -21.911 7.438 48 H5'' DG 128 H5" G 128 -6.616 -21.177 9.041 49 H4' DG 128 H4' G 128 -4.571 -20.685 8.079 50 H3' DG 128 H3' G 128 -6.200 -18.495 8.625 51 H2' DG 128 H2' G 128 -6.833 -18.174 6.323 52 H2'' DG 128 H2" G 128 -5.404 -17.075 6.436 53 H1' DG 128 H1' G 128 -3.884 -18.877 5.731 54 H21 DG 128 1H2 G 128 -0.794 -19.921 1.067 55 H22 DG 128 2H2 G 128 -0.731 -20.047 2.815 56 H8 DG 129 8H G 129 -3.424 -16.273 5.601 57 H1 DG 129 1H G 129 -0.992 -16.656 -0.346 58 H5' DG 129 H5' G 129 -1.496 -18.421 8.721 59 H5'' DG 129 H5" G 129 -0.876 -17.331 9.957 60 H4' DG 129 H4' G 129 0.670 -17.307 8.079 61 H3' DG 129 H3' G 129 -0.721 -14.866 8.781 62 H2' DG 129 H2' G 129 -1.888 -14.788 6.768 63 H2'' DG 129 H2" G 129 -0.414 -13.994 6.177 64 H1' DG 129 H1' G 129 0.474 -16.109 5.351 65 H21 DG 129 1H2 G 129 1.164 -16.490 -0.306 66 H22 DG 129 2H2 G 129 2.047 -16.270 1.196 67 H8 DG 130 8H G 130 0.590 -13.450 4.261 68 H1 DG 130 1H G 130 -0.644 -12.800 -1.992 69 H5' DG 130 H5' G 130 2.931 -15.558 5.464 70 H5'' DG 130 H5" G 130 4.037 -14.711 6.561 71 H4' DG 130 H4' G 130 5.059 -14.418 4.516 72 H3' DG 130 H3' G 130 4.084 -12.159 5.830 73 H2' DG 130 H2' G 130 2.295 -11.694 4.482 74 H2'' DG 130 H2" G 130 3.495 -10.886 3.470 75 H1' DG 130 H1' G 130 3.621 -12.641 1.957 76 H21 DG 130 1H2 G 130 1.185 -12.398 -3.108 77 H22 DG 130 2H2 G 130 2.734 -12.214 -2.297 78 H8 DG 131 8H G 131 2.583 -9.424 2.356 79 H1 DG 131 1H G 131 -1.868 -9.281 -2.245 80 H5' DG 131 H5' G 131 6.142 -11.749 1.686 81 H5'' DG 131 H5" G 131 7.460 -10.569 1.861 82 H4' DG 131 H4' G 131 6.610 -10.306 -0.352 83 H3' DG 131 H3' G 131 6.513 -8.154 1.459 84 H2' DG 131 H2' G 131 4.214 -8.001 1.589 85 H2'' DG 131 H2" G 131 4.370 -7.048 0.104 86 H1' DG 131 H1' G 131 3.886 -8.931 -1.297 87 H21 DG 131 1H2 G 131 -0.991 -8.873 -4.158 88 H22 DG 131 2H2 G 131 0.742 -8.662 -4.355 89 H5 DC 132 5H C 132 1.265 -6.372 1.702 90 H6 DC 132 6H C 132 2.762 -5.679 -0.101 91 H5' DC 132 H5' C 132 5.376 -7.632 -2.930 92 H5'' DC 132 H5" C 132 6.323 -6.276 -3.584 93 H4' DC 132 H4' C 132 4.099 -6.192 -4.577 94 H3' DC 132 H3' C 132 5.138 -4.042 -2.863 95 H2' DC 132 H2' C 132 3.280 -3.933 -1.529 96 H2'' DC 132 H2" C 132 2.464 -3.254 -2.953 97 H1' DC 132 H1' C 132 1.583 -5.323 -3.636 98 H41 DC 132 1H4 C 132 -2.330 -6.868 1.096 99 H42 DC 132 2H4 C 132 -0.976 -7.197 2.160 100 H8 DG 133 8H G 133 1.259 -1.765 -3.052 101 H1 DG 133 1H G 133 -4.895 -2.780 -1.539 102 H5' DG 133 H5' G 133 2.741 -3.240 -6.734 103 H5'' DG 133 H5" G 133 3.369 -1.759 -7.479 104 H4' DG 133 H4' G 133 1.013 -2.065 -8.074 105 H3' DG 133 H3' G 133 2.000 0.285 -6.951 106 H2' DG 133 H2' G 133 1.206 -0.150 -4.793 107 H2'' DG 133 H2" G 133 -0.216 0.706 -5.378 108 H1' DG 133 H1' G 133 -1.294 -1.360 -6.017 109 H21 DG 133 1H2 G 133 -6.163 -2.206 -3.202 110 H22 DG 133 2H2 G 133 -5.507 -1.676 -4.733 111 H5' DT 134 H5' T 134 -2.341 -0.088 -7.078 112 H5'' DT 134 H5" T 134 -2.828 0.995 -8.373 113 H4' DT 134 H4' T 134 -4.690 1.064 -7.021 114 H3' DT 134 H3' T 134 -3.031 3.371 -7.176 115 H2' DT 134 H2' T 134 -2.347 3.203 -5.036 116 H2'' DT 134 H2" T 134 -3.838 4.074 -4.746 117 H1' DT 134 H1' T 134 -5.089 2.039 -4.208 118 H3 DT 134 3H T 134 -4.023 0.217 -0.206 119 H71 DT 134 1H7 T 134 0.696 1.387 -2.498 120 H72 DT 134 2H7 T 134 0.229 2.393 -1.117 121 H73 DT 134 3H7 T 134 0.524 0.639 -0.905 122 H6 DT 134 6H T 134 -1.425 2.144 -3.679 123 H5 DC 135 5H C 135 -3.634 4.885 -2.733 124 H6 DC 135 6H C 135 -5.470 5.387 -4.249 125 H5' DC 135 H5' C 135 -7.488 3.515 -7.414 126 H5'' DC 135 H5" C 135 -8.290 4.889 -8.189 127 H4' DC 135 H4' C 135 -9.574 4.211 -6.298 128 H3' DC 135 H3' C 135 -8.660 6.835 -6.547 129 H2' DC 135 H2' C 135 -6.959 6.490 -4.980 130 H2'' DC 135 H2" C 135 -8.209 7.120 -3.913 131 H1' DC 135 H1' C 135 -9.035 4.895 -3.320 132 H41 DC 135 1H4 C 135 -4.207 3.476 0.593 133 H42 DC 135 2H4 C 135 -3.072 4.207 -0.504 134 H5' DT 136 H5' T 136 -10.812 5.279 -2.677 135 H5'' DT 136 H5" T 136 -12.350 6.055 -3.037 136 H4' DT 136 H4' T 136 -12.375 5.835 -0.702 137 H3' DT 136 H3' T 136 -12.319 8.446 -1.797 138 H2' DT 136 H2' T 136 -10.198 8.970 -1.321 139 H2'' DT 136 H2" T 136 -10.765 9.455 0.243 140 H1' DT 136 H1' T 136 -10.158 7.350 1.350 141 H3 DT 136 3H T 136 -5.721 6.448 1.587 142 H71 DT 136 1H7 T 136 -5.227 9.295 -2.213 143 H72 DT 136 2H7 T 136 -5.264 7.666 -2.938 144 H73 DT 136 3H7 T 136 -6.645 8.772 -3.148 145 H6 DT 136 6H T 136 -8.456 8.257 -1.839 146 H8 DG 137 8H G 137 -9.644 10.452 1.736 147 H1 DG 137 1H G 137 -3.784 9.224 4.013 148 H5' DG 137 H5' G 137 -12.165 7.402 2.556 149 H5'' DG 137 H5" G 137 -13.641 8.157 3.184 150 H4' DG 137 H4' G 137 -12.294 7.959 5.076 151 H3' DG 137 H3' G 137 -13.005 10.533 4.250 152 H2' DG 137 H2' G 137 -10.964 11.042 3.323 153 H2'' DG 137 H2" G 137 -10.634 11.627 4.937 154 H1' DG 137 H1' G 137 -9.416 9.642 5.546 155 H21 DG 137 1H2 G 137 -3.842 8.873 6.139 156 H22 DG 137 2H2 G 137 -5.353 8.909 7.039 157 H5 DC 138 5H C 138 -8.570 12.951 3.976 158 H6 DC 138 6H C 138 -9.161 12.245 6.246 159 H5' DC 138 H5' C 138 -10.440 9.300 7.680 160 H5'' DC 138 H5" C 138 -11.337 9.867 9.096 161 H4' DC 138 H4' C 138 -9.114 9.543 9.858 162 H3' DC 138 H3' C 138 -10.364 12.057 9.957 163 H2' DC 138 H2' C 138 -9.197 13.078 8.249 164 H2'' DC 138 H2" C 138 -8.030 13.429 9.501 165 H1' DC 138 H1' C 138 -6.610 11.636 8.907 166 H41 DC 138 1H4 C 138 -5.054 13.253 2.966 167 H42 DC 138 2H4 C 138 -6.733 13.314 2.473 168 H8 DG 139 8H G 139 -6.388 14.655 9.643 169 H1 DG 139 1H G 139 -2.090 15.929 5.078 170 H5' DG 139 H5' G 139 -6.095 11.054 11.097 171 H5'' DG 139 H5" G 139 -6.197 11.286 12.849 172 H4' DG 139 H4' G 139 -3.915 11.475 12.361 173 H3' DG 139 H3' G 139 -5.188 13.652 13.523 174 H2' DG 139 H2' G 139 -5.412 14.892 11.582 175 H2'' DG 139 H2" G 139 -3.837 15.512 12.045 176 H1' DG 139 H1' G 139 -2.655 14.050 10.568 177 H21 DG 139 1H2 G 139 -0.094 15.341 5.714 178 H22 DG 139 2H2 G 139 0.213 14.724 7.332 179 H5 DC 140 5H C 140 -4.194 17.664 10.556 180 H6 DC 140 6H C 140 -2.171 16.824 11.653 181 H5' DC 140 H5' C 140 -0.847 13.456 12.121 182 H5'' DC 140 H5" C 140 0.089 13.669 13.606 183 H4' DC 140 H4' C 140 1.547 14.144 11.782 184 H3' DC 140 H3' C 140 1.220 16.037 13.780 185 H2' DC 140 H2' C 140 -0.300 17.420 12.631 186 H2'' DC 140 H2" C 140 1.212 18.176 12.065 187 H1' DC 140 H1' C 140 1.231 16.960 10.033 188 H41 DC 140 1H4 C 140 -4.079 19.032 7.151 189 H42 DC 140 2H4 C 140 -5.075 18.575 8.515 190 H8 DG 141 8H G 141 -3.434 21.426 0.820 191 H1 DG 141 1H G 141 -1.561 18.742 6.354 192 H5' DG 141 H5' G 141 -0.772 24.503 -0.581 193 H5'' DG 141 H5" G 141 -0.933 23.900 -2.242 194 H4' DG 141 H4' G 141 0.897 22.809 -0.982 195 H3' DG 141 H3' G 141 -0.930 21.379 -2.548 196 H2' DG 141 H2' G 141 -2.176 20.560 -0.804 197 H2'' DG 141 H2" G 141 -0.987 19.258 -0.828 198 H1' DG 141 H1' G 141 0.275 20.216 0.971 199 H21 DG 141 1H2 G 141 0.538 18.230 6.297 200 H22 DG 141 2H2 G 141 1.497 18.439 4.840 201 H5 DC 142 5H C 142 -2.612 17.576 0.369 202 H6 DC 142 6H C 142 -0.236 17.239 -0.037 203 H5' DC 142 H5' C 142 2.164 19.706 0.320 204 H5'' DC 142 H5" C 142 3.340 19.229 -0.898 205 H4' DC 142 H4' C 142 4.021 18.062 0.944 206 H3' DC 142 H3' C 142 3.190 16.578 -1.252 207 H2' DC 142 H2' C 142 1.157 15.865 -0.500 208 H2'' DC 142 H2" C 142 2.029 14.596 0.276 209 H1' DC 142 H1' C 142 2.009 15.596 2.410 210 H41 DC 142 1H4 C 142 -4.094 16.839 3.631 211 H42 DC 142 2H4 C 142 -4.307 17.559 2.049 212 H8 DG 143 8H G 143 1.530 12.897 1.255 213 H1 DG 143 1H G 143 -3.673 12.487 5.022 214 H5' DG 143 H5' G 143 4.243 15.370 3.257 215 H5'' DG 143 H5" G 143 5.716 14.474 2.857 216 H4' DG 143 H4' G 143 4.926 13.574 4.919 217 H3' DG 143 H3' G 143 5.368 11.954 2.701 218 H2' DG 143 H2' G 143 3.155 11.779 2.001 219 H2'' DG 143 H2" G 143 3.131 10.400 3.076 220 H1' DG 143 H1' G 143 2.157 11.598 4.854 221 H21 DG 143 1H2 G 143 -3.166 11.752 7.009 222 H22 DG 143 2H2 G 143 -1.509 11.361 7.444 223 H5 DC 144 5H C 144 0.827 9.543 1.986 224 H6 DC 144 6H C 144 1.839 8.780 4.094 225 H5' DC 144 H5' C 144 3.098 10.911 6.480 226 H5'' DC 144 H5" C 144 4.385 9.973 7.220 227 H4' DC 144 H4' C 144 2.547 9.380 8.440 228 H3' DC 144 H3' C 144 3.781 7.373 7.028 229 H2' DC 144 H2' C 144 2.260 7.184 5.298 230 H2'' DC 144 H2" C 144 1.442 6.110 6.399 231 H1' DC 144 H1' C 144 -0.203 7.699 7.026 232 H41 DC 144 1H4 C 144 -2.850 9.784 1.675 233 H42 DC 144 2H4 C 144 -1.297 10.065 0.913 234 H8 DA 145 8H A 145 -0.217 5.089 5.991 235 H2 DA 145 2H A 145 -6.285 6.193 4.371 236 H5' DA 145 H5' A 145 0.023 7.215 9.754 237 H5'' DA 145 H5" A 145 0.150 5.842 10.872 238 H4' DA 145 H4' A 145 -2.190 6.293 10.344 239 H3' DA 145 H3' A 145 -0.949 3.747 10.127 240 H2' DA 145 H2' A 145 -0.918 3.872 7.767 241 H2'' DA 145 H2" A 145 -2.495 3.112 7.984 242 H1' DA 145 H1' A 145 -3.654 5.259 7.831 243 H61 DA 145 2H6 A 145 -1.876 6.232 1.640 244 H62 DA 145 1H6 A 145 -3.471 6.591 1.003 245 H8 DG 146 8H G 146 -3.927 1.565 7.239 246 H1 DG 146 1H G 146 -5.748 3.307 1.337 247 H5' DG 146 H5' G 146 -5.235 4.599 9.689 248 H5'' DG 146 H5" G 146 -6.410 4.635 10.976 249 H4' DG 146 H4' G 146 -7.886 3.914 9.580 250 H3' DG 146 H3' G 146 -6.790 1.469 10.453 251 H2' DG 146 H2' G 146 -5.561 1.016 8.526 252 H2'' DG 146 H2" G 146 -7.096 0.383 7.939 253 H1' DG 146 H1' G 146 -7.676 2.371 6.802 254 H21 DG 146 1H2 G 146 -7.871 3.692 1.292 255 H22 DG 146 2H2 G 146 -8.839 3.718 2.744 256 H8 DA 147 8H A 147 -6.794 -1.149 6.443 257 H2 DA 147 2H A 147 -6.496 0.551 0.271 258 H5' DA 147 H5' A 147 -10.085 1.856 7.407 259 H5'' DA 147 H5" A 147 -11.474 0.821 7.798 260 H4' DA 147 H4' A 147 -11.316 1.023 5.350 261 H3' DA 147 H3' A 147 -11.187 -1.541 6.639 262 H2' DA 147 H2' A 147 -8.961 -1.990 6.105 263 H2'' DA 147 H2" A 147 -9.660 -2.507 4.533 264 H1' DA 147 H1' A 147 -9.353 -0.337 3.579 265 H61 DA 147 2H6 A 147 -2.784 -0.534 3.784 266 H62 DA 147 1H6 A 147 -2.503 -0.250 2.079 267 H5 DC 148 5H C 148 -7.021 -3.584 3.272 268 H6 DC 148 6H C 148 -9.330 -3.410 2.470 269 H5' DC 148 H5' C 148 -12.542 -0.841 2.044 270 H5'' DC 148 H5" C 148 -13.869 -1.995 1.806 271 H4' DC 148 H4' C 148 -12.751 -1.659 -0.319 272 H3' DC 148 H3' C 148 -13.119 -4.194 0.878 273 H2' DC 148 H2' C 148 -10.898 -4.501 1.437 274 H2'' DC 148 H2" C 148 -10.811 -5.226 -0.177 275 H1' DC 148 H1' C 148 -10.158 -3.138 -1.194 276 H41 DC 148 1H4 C 148 -4.183 -3.276 0.945 277 H42 DC 148 2H4 C 148 -4.702 -3.576 2.605 278 H8 DG 149 8H G 149 -9.200 -6.915 -1.033 279 H1 DG 149 1H G 149 -2.848 -5.899 -1.096 280 H5' DG 149 H5' G 149 -10.739 -3.540 -3.118 281 H5'' DG 149 H5" G 149 -12.028 -4.170 -4.155 282 H4' DG 149 H4' G 149 -10.121 -4.551 -5.398 283 H3' DG 149 H3' G 149 -11.509 -6.824 -4.561 284 H2' DG 149 H2' G 149 -10.021 -7.445 -2.930 285 H2'' DG 149 H2" G 149 -9.209 -8.298 -4.237 286 H1' DG 149 H1' G 149 -7.597 -6.506 -4.542 287 H21 DG 149 1H2 G 149 -2.189 -5.585 -3.131 288 H22 DG 149 2H2 G 149 -3.316 -5.502 -4.469 289 H5 DC 150 5H C 150 -6.963 -9.568 -1.710 290 H6 DC 150 6H C 150 -7.101 -9.862 -4.125 291 H5' DC 150 H5' C 150 -8.133 -9.169 -5.815 292 H5'' DC 150 H5" C 150 -7.974 -7.475 -6.333 293 H4' DC 150 H4' C 150 -6.650 -8.193 -8.282 294 H3' DC 150 H3' C 150 -7.703 -10.705 -7.784 295 H2' DC 150 H2' C 150 -6.705 -11.141 -5.773 296 H2'' DC 150 H2" C 150 -5.368 -11.639 -6.772 297 H1' DC 150 H1' C 150 -4.097 -9.694 -6.379 298 H41 DC 150 1H4 C 150 -3.717 -9.339 -0.018 299 H42 DC 150 2H4 C 150 -5.462 -9.474 0.181 300 H5 DC 151 5H C 151 -5.141 -12.904 -4.318 301 H6 DC 151 6H C 151 -3.956 -12.920 -6.453 302 H5' DC 151 H5' C 151 -3.476 -10.223 -9.057 303 H5'' DC 151 H5" C 151 -3.196 -11.129 -10.555 304 H4' DC 151 H4' C 151 -1.094 -10.975 -9.501 305 H3' DC 151 H3' C 151 -2.124 -13.531 -9.925 306 H2' DC 151 H2' C 151 -2.718 -13.995 -7.746 307 H2'' DC 151 H2" C 151 -1.031 -14.527 -7.644 308 H1' DC 151 H1' C 151 -0.257 -12.479 -6.738 309 H41 DC 151 1H4 C 151 -3.266 -12.939 -1.184 310 H42 DC 151 2H4 C 151 -4.836 -12.942 -1.953 311 H5 DC 152 5H C 152 -3.128 -15.893 -4.994 312 H6 DC 152 6H C 152 -0.931 -15.844 -6.066 313 H5' DC 152 H5' C 152 1.770 -13.257 -7.578 314 H5'' DC 152 H5" C 152 3.050 -14.087 -8.493 315 H4' DC 152 H4' C 152 3.535 -14.630 -6.263 316 H3' DC 152 H3' C 152 2.540 -16.768 -7.937 317 H2' DC 152 H2' C 152 0.734 -17.230 -6.602 318 H2'' DC 152 H2" C 152 1.916 -18.104 -5.604 319 H1' DC 152 H1' C 152 2.250 -16.231 -4.143 320 H41 DC 152 1H4 C 152 -3.403 -16.217 -1.329 321 H42 DC 152 2H4 C 152 -4.240 -15.956 -2.848 322 H5 DC 153 5H C 153 -1.350 -19.701 -4.690 323 H6 DC 153 6H C 153 1.072 -20.022 -4.443 324 H5' DC 153 H5' C 153 4.591 -17.640 -3.993 325 H5'' DC 153 H5" C 153 5.935 -18.745 -4.330 326 H4' DC 153 H4' C 153 5.197 -19.308 -2.166 327 H3' DC 153 H3' C 153 4.842 -21.281 -4.231 328 H2' DC 153 H2' C 153 2.572 -21.375 -4.040 329 H2'' DC 153 H2" C 153 2.887 -22.332 -2.590 330 H1' DC 153 H1' C 153 2.707 -20.453 -1.107 331 H41 DC 153 1H4 C 153 -3.511 -19.131 -1.754 332 H42 DC 153 2H4 C 153 -3.454 -19.490 -3.470 333 H5 DC 154 5H C 154 -0.123 -22.900 -3.122 334 H6 DC 154 6H C 154 1.693 -23.604 -1.634 335 H5' DC 154 H5' C 154 4.661 -21.826 0.143 336 H5'' DC 154 H5" C 154 5.771 -23.121 0.638 337 H4' DC 154 H4' C 154 4.002 -23.022 2.271 338 H3' DC 154 H3' C 154 4.537 -25.337 0.636 339 H2' DC 154 H2' C 154 2.469 -25.435 -0.387 340 H2'' DC 154 H2" C 154 1.958 -26.134 1.183 341 H1' DC 154 H1' C 154 1.193 -24.066 2.027 342 H41 DC 154 1H4 C 154 -3.579 -22.646 -1.882 343 H42 DC 154 2H4 C 154 -2.483 -22.408 -3.228 344 H8 DG 155 8H G 155 0.582 -27.557 0.964 345 H1 DG 155 1H G 155 -5.488 -25.858 -0.269 346 H5' DG 155 H5' G 155 2.306 -25.506 4.569 347 H5'' DG 155 H5" G 155 2.776 -26.856 5.630 348 H4' DG 155 H4' G 155 0.397 -26.440 5.921 349 H3' DG 155 H3' G 155 1.453 -28.937 5.087 350 H2' DG 155 H2' G 155 0.575 -28.848 2.930 351 H2'' DG 155 H2" G 155 -0.867 -29.514 3.752 352 H1' DG 155 H1' G 155 -1.832 -27.343 4.042 353 H21 DG 155 1H2 G 155 -6.680 -25.942 1.563 354 H22 DG 155 2H2 G 155 -5.963 -26.365 3.111 355 H5 DC 156 5H C 156 -1.603 -30.544 1.178 356 H6 DC 156 6H C 156 -2.486 -30.913 3.438 357 H5' DC 156 H5' C 156 -2.732 -28.683 6.890 358 H5'' DC 156 H5" C 156 -3.061 -29.914 8.127 359 H4' DC 156 H4' C 156 -5.124 -29.436 6.960 360 H3' DC 156 H3' C 156 -3.985 -32.071 6.930 361 H2' DC 156 H2' C 156 -3.833 -32.297 4.634 362 H2'' DC 156 H2" C 156 -5.620 -32.467 4.744 363 H1' DC 156 H1' C 156 -6.067 -30.256 4.299 364 H41 DC 156 1H4 C 156 -3.798 -29.310 -1.503 365 H42 DC 156 2H4 C 156 -2.156 -29.662 -1.005 366 H8 DG 157 8H G 157 -6.436 -34.873 4.677 367 H1 DG 157 1H G 157 -6.900 -32.156 -1.116 368 H5' DG 157 H5' G 157 -8.782 -31.580 7.386 369 H5'' DG 157 H5" G 157 -9.530 -32.873 8.350 370 H4' DG 157 H4' G 157 -10.801 -32.362 6.254 371 H3' DG 157 H3' G 157 -10.179 -34.939 7.125 372 H2' DG 157 H2' G 157 -8.409 -35.333 5.630 373 H2'' DG 157 H2" G 157 -9.761 -35.919 4.601 374 H1' DG 157 H1' G 157 -10.017 -33.798 3.556 375 H21 DG 157 1H2 G 157 -9.003 -31.767 -1.565 376 H22 DG 157 2H2 G 157 -10.249 -31.956 -0.348 377 HA ALA 1 HA ALA 1 15.662 32.934 -9.322 378 H1 ALA 1 HN ALA 1 16.746 34.667 -10.904 379 HB1 ALA 1 1HB ALA 1 17.005 34.825 -8.447 380 HB2 ALA 1 2HB ALA 1 15.580 35.887 -8.541 381 HB3 ALA 1 3HB ALA 1 15.597 34.511 -7.415 382 H SER 2 HN SER 2 13.640 34.804 -11.255 383 HA SER 2 HA SER 2 11.267 34.843 -9.545 384 HG SER 2 HG SER 2 11.328 34.237 -12.957 385 HB2 SER 2 2HB SER 2 10.119 35.620 -11.581 386 HB3 SER 2 3HB SER 2 11.623 36.529 -11.337 387 H GLU 3 HN GLU 3 11.459 32.500 -8.953 388 HA GLU 3 HA GLU 3 9.803 30.875 -10.811 389 HB2 GLU 3 2HB GLU 3 12.635 30.547 -10.624 390 HB3 GLU 3 3HB GLU 3 11.960 29.223 -9.696 391 HG2 GLU 3 2HG GLU 3 11.126 29.910 -12.551 392 HG3 GLU 3 3HG GLU 3 12.408 28.773 -12.141 393 H LYS 4 HN LYS 4 8.946 28.899 -9.756 394 HA LYS 4 HA LYS 4 8.122 29.434 -7.010 395 HB2 LYS 4 2HB LYS 4 6.792 27.451 -7.227 396 HB3 LYS 4 3HB LYS 4 6.695 28.307 -8.763 397 HG2 LYS 4 2HG LYS 4 8.412 26.710 -9.708 398 HG3 LYS 4 3HG LYS 4 8.411 25.850 -8.162 399 HD2 LYS 4 2HD LYS 4 5.966 25.398 -8.439 400 HD3 LYS 4 3HD LYS 4 6.025 26.204 -10.014 401 HE2 LYS 4 2HE LYS 4 6.149 23.814 -10.363 402 HE3 LYS 4 3HE LYS 4 7.710 24.528 -10.791 403 HZ1 LYS 4 3HZ LYS 4 8.601 23.773 -8.748 404 HZ2 LYS 4 1HZ LYS 4 7.812 22.492 -9.448 405 HZ3 LYS 4 2HZ LYS 4 7.129 23.294 -8.180 406 H ARG 5 HN ARG 5 8.419 27.929 -5.209 407 HA ARG 5 HA ARG 5 11.162 26.962 -4.952 408 HE ARG 5 HE ARG 5 6.791 24.468 -1.078 409 HB2 ARG 5 2HB ARG 5 10.560 26.423 -2.687 410 HB3 ARG 5 3HB ARG 5 9.839 27.965 -3.082 411 HG2 ARG 5 2HG ARG 5 8.043 27.049 -2.024 412 HG3 ARG 5 3HG ARG 5 7.686 26.434 -3.638 413 HD2 ARG 5 2HD ARG 5 9.033 24.332 -2.940 414 HD3 ARG 5 3HD ARG 5 9.046 24.993 -1.316 415 HH11 ARG 5 2HH2 ARG 5 7.581 23.931 -4.519 416 HH12 ARG 5 1HH2 ARG 5 6.246 22.801 -4.671 417 HH21 ARG 5 1HH1 ARG 5 5.074 23.147 -1.475 418 HH22 ARG 5 2HH1 ARG 5 4.871 22.454 -3.073 419 HA PRO 6 HA PRO 6 10.351 22.875 -6.455 420 HB2 PRO 6 2HB PRO 6 12.500 21.507 -5.459 421 HB3 PRO 6 3HB PRO 6 12.657 22.787 -6.697 422 HG2 PRO 6 2HG PRO 6 13.056 23.046 -3.698 423 HG3 PRO 6 3HG PRO 6 14.143 23.605 -5.010 424 HD2 PRO 6 2HD PRO 6 12.337 25.259 -3.778 425 HD3 PRO 6 3HD PRO 6 12.743 25.427 -5.518 426 H PHE 7 HN PHE 7 9.404 20.939 -5.866 427 HA PHE 7 HA PHE 7 8.454 20.658 -3.079 428 HD1 PHE 7 1HD PHE 7 5.437 20.028 -3.359 429 HD2 PHE 7 2HD PHE 7 7.424 20.378 -7.168 430 HE1 PHE 7 1HE PHE 7 3.525 21.349 -4.249 431 HE2 PHE 7 2HE PHE 7 5.494 21.670 -8.051 432 HZ PHE 7 HZ PHE 7 3.584 22.222 -6.566 433 HB2 PHE 7 2HB PHE 7 8.203 18.800 -5.480 434 HB3 PHE 7 3HB PHE 7 7.371 18.601 -3.947 435 H MET 8 HN MET 8 9.006 18.861 -1.698 436 HA MET 8 HA MET 8 11.166 17.098 -2.695 437 HB2 MET 8 2HB MET 8 12.443 17.194 -0.647 438 HB3 MET 8 3HB MET 8 12.361 18.781 -1.383 439 HG2 MET 8 2HG MET 8 10.721 17.824 1.002 440 HG3 MET 8 3HG MET 8 12.169 18.806 1.084 441 HE1 MET 8 3HE MET 8 12.337 21.338 0.222 442 HE2 MET 8 1HE MET 8 11.623 20.948 -1.363 443 HE3 MET 8 2HE MET 8 10.945 22.263 -0.389 444 H CYS 9 HN CYS 9 11.320 15.063 -1.736 445 HA CYS 9 HA CYS 9 8.847 14.050 -0.480 446 HB2 CYS 9 2HB CYS 9 10.149 12.680 -2.086 447 HB3 CYS 9 3HB CYS 9 11.546 12.706 -1.028 448 H ALA 10 HN ALA 10 9.501 12.382 1.482 449 HA ALA 10 HA ALA 10 11.112 13.908 3.490 450 HB1 ALA 10 1HB ALA 10 9.365 13.501 5.191 451 HB2 ALA 10 2HB ALA 10 8.730 14.469 3.844 452 HB3 ALA 10 3HB ALA 10 8.329 12.740 3.960 453 H TYR 11 HN TYR 11 10.140 10.859 2.066 454 HA TYR 11 HA TYR 11 10.686 9.093 4.202 455 HD1 TYR 11 1HD TYR 11 9.186 6.882 3.979 456 HD2 TYR 11 2HD TYR 11 12.440 6.612 1.185 457 HE1 TYR 11 1HE TYR 11 9.538 4.486 4.615 458 HE2 TYR 11 2HE TYR 11 12.815 4.226 1.845 459 HH TYR 11 HH TYR 11 10.655 2.503 4.004 460 HB2 TYR 11 2HB TYR 11 9.562 8.551 2.029 461 HB3 TYR 11 3HB TYR 11 11.142 8.587 1.254 462 HA PRO 12 HA PRO 12 15.060 9.506 4.939 463 HB2 PRO 12 2HB PRO 12 14.793 6.545 5.551 464 HB3 PRO 12 3HB PRO 12 15.629 7.813 6.499 465 HG2 PRO 12 2HG PRO 12 13.185 6.949 7.259 466 HG3 PRO 12 3HG PRO 12 13.548 8.707 7.268 467 HD2 PRO 12 2HD PRO 12 11.990 7.120 5.228 468 HD3 PRO 12 3HD PRO 12 11.676 8.749 5.920 469 H GLY 13 HN GLY 13 13.852 6.729 3.011 470 HA2 GLY 13 2HA GLY 13 16.462 6.208 1.796 471 HA3 GLY 13 3HA GLY 13 14.922 5.437 1.379 472 H CYS 14 HN CYS 14 14.550 8.818 1.349 473 HA CYS 14 HA CYS 14 15.392 9.152 -1.479 474 HB2 CYS 14 2HB CYS 14 13.169 8.265 -1.736 475 HB3 CYS 14 3HB CYS 14 12.545 9.298 -0.445 476 H ASN 15 HN ASN 15 12.926 11.080 0.191 477 HA ASN 15 HA ASN 15 12.858 13.318 0.697 478 HB2 ASN 15 2HB ASN 15 14.491 12.298 2.494 479 HB3 ASN 15 3HB ASN 15 15.746 13.192 1.648 480 HD21 ASN 15 1HD2 ASN 15 14.836 15.594 1.140 481 HD22 ASN 15 2HD2 ASN 15 14.135 16.373 2.600 482 H LYS 16 HN LYS 16 13.454 12.731 -2.011 483 HA LYS 16 HA LYS 16 15.581 14.706 -2.774 484 HB2 LYS 16 2HB LYS 16 15.759 13.639 -4.828 485 HB3 LYS 16 3HB LYS 16 15.491 12.306 -3.726 486 HG2 LYS 16 2HG LYS 16 13.022 12.357 -4.480 487 HG3 LYS 16 3HG LYS 16 13.499 13.564 -5.661 488 HD2 LYS 16 2HD LYS 16 13.597 11.716 -6.957 489 HD3 LYS 16 3HD LYS 16 15.277 11.801 -6.449 490 HE2 LYS 16 2HE LYS 16 13.115 10.028 -5.207 491 HE3 LYS 16 3HE LYS 16 14.278 9.501 -6.435 492 HZ1 LYS 16 3HZ LYS 16 15.072 8.844 -4.348 493 HZ2 LYS 16 1HZ LYS 16 14.785 10.300 -3.672 494 HZ3 LYS 16 2HZ LYS 16 16.023 10.134 -4.772 495 H ARG 17 HN ARG 17 14.987 15.927 -4.890 496 HA ARG 17 HA ARG 17 12.523 17.369 -4.133 497 HE ARG 17 HE ARG 17 14.474 20.307 -7.300 498 HB2 ARG 17 2HB ARG 17 13.532 19.244 -5.412 499 HB3 ARG 17 3HB ARG 17 14.538 18.683 -4.085 500 HG2 ARG 17 2HG ARG 17 16.035 17.509 -5.635 501 HG3 ARG 17 3HG ARG 17 15.021 17.947 -7.017 502 HD2 ARG 17 2HD ARG 17 16.369 19.971 -5.189 503 HD3 ARG 17 3HD ARG 17 17.069 19.362 -6.700 504 HH11 ARG 17 2HH1 ARG 17 17.564 21.677 -6.329 505 HH12 ARG 17 1HH1 ARG 17 17.255 23.179 -7.174 506 HH21 ARG 17 1HH2 ARG 17 14.174 22.227 -8.380 507 HH22 ARG 17 2HH2 ARG 17 15.399 23.471 -8.302 508 H TYR 18 HN TYR 18 10.823 17.677 -5.398 509 HA TYR 18 HA TYR 18 10.890 16.628 -8.195 510 HD1 TYR 18 2HD TYR 18 10.049 15.234 -4.630 511 HD2 TYR 18 1HD TYR 18 8.875 14.181 -8.653 512 HE1 TYR 18 2HE TYR 18 10.749 12.894 -4.253 513 HE2 TYR 18 1HE TYR 18 9.706 11.894 -8.294 514 HH TYR 18 HH TYR 18 10.882 10.787 -5.191 515 HB2 TYR 18 2HB TYR 18 8.718 16.794 -6.092 516 HB3 TYR 18 3HB TYR 18 8.391 16.397 -7.764 517 H PHE 19 HN PHE 19 9.162 17.635 -9.638 518 HA PHE 19 HA PHE 19 9.133 20.607 -9.194 519 HD1 PHE 19 2HD PHE 19 10.921 22.084 -10.082 520 HD2 PHE 19 1HD PHE 19 8.464 20.845 -13.401 521 HE1 PHE 19 2HE PHE 19 10.849 24.424 -10.908 522 HE2 PHE 19 1HE PHE 19 8.395 23.191 -14.219 523 HZ PHE 19 HZ PHE 19 9.587 24.979 -12.966 524 HB2 PHE 19 2HB PHE 19 10.740 19.619 -10.933 525 HB3 PHE 19 3HB PHE 19 9.318 19.187 -11.880 526 H LYS 20 HN LYS 20 7.333 17.754 -10.283 527 HA LYS 20 HA LYS 20 4.970 19.481 -10.947 528 HB2 LYS 20 2HB LYS 20 5.911 16.807 -11.906 529 HB3 LYS 20 3HB LYS 20 4.164 16.961 -11.612 530 HG2 LYS 20 2HG LYS 20 4.639 17.456 -13.904 531 HG3 LYS 20 3HG LYS 20 4.096 18.926 -13.090 532 HD2 LYS 20 2HD LYS 20 6.440 19.728 -12.953 533 HD3 LYS 20 3HD LYS 20 7.011 18.205 -13.656 534 HE2 LYS 20 2HE LYS 20 7.008 19.851 -15.399 535 HE3 LYS 20 3HE LYS 20 5.687 18.721 -15.729 536 HZ1 LYS 20 3HZ LYS 20 4.169 20.328 -14.778 537 HZ2 LYS 20 1HZ LYS 20 5.013 21.009 -16.015 538 HZ3 LYS 20 2HZ LYS 20 5.403 21.369 -14.455 539 H LEU 21 HN LEU 21 3.528 19.752 -9.397 540 HA LEU 21 HA LEU 21 3.632 18.722 -6.817 541 HG LEU 21 HG LEU 21 1.420 18.970 -5.534 542 HB2 LEU 21 2HB LEU 21 2.266 20.620 -7.505 543 HB3 LEU 21 3HB LEU 21 1.207 19.616 -8.451 544 HD11 LEU 21 1HD1 LEU 21 -0.265 20.743 -5.000 545 HD12 LEU 21 2HD1 LEU 21 -0.075 21.391 -6.640 546 HD13 LEU 21 3HD1 LEU 21 1.288 21.425 -5.496 547 HD21 LEU 21 3HD2 LEU 21 -0.928 19.115 -7.479 548 HD22 LEU 21 1HD2 LEU 21 -1.039 18.641 -5.773 549 HD23 LEU 21 2HD2 LEU 21 -0.134 17.634 -6.888 550 H SER 22 HN SER 22 1.547 17.487 -9.499 551 HA SER 22 HA SER 22 0.469 15.298 -7.988 552 HG SER 22 HG SER 22 0.178 15.902 -11.994 553 HB2 SER 22 2HB SER 22 -0.246 14.474 -10.264 554 HB3 SER 22 3HB SER 22 -0.741 16.133 -9.871 555 H HIS 23 HN HIS 23 3.416 15.634 -9.912 556 HA HIS 23 HA HIS 23 3.768 12.737 -10.314 557 HD1 HIS 23 1HD HIS 23 7.558 13.944 -12.675 558 HD2 HIS 23 2HD HIS 23 6.770 15.870 -9.043 559 HE1 HIS 23 1HE HIS 23 9.574 15.429 -12.174 560 HB2 HIS 23 2HB HIS 23 5.408 13.238 -11.635 561 HB3 HIS 23 3HB HIS 23 4.748 14.804 -11.703 562 H LEU 24 HN LEU 24 4.977 15.310 -8.158 563 HA LEU 24 HA LEU 24 6.436 13.568 -6.435 564 HG LEU 24 HG LEU 24 7.299 16.293 -4.357 565 HB2 LEU 24 2HB LEU 24 6.644 16.009 -6.475 566 HB3 LEU 24 3HB LEU 24 5.059 16.216 -5.841 567 HD11 LEU 24 1HD1 LEU 24 5.076 16.958 -3.602 568 HD12 LEU 24 2HD1 LEU 24 5.943 16.044 -2.356 569 HD13 LEU 24 3HD1 LEU 24 4.656 15.257 -3.293 570 HD21 LEU 24 3HD2 LEU 24 7.622 13.686 -4.701 571 HD22 LEU 24 1HD2 LEU 24 6.434 13.594 -3.381 572 HD23 LEU 24 2HD2 LEU 24 7.927 14.468 -3.147 573 H GLN 25 HN GLN 25 3.013 14.717 -6.282 574 HA GLN 25 HA GLN 25 2.323 13.489 -3.828 575 HB2 GLN 25 2HB GLN 25 0.897 15.107 -5.076 576 HB3 GLN 25 3HB GLN 25 0.578 13.881 -6.312 577 HG2 GLN 25 2HG GLN 25 -1.284 14.108 -4.720 578 HG3 GLN 25 3HG GLN 25 -0.611 12.485 -4.702 579 HE21 GLN 25 1HE2 GLN 25 0.678 11.801 -2.776 580 HE22 GLN 25 2HE2 GLN 25 0.430 12.769 -1.297 581 H MET 26 HN MET 26 2.297 12.137 -7.175 582 HA MET 26 HA MET 26 1.362 9.510 -6.386 583 HB2 MET 26 2HB MET 26 1.765 10.786 -8.807 584 HB3 MET 26 3HB MET 26 3.151 9.695 -8.775 585 HG2 MET 26 2HG MET 26 0.213 8.987 -8.390 586 HG3 MET 26 3HG MET 26 1.151 8.706 -9.852 587 HE1 MET 26 3HE MET 26 -0.166 6.275 -9.555 588 HE2 MET 26 1HE MET 26 0.160 5.172 -8.184 589 HE3 MET 26 2HE MET 26 -0.728 6.673 -7.908 590 H HIS 27 HN HIS 27 4.619 11.019 -6.779 591 HA HIS 27 HA HIS 27 6.189 8.697 -6.459 592 HD1 HIS 27 1HD HIS 27 8.841 8.379 -6.046 593 HD2 HIS 27 2HD HIS 27 8.138 11.745 -3.604 594 HE1 HIS 27 1HE HIS 27 10.424 8.201 -4.010 595 HB2 HIS 27 2HB HIS 27 7.328 10.718 -7.090 596 HB3 HIS 27 3HB HIS 27 6.707 11.614 -5.703 597 H SER 28 HN SER 28 4.751 10.853 -3.972 598 HA SER 28 HA SER 28 5.920 9.712 -1.702 599 HG SER 28 HG SER 28 5.241 11.056 -0.027 600 HB2 SER 28 2HB SER 28 4.312 11.753 -2.021 601 HB3 SER 28 3HB SER 28 3.017 10.603 -1.751 602 H ARG 29 HN ARG 29 3.198 8.539 -3.680 603 HA ARG 29 HA ARG 29 2.081 6.638 -1.867 604 HE ARG 29 HE ARG 29 1.486 3.719 -5.659 605 HB2 ARG 29 2HB ARG 29 1.310 7.468 -4.220 606 HB3 ARG 29 3HB ARG 29 2.325 6.189 -4.863 607 HG2 ARG 29 2HG ARG 29 -0.034 5.855 -2.973 608 HG3 ARG 29 3HG ARG 29 -0.058 5.604 -4.716 609 HD2 ARG 29 2HD ARG 29 1.386 3.916 -2.658 610 HD3 ARG 29 3HD ARG 29 -0.019 3.503 -3.601 611 HH11 ARG 29 1HH2 ARG 29 2.952 2.682 -2.630 612 HH12 ARG 29 2HH2 ARG 29 3.917 1.460 -3.439 613 HH21 ARG 29 1HH1 ARG 29 2.891 2.381 -6.592 614 HH22 ARG 29 2HH1 ARG 29 3.982 1.395 -5.629 615 H LYS 30 HN LYS 30 4.933 6.498 -4.036 616 HA LYS 30 HA LYS 30 5.383 3.678 -3.980 617 HB2 LYS 30 2HB LYS 30 6.530 5.207 -5.504 618 HB3 LYS 30 3HB LYS 30 7.363 5.993 -4.171 619 HG2 LYS 30 2HG LYS 30 7.826 3.047 -4.492 620 HG3 LYS 30 3HG LYS 30 8.499 4.136 -5.706 621 HD2 LYS 30 2HD LYS 30 9.606 5.478 -3.915 622 HD3 LYS 30 3HD LYS 30 9.043 4.307 -2.712 623 HE2 LYS 30 2HE LYS 30 10.288 2.510 -3.851 624 HE3 LYS 30 3HE LYS 30 10.818 3.655 -5.100 625 HZ1 LYS 30 3HZ LYS 30 12.491 3.351 -3.419 626 HZ2 LYS 30 1HZ LYS 30 11.450 3.794 -2.229 627 HZ3 LYS 30 2HZ LYS 30 11.938 4.906 -3.354 628 H HIS 31 HN HIS 31 6.130 6.225 -1.593 629 HA HIS 31 HA HIS 31 7.905 4.442 -0.071 630 HD1 HIS 31 1HD HIS 31 10.040 4.986 -0.248 631 HD2 HIS 31 2HD HIS 31 8.629 8.940 -0.774 632 HE1 HIS 31 1HE HIS 31 11.908 6.296 -1.343 633 HB2 HIS 31 2HB HIS 31 6.896 7.280 0.365 634 HB3 HIS 31 3HB HIS 31 7.890 6.413 1.543 635 H THR 32 HN THR 32 4.532 5.709 0.270 636 HA THR 32 HA THR 32 3.835 4.784 2.708 637 HB THR 32 HB THR 32 1.579 4.356 1.937 638 HG1 THR 32 1HG THR 32 2.667 4.320 -0.710 639 HG21 THR 32 3HG2 THR 32 1.044 6.395 0.720 640 HG22 THR 32 1HG2 THR 32 2.749 6.634 0.297 641 HG23 THR 32 2HG2 THR 32 2.235 6.717 1.992 642 H GLY 33 HN GLY 33 4.739 2.674 0.029 643 HA2 GLY 33 2HA GLY 33 3.817 0.240 1.480 644 HA3 GLY 33 3HA GLY 33 4.482 0.301 -0.162 645 H GLU 34 HN GLU 34 6.360 2.207 1.955 646 HA GLU 34 HA GLU 34 8.331 -0.029 2.378 647 HB2 GLU 34 2HB GLU 34 8.906 2.883 1.617 648 HB3 GLU 34 3HB GLU 34 10.116 1.619 1.919 649 HG2 GLU 34 2HG GLU 34 9.237 0.277 0.056 650 HG3 GLU 34 3HG GLU 34 8.085 1.557 -0.333 651 H LYS 35 HN LYS 35 6.280 1.029 4.264 652 HA LYS 35 HA LYS 35 7.783 2.691 6.201 653 HB2 LYS 35 2HB LYS 35 5.004 1.460 6.279 654 HB3 LYS 35 3HB LYS 35 5.664 2.505 7.540 655 HG2 LYS 35 2HG LYS 35 5.358 3.371 4.622 656 HG3 LYS 35 3HG LYS 35 4.122 3.615 5.845 657 HD2 LYS 35 2HD LYS 35 5.632 4.984 7.197 658 HD3 LYS 35 3HD LYS 35 6.966 4.725 6.065 659 HE2 LYS 35 2HE LYS 35 4.324 5.953 5.216 660 HE3 LYS 35 3HE LYS 35 5.653 6.918 5.878 661 HZ1 LYS 35 3HZ LYS 35 5.670 6.823 3.460 662 HZ2 LYS 35 1HZ LYS 35 5.923 5.186 3.506 663 HZ3 LYS 35 2HZ LYS 35 7.048 6.209 4.113 664 HA PRO 36 HA PRO 36 9.384 -1.189 7.774 665 HB2 PRO 36 2HB PRO 36 11.188 -0.172 9.598 666 HB3 PRO 36 3HB PRO 36 11.434 -0.114 7.832 667 HG2 PRO 36 2HG PRO 36 10.353 2.084 9.620 668 HG3 PRO 36 3HG PRO 36 11.639 2.195 8.377 669 HD2 PRO 36 2HD PRO 36 9.061 2.893 7.866 670 HD3 PRO 36 3HD PRO 36 10.087 2.103 6.626 671 H TYR 37 HN TYR 37 7.771 -2.236 8.878 672 HA TYR 37 HA TYR 37 7.357 -1.399 11.747 673 HD1 TYR 37 1HD TYR 37 4.798 -0.627 12.778 674 HD2 TYR 37 2HD TYR 37 4.896 -0.800 8.470 675 HE1 TYR 37 1HE TYR 37 3.379 1.409 12.672 676 HE2 TYR 37 2HE TYR 37 3.512 1.282 8.368 677 HH TYR 37 HH TYR 37 2.644 3.171 11.109 678 HB2 TYR 37 2HB TYR 37 5.470 -2.733 9.770 679 HB3 TYR 37 3HB TYR 37 5.210 -2.772 11.482 680 H GLN 38 HN GLN 38 6.910 -3.227 13.238 681 HA GLN 38 HA GLN 38 7.807 -5.879 12.263 682 HB2 GLN 38 2HB GLN 38 9.153 -6.329 14.134 683 HB3 GLN 38 3HB GLN 38 9.728 -4.803 13.487 684 HG2 GLN 38 2HG GLN 38 9.213 -3.651 15.405 685 HG3 GLN 38 3HG GLN 38 7.759 -4.572 15.754 686 HE21 GLN 38 1HE2 GLN 38 7.898 -6.658 16.922 687 HE22 GLN 38 2HE2 GLN 38 9.412 -7.028 17.752 688 H CYS 39 HN CYS 39 6.936 -7.652 13.444 689 HA CYS 39 HA CYS 39 4.258 -7.413 14.221 690 HB2 CYS 39 2HB CYS 39 5.385 -9.585 13.696 691 HB3 CYS 39 3HB CYS 39 6.225 -9.496 15.273 692 H ASP 40 HN ASP 40 3.161 -6.828 16.027 693 HA ASP 40 HA ASP 40 4.556 -5.489 18.184 694 HB2 ASP 40 2HB ASP 40 1.652 -6.404 18.000 695 HB3 ASP 40 3HB ASP 40 2.306 -5.252 19.160 696 H PHE 41 HN PHE 41 3.550 -8.793 17.566 697 HA PHE 41 HA PHE 41 3.463 -9.672 20.317 698 HD1 PHE 41 1HD PHE 41 1.154 -11.275 20.178 699 HD2 PHE 41 2HD PHE 41 4.596 -13.498 18.850 700 HE1 PHE 41 1HE PHE 41 0.267 -13.315 21.286 701 HE2 PHE 41 2HE PHE 41 3.718 -15.529 19.959 702 HZ PHE 41 HZ PHE 41 1.551 -15.444 21.183 703 HB2 PHE 41 2HB PHE 41 2.513 -10.717 18.121 704 HB3 PHE 41 3HB PHE 41 4.092 -11.385 17.892 705 H LYS 42 HN LYS 42 5.220 -9.468 21.603 706 HA LYS 42 HA LYS 42 7.858 -9.063 20.740 707 HB2 LYS 42 2HB LYS 42 8.521 -9.394 23.057 708 HB3 LYS 42 3HB LYS 42 6.992 -8.514 23.003 709 HG2 LYS 42 2HG LYS 42 5.763 -10.625 23.530 710 HG3 LYS 42 3HG LYS 42 7.308 -11.495 23.569 711 HD2 LYS 42 2HD LYS 42 8.071 -10.143 25.469 712 HD3 LYS 42 3HD LYS 42 6.566 -9.207 25.423 713 HE2 LYS 42 2HE LYS 42 6.423 -10.887 27.177 714 HE3 LYS 42 3HE LYS 42 5.259 -11.258 25.895 715 HZ1 LYS 42 3HZ LYS 42 6.483 -13.201 26.668 716 HZ2 LYS 42 1HZ LYS 42 7.905 -12.537 26.162 717 HZ3 LYS 42 2HZ LYS 42 6.735 -12.924 25.069 718 H ASP 43 HN ASP 43 6.152 -12.094 20.961 719 HA ASP 43 HA ASP 43 8.665 -13.679 21.019 720 HB2 ASP 43 2HB ASP 43 5.750 -14.575 21.052 721 HB3 ASP 43 3HB ASP 43 7.156 -15.615 21.286 722 H CYS 44 HN CYS 44 6.931 -12.094 18.666 723 HA CYS 44 HA CYS 44 7.176 -14.265 16.631 724 HB2 CYS 44 2HB CYS 44 5.028 -13.118 16.682 725 HB3 CYS 44 3HB CYS 44 5.807 -11.533 16.517 726 H GLU 45 HN GLU 45 7.714 -10.660 16.629 727 HA GLU 45 HA GLU 45 9.524 -9.396 16.017 728 HB2 GLU 45 2HB GLU 45 11.122 -12.023 16.264 729 HB3 GLU 45 3HB GLU 45 11.828 -10.482 15.919 730 HG2 GLU 45 2HG GLU 45 10.177 -11.051 18.405 731 HG3 GLU 45 3HG GLU 45 11.936 -11.074 18.312 732 H ARG 46 HN ARG 46 7.709 -10.703 14.038 733 HA ARG 46 HA ARG 46 9.357 -11.036 11.605 734 HE ARG 46 HE ARG 46 7.041 -13.400 12.810 735 HB2 ARG 46 2HB ARG 46 6.586 -11.509 12.328 736 HB3 ARG 46 3HB ARG 46 6.598 -10.373 11.035 737 HG2 ARG 46 2HG ARG 46 6.427 -12.614 10.160 738 HG3 ARG 46 3HG ARG 46 7.924 -11.858 9.615 739 HD2 ARG 46 2HD ARG 46 8.216 -14.234 10.229 740 HD3 ARG 46 3HD ARG 46 9.230 -13.173 11.219 741 HH11 ARG 46 1HH2 ARG 46 8.981 -15.931 11.327 742 HH12 ARG 46 2HH2 ARG 46 8.576 -17.051 12.619 743 HH21 ARG 46 1HH1 ARG 46 6.641 -14.730 14.298 744 HH22 ARG 46 2HH1 ARG 46 7.278 -16.385 14.346 745 H ARG 47 HN ARG 47 8.741 -9.538 9.684 746 HA ARG 47 HA ARG 47 8.489 -6.719 10.632 747 HE ARG 47 HE ARG 47 11.466 -8.537 12.719 748 HB2 ARG 47 2HB ARG 47 10.394 -7.584 8.444 749 HB3 ARG 47 3HB ARG 47 10.276 -5.997 9.191 750 HG2 ARG 47 2HG ARG 47 11.293 -8.537 10.545 751 HG3 ARG 47 3HG ARG 47 12.301 -7.278 9.857 752 HD2 ARG 47 2HD ARG 47 12.017 -5.848 11.593 753 HD3 ARG 47 3HD ARG 47 10.319 -6.280 11.821 754 HH11 ARG 47 2HH1 ARG 47 12.122 -5.191 13.655 755 HH12 ARG 47 1HH1 ARG 47 12.075 -5.664 15.350 756 HH21 ARG 47 1HH2 ARG 47 11.788 -9.017 14.699 757 HH22 ARG 47 2HH2 ARG 47 12.167 -7.821 15.947 758 H PHE 48 HN PHE 48 7.636 -5.233 9.134 759 HA PHE 48 HA PHE 48 6.441 -6.358 6.643 760 HD1 PHE 48 1HD PHE 48 4.113 -7.813 6.687 761 HD2 PHE 48 2HD PHE 48 5.019 -6.356 10.641 762 HE1 PHE 48 1HE PHE 48 3.854 -10.103 7.592 763 HE2 PHE 48 2HE PHE 48 4.749 -8.657 11.550 764 HZ PHE 48 HZ PHE 48 4.290 -10.538 9.995 765 HB2 PHE 48 2HB PHE 48 4.873 -4.814 8.763 766 HB3 PHE 48 3HB PHE 48 4.261 -5.348 7.202 767 H SER 49 HN SER 49 5.557 -4.584 5.220 768 HA SER 49 HA SER 49 7.330 -2.177 5.513 769 HG SER 49 HG SER 49 6.056 -2.228 2.042 770 HB2 SER 49 2HB SER 49 7.682 -2.209 3.242 771 HB3 SER 49 3HB SER 49 7.528 -3.936 3.549 772 H ARG 50 HN ARG 50 4.211 -2.898 6.162 773 HA ARG 50 HA ARG 50 3.382 -0.121 5.763 774 HE ARG 50 HE ARG 50 -0.844 -1.830 3.098 775 HB2 ARG 50 2HB ARG 50 2.798 -1.290 3.588 776 HB3 ARG 50 3HB ARG 50 1.676 -2.312 4.494 777 HG2 ARG 50 2HG ARG 50 0.277 -0.410 5.032 778 HG3 ARG 50 3HG ARG 50 1.534 0.736 4.542 779 HD2 ARG 50 2HD ARG 50 -0.267 0.610 2.884 780 HD3 ARG 50 3HD ARG 50 1.288 0.117 2.222 781 HH11 ARG 50 2HH1 ARG 50 1.448 -0.866 0.620 782 HH12 ARG 50 1HH1 ARG 50 0.905 -2.189 -0.394 783 HH21 ARG 50 1HH2 ARG 50 -1.302 -3.501 1.753 784 HH22 ARG 50 2HH2 ARG 50 -0.483 -3.617 0.241 785 H SER 51 HN SER 51 1.554 0.473 7.023 786 HA SER 51 HA SER 51 1.270 -0.804 9.517 787 HG SER 51 HG SER 51 1.328 2.078 9.313 788 HB2 SER 51 2HB SER 51 -0.996 0.793 8.304 789 HB3 SER 51 3HB SER 51 -0.396 0.804 9.968 790 H ASP 52 HN ASP 52 -0.849 -0.976 6.615 791 HA ASP 52 HA ASP 52 -2.797 -2.672 7.721 792 HB2 ASP 52 2HB ASP 52 -2.929 -1.395 5.574 793 HB3 ASP 52 3HB ASP 52 -1.879 -2.586 4.821 794 H GLN 53 HN GLN 53 0.313 -3.495 6.135 795 HA GLN 53 HA GLN 53 -0.123 -6.328 5.939 796 HB2 GLN 53 2HB GLN 53 2.389 -4.647 6.203 797 HB3 GLN 53 3HB GLN 53 2.416 -6.395 6.014 798 HG2 GLN 53 2HG GLN 53 1.534 -6.300 3.833 799 HG3 GLN 53 3HG GLN 53 1.108 -4.579 3.971 800 HE21 GLN 53 1HE2 GLN 53 2.555 -3.732 2.246 801 HE22 GLN 53 2HE2 GLN 53 4.309 -3.898 2.530 802 H LEU 54 HN LEU 54 1.496 -4.280 8.427 803 HA LEU 54 HA LEU 54 2.032 -6.401 10.273 804 HG LEU 54 HG LEU 54 1.194 -4.251 12.812 805 HB2 LEU 54 2HB LEU 54 3.139 -4.279 10.479 806 HB3 LEU 54 3HB LEU 54 1.620 -3.405 10.588 807 HD11 LEU 54 1HD1 LEU 54 2.219 -6.514 12.631 808 HD12 LEU 54 2HD1 LEU 54 2.857 -5.608 14.020 809 HD13 LEU 54 3HD1 LEU 54 3.821 -5.775 12.543 810 HD21 LEU 54 3HD2 LEU 54 2.719 -2.935 13.922 811 HD22 LEU 54 1HD2 LEU 54 2.927 -2.316 12.278 812 HD23 LEU 54 2HD2 LEU 54 4.093 -3.487 13.006 813 H LYS 55 HN LYS 55 -0.764 -4.110 10.033 814 HA LYS 55 HA LYS 55 -2.176 -5.047 12.313 815 HB2 LYS 55 2HB LYS 55 -2.624 -2.951 11.000 816 HB3 LYS 55 3HB LYS 55 -3.387 -3.926 9.736 817 HG2 LYS 55 2HG LYS 55 -5.108 -4.681 11.337 818 HG3 LYS 55 3HG LYS 55 -4.253 -3.866 12.661 819 HD2 LYS 55 2HD LYS 55 -4.621 -1.664 11.490 820 HD3 LYS 55 3HD LYS 55 -5.537 -2.518 10.239 821 HE2 LYS 55 2HE LYS 55 -7.091 -1.536 11.807 822 HE3 LYS 55 3HE LYS 55 -7.154 -3.295 11.977 823 HZ1 LYS 55 3HZ LYS 55 -5.718 -3.072 13.906 824 HZ2 LYS 55 1HZ LYS 55 -7.093 -2.189 14.103 825 HZ3 LYS 55 2HZ LYS 55 -5.677 -1.435 13.731 826 H ARG 56 HN ARG 56 -2.345 -6.122 8.877 827 HA ARG 56 HA ARG 56 -4.354 -8.148 9.244 828 HE ARG 56 HE ARG 56 -4.698 -8.552 4.219 829 HB2 ARG 56 2HB ARG 56 -2.045 -7.838 7.285 830 HB3 ARG 56 3HB ARG 56 -3.160 -9.200 7.211 831 HG2 ARG 56 2HG ARG 56 -5.029 -7.831 6.679 832 HG3 ARG 56 3HG ARG 56 -4.206 -6.356 7.167 833 HD2 ARG 56 2HD ARG 56 -4.166 -6.283 4.833 834 HD3 ARG 56 3HD ARG 56 -2.533 -6.763 5.277 835 HH11 ARG 56 1HH2 ARG 56 -1.196 -8.086 4.423 836 HH12 ARG 56 2HH2 ARG 56 -0.946 -9.151 3.033 837 HH21 ARG 56 1HH1 ARG 56 -4.272 -9.864 2.573 838 HH22 ARG 56 2HH1 ARG 56 -2.642 -9.992 1.952 839 H HIS 57 HN HIS 57 -0.766 -8.224 9.431 840 HA HIS 57 HA HIS 57 -0.502 -10.987 9.943 841 HD1 HIS 57 1HD HIS 57 1.743 -12.370 9.968 842 HD2 HIS 57 2HD HIS 57 2.569 -9.516 12.940 843 HE1 HIS 57 1HE HIS 57 3.034 -13.589 11.844 844 HB2 HIS 57 2HB HIS 57 1.403 -9.590 9.357 845 HB3 HIS 57 3HB HIS 57 1.245 -8.640 10.839 846 H GLN 58 HN GLN 58 -1.000 -8.253 12.229 847 HA GLN 58 HA GLN 58 -0.718 -9.631 14.658 848 HB2 GLN 58 2HB GLN 58 -2.548 -7.313 13.882 849 HB3 GLN 58 3HB GLN 58 -2.495 -7.983 15.502 850 HG2 GLN 58 2HG GLN 58 -0.283 -6.518 14.062 851 HG3 GLN 58 3HG GLN 58 -1.014 -6.172 15.619 852 HE21 GLN 58 1HE2 GLN 58 1.642 -7.606 14.079 853 HE22 GLN 58 2HE2 GLN 58 2.252 -8.612 15.394 854 H ARG 59 HN ARG 59 -3.465 -9.693 12.362 855 HA ARG 59 HA ARG 59 -5.444 -10.820 14.091 856 HE ARG 59 HE ARG 59 -6.587 -7.219 10.909 857 HB2 ARG 59 2HB ARG 59 -5.090 -11.358 11.111 858 HB3 ARG 59 3HB ARG 59 -6.553 -11.573 12.069 859 HG2 ARG 59 2HG ARG 59 -6.580 -9.136 12.614 860 HG3 ARG 59 3HG ARG 59 -5.144 -8.921 11.622 861 HD2 ARG 59 2HD ARG 59 -6.464 -9.823 9.661 862 HD3 ARG 59 3HD ARG 59 -7.917 -9.639 10.675 863 HH11 ARG 59 2HH1 ARG 59 -7.884 -8.939 8.131 864 HH12 ARG 59 1HH1 ARG 59 -7.779 -7.498 7.113 865 HH21 ARG 59 1HH2 ARG 59 -6.526 -5.469 9.603 866 HH22 ARG 59 2HH2 ARG 59 -7.062 -5.571 7.942 867 H ARG 60 HN ARG 60 -2.673 -12.298 12.408 868 HA ARG 60 HA ARG 60 -3.438 -15.066 12.665 869 HE ARG 60 HE ARG 60 0.976 -17.831 12.349 870 HB2 ARG 60 2HB ARG 60 -1.576 -14.248 11.228 871 HB3 ARG 60 3HB ARG 60 -0.661 -13.802 12.677 872 HG2 ARG 60 2HG ARG 60 -0.521 -16.155 13.374 873 HG3 ARG 60 3HG ARG 60 -1.444 -16.637 11.941 874 HD2 ARG 60 2HD ARG 60 0.367 -15.614 10.516 875 HD3 ARG 60 3HD ARG 60 1.238 -15.172 11.981 876 HH11 ARG 60 1HH1 ARG 60 2.165 -16.121 9.465 877 HH12 ARG 60 2HH1 ARG 60 3.339 -17.380 9.160 878 HH21 ARG 60 1HH2 ARG 60 2.438 -19.381 11.790 879 HH22 ARG 60 2HH2 ARG 60 3.454 -19.169 10.383 880 H HIS 61 HN HIS 61 -1.963 -12.751 14.964 881 HA HIS 61 HA HIS 61 -1.427 -14.914 16.936 882 HD1 HIS 61 1HD HIS 61 1.041 -15.238 17.482 883 HD2 HIS 61 2HD HIS 61 1.302 -11.467 15.606 884 HE1 HIS 61 1HE HIS 61 3.335 -15.124 16.323 885 HB2 HIS 61 2HB HIS 61 -0.909 -11.905 16.948 886 HB3 HIS 61 3HB HIS 61 -0.588 -12.959 18.324 887 H THR 62 HN THR 62 -3.511 -12.035 16.509 888 HA THR 62 HA THR 62 -4.744 -12.303 19.137 889 HB THR 62 HB THR 62 -6.303 -10.535 18.286 890 HG1 THR 62 1HG THR 62 -4.664 -10.514 16.005 891 HG21 THR 62 3HG2 THR 62 -4.644 -8.760 17.908 892 HG22 THR 62 1HG2 THR 62 -3.364 -9.961 17.637 893 HG23 THR 62 2HG2 THR 62 -4.132 -9.823 19.229 894 H GLY 63 HN GLY 63 -5.255 -13.844 16.076 895 HA2 GLY 63 2HA GLY 63 -6.717 -15.546 15.520 896 HA3 GLY 63 3HA GLY 63 -7.290 -15.529 17.197 897 H VAL 64 HN VAL 64 -7.631 -12.422 15.837 898 HA VAL 64 HA VAL 64 -10.493 -12.574 16.014 899 HB VAL 64 HB VAL 64 -10.470 -10.262 15.206 900 HG11 VAL 64 1HG1 VAL 64 -8.279 -10.767 17.244 901 HG12 VAL 64 2HG1 VAL 64 -9.210 -9.273 17.038 902 HG13 VAL 64 3HG1 VAL 64 -10.022 -10.755 17.571 903 HG21 VAL 64 3HG2 VAL 64 -8.756 -10.172 13.518 904 HG22 VAL 64 1HG2 VAL 64 -8.322 -9.051 14.811 905 HG23 VAL 64 2HG2 VAL 64 -7.508 -10.621 14.694 906 H LYS 65 HN LYS 65 -12.074 -12.793 14.527 907 HA LYS 65 HA LYS 65 -11.329 -12.782 11.636 908 HB2 LYS 65 2HB LYS 65 -13.089 -14.809 13.080 909 HB3 LYS 65 3HB LYS 65 -13.041 -14.577 11.321 910 HG2 LYS 65 2HG LYS 65 -10.785 -15.270 11.162 911 HG3 LYS 65 3HG LYS 65 -10.593 -15.366 12.930 912 HD2 LYS 65 2HD LYS 65 -12.174 -17.231 13.019 913 HD3 LYS 65 3HD LYS 65 -12.553 -17.032 11.297 914 HE2 LYS 65 2HE LYS 65 -10.126 -17.478 10.771 915 HE3 LYS 65 3HE LYS 65 -9.876 -17.866 12.481 916 HZ1 LYS 65 3HZ LYS 65 -10.302 -19.834 11.160 917 HZ2 LYS 65 1HZ LYS 65 -11.753 -19.236 10.659 918 HZ3 LYS 65 2HZ LYS 65 -11.522 -19.613 12.245 919 HA PRO 66 HA PRO 66 -14.771 -9.917 12.774 920 HB2 PRO 66 2HB PRO 66 -13.936 -7.712 11.345 921 HB3 PRO 66 3HB PRO 66 -13.268 -8.169 12.936 922 HG2 PRO 66 2HG PRO 66 -12.121 -8.774 10.200 923 HG3 PRO 66 3HG PRO 66 -11.278 -8.084 11.625 924 HD2 PRO 66 2HD PRO 66 -11.155 -10.720 11.035 925 HD3 PRO 66 3HD PRO 66 -11.246 -10.166 12.730 926 H PHE 67 HN PHE 67 -13.646 -11.199 9.719 927 HA PHE 67 HA PHE 67 -15.978 -10.079 8.220 928 HD1 PHE 67 2HD PHE 67 -14.899 -8.810 5.753 929 HD2 PHE 67 1HD PHE 67 -11.864 -10.666 8.178 930 HE1 PHE 67 2HE PHE 67 -13.468 -6.801 5.503 931 HE2 PHE 67 1HE PHE 67 -10.424 -8.658 7.915 932 HZ PHE 67 HZ PHE 67 -11.235 -6.717 6.584 933 HB2 PHE 67 2HB PHE 67 -13.775 -11.989 7.288 934 HB3 PHE 67 3HB PHE 67 -14.949 -11.188 6.280 935 H GLN 68 HN GLN 68 -17.855 -11.208 7.943 936 HA GLN 68 HA GLN 68 -17.840 -14.143 8.615 937 HB2 GLN 68 2HB GLN 68 -18.819 -12.842 10.483 938 HB3 GLN 68 3HB GLN 68 -19.993 -12.100 9.393 939 HG2 GLN 68 2HG GLN 68 -21.068 -14.240 8.987 940 HG3 GLN 68 3HG GLN 68 -19.780 -15.096 9.860 941 HE21 GLN 68 1HE2 GLN 68 -23.010 -14.424 10.318 942 HE22 GLN 68 2HE2 GLN 68 -22.855 -14.086 12.050 943 H CYS 69 HN CYS 69 -18.747 -15.414 7.075 944 HA CYS 69 HA CYS 69 -19.626 -14.306 4.590 945 HB2 CYS 69 2HB CYS 69 -18.723 -16.589 4.719 946 HB3 CYS 69 3HB CYS 69 -20.042 -17.083 5.791 947 H LYS 70 HN LYS 70 -21.478 -13.256 4.172 948 HA LYS 70 HA LYS 70 -23.731 -13.153 5.789 949 HB2 LYS 70 2HB LYS 70 -24.898 -12.191 3.892 950 HB3 LYS 70 3HB LYS 70 -23.279 -11.543 4.002 951 HG2 LYS 70 2HG LYS 70 -24.146 -13.678 1.983 952 HG3 LYS 70 3HG LYS 70 -24.155 -11.950 1.704 953 HD2 LYS 70 2HD LYS 70 -22.142 -12.314 0.756 954 HD3 LYS 70 3HD LYS 70 -21.564 -12.160 2.417 955 HE2 LYS 70 2HE LYS 70 -22.013 -14.760 2.502 956 HE3 LYS 70 3HE LYS 70 -22.037 -14.673 0.753 957 HZ1 LYS 70 3HZ LYS 70 -19.892 -15.216 1.787 958 HZ2 LYS 70 1HZ LYS 70 -19.806 -13.724 2.444 959 HZ3 LYS 70 2HZ LYS 70 -19.774 -13.885 0.802 960 H THR 71 HN THR 71 -22.745 -15.863 3.937 961 HA THR 71 HA THR 71 -25.526 -16.883 3.593 962 HB THR 71 HB THR 71 -23.444 -18.717 2.630 963 HG1 THR 71 1HG THR 71 -22.155 -16.977 2.326 964 HG21 THR 71 3HG2 THR 71 -25.510 -17.084 1.145 965 HG22 THR 71 1HG2 THR 71 -25.774 -18.693 1.865 966 HG23 THR 71 2HG2 THR 71 -24.614 -18.493 0.537 967 H CYS 72 HN CYS 72 -22.408 -18.543 4.401 968 HA CYS 72 HA CYS 72 -23.946 -20.355 6.169 969 HB2 CYS 72 2HB CYS 72 -21.906 -21.728 6.096 970 HB3 CYS 72 3HB CYS 72 -22.402 -21.271 4.447 971 H GLN 73 HN GLN 73 -22.470 -17.427 6.653 972 HA GLN 73 HA GLN 73 -21.718 -16.315 8.516 973 HB2 GLN 73 2HB GLN 73 -22.503 -18.708 10.237 974 HB3 GLN 73 3HB GLN 73 -22.417 -17.015 10.668 975 HG2 GLN 73 2HG GLN 73 -24.510 -18.377 8.940 976 HG3 GLN 73 3HG GLN 73 -24.731 -17.525 10.460 977 HE21 GLN 73 1HE2 GLN 73 -25.281 -17.185 7.114 978 HE22 GLN 73 2HE2 GLN 73 -25.235 -15.429 7.119 979 H ARG 74 HN ARG 74 -20.042 -18.583 7.101 980 HA ARG 74 HA ARG 74 -18.080 -19.424 9.018 981 HE ARG 74 HE ARG 74 -14.955 -22.822 7.833 982 HB2 ARG 74 2HB ARG 74 -18.349 -20.476 6.815 983 HB3 ARG 74 3HB ARG 74 -17.850 -18.983 6.004 984 HG2 ARG 74 2HG ARG 74 -16.068 -20.630 6.028 985 HG3 ARG 74 3HG ARG 74 -15.589 -19.228 6.998 986 HD2 ARG 74 2HD ARG 74 -15.874 -20.402 9.050 987 HD3 ARG 74 3HD ARG 74 -16.845 -21.666 8.281 988 HH11 ARG 74 1HH2 ARG 74 -13.796 -19.457 8.205 989 HH12 ARG 74 2HH2 ARG 74 -12.152 -19.977 7.978 990 HH21 ARG 74 1HH1 ARG 74 -12.857 -23.335 7.697 991 HH22 ARG 74 2HH1 ARG 74 -11.619 -22.101 7.721 992 H LYS 75 HN LYS 75 -16.667 -18.243 10.100 993 HA LYS 75 HA LYS 75 -16.293 -15.457 9.351 994 HB2 LYS 75 2HB LYS 75 -15.706 -17.175 11.771 995 HB3 LYS 75 3HB LYS 75 -14.807 -15.678 11.555 996 HG2 LYS 75 2HG LYS 75 -16.927 -14.432 11.209 997 HG3 LYS 75 3HG LYS 75 -17.836 -15.893 11.623 998 HD2 LYS 75 2HD LYS 75 -16.961 -15.903 13.868 999 HD3 LYS 75 3HD LYS 75 -15.738 -14.684 13.484 1000 HE2 LYS 75 2HE LYS 75 -18.744 -14.184 13.453 1001 HE3 LYS 75 3HE LYS 75 -17.649 -13.768 14.782 1002 HZ1 LYS 75 3HZ LYS 75 -17.953 -11.865 13.430 1003 HZ2 LYS 75 1HZ LYS 75 -17.584 -12.683 12.054 1004 HZ3 LYS 75 2HZ LYS 75 -16.405 -12.405 13.157 1005 H PHE 76 HN PHE 76 -14.412 -14.403 8.880 1006 HA PHE 76 HA PHE 76 -11.909 -15.983 8.520 1007 HD1 PHE 76 1HD PHE 76 -11.499 -17.492 6.044 1008 HD2 PHE 76 2HD PHE 76 -15.189 -15.262 5.816 1009 HE1 PHE 76 1HE PHE 76 -12.599 -19.403 4.897 1010 HE2 PHE 76 2HE PHE 76 -16.278 -17.172 4.697 1011 HZ PHE 76 HZ PHE 76 -14.975 -19.247 4.225 1012 HB2 PHE 76 2HB PHE 76 -13.113 -14.146 6.402 1013 HB3 PHE 76 3HB PHE 76 -11.572 -14.971 6.286 1014 H SER 77 HN SER 77 -9.981 -14.564 8.267 1015 HA SER 77 HA SER 77 -10.312 -12.063 9.854 1016 HG SER 77 HG SER 77 -8.923 -13.422 11.747 1017 HB2 SER 77 2HB SER 77 -7.810 -13.652 9.143 1018 HB3 SER 77 3HB SER 77 -7.867 -12.257 10.223 1019 H ARG 78 HN ARG 78 -10.138 -12.893 6.611 1020 HA ARG 78 HA ARG 78 -8.895 -10.268 5.903 1021 HE ARG 78 HE ARG 78 -6.073 -13.083 3.217 1022 HB2 ARG 78 2HB ARG 78 -8.228 -13.030 4.836 1023 HB3 ARG 78 3HB ARG 78 -8.003 -11.595 3.827 1024 HG2 ARG 78 2HG ARG 78 -6.349 -10.667 5.185 1025 HG3 ARG 78 3HG ARG 78 -6.836 -11.586 6.607 1026 HD2 ARG 78 2HD ARG 78 -4.722 -12.387 5.820 1027 HD3 ARG 78 3HD ARG 78 -5.948 -13.644 5.695 1028 HH11 ARG 78 1HH1 ARG 78 -3.033 -12.310 4.853 1029 HH12 ARG 78 2HH1 ARG 78 -2.126 -12.871 3.445 1030 HH21 ARG 78 1HH2 ARG 78 -4.819 -13.949 1.687 1031 HH22 ARG 78 2HH2 ARG 78 -3.122 -13.529 1.588 1032 H SER 79 HN SER 79 -10.053 -9.086 4.528 1033 HA SER 79 HA SER 79 -12.673 -9.793 3.693 1034 HG SER 79 HG SER 79 -12.995 -7.953 1.459 1035 HB2 SER 79 2HB SER 79 -11.603 -7.456 3.886 1036 HB3 SER 79 3HB SER 79 -10.889 -7.751 2.299 1037 H ASP 80 HN ASP 80 -9.538 -9.913 1.962 1038 HA ASP 80 HA ASP 80 -10.562 -10.624 -0.565 1039 HB2 ASP 80 2HB ASP 80 -8.230 -11.452 -1.009 1040 HB3 ASP 80 3HB ASP 80 -8.410 -9.822 -0.338 1041 H HIS 81 HN HIS 81 -9.768 -12.699 2.237 1042 HA HIS 81 HA HIS 81 -10.146 -15.216 0.765 1043 HD1 HIS 81 1HD HIS 81 -7.728 -15.745 4.761 1044 HD2 HIS 81 2HD HIS 81 -7.872 -15.129 0.604 1045 HE1 HIS 81 1HE HIS 81 -5.415 -15.769 4.006 1046 HB2 HIS 81 2HB HIS 81 -9.963 -14.558 3.738 1047 HB3 HIS 81 3HB HIS 81 -10.212 -16.185 3.112 1048 H LEU 82 HN LEU 82 -12.148 -13.050 2.826 1049 HA LEU 82 HA LEU 82 -14.452 -14.802 2.894 1050 HG LEU 82 HG LEU 82 -16.493 -13.797 3.332 1051 HB2 LEU 82 2HB LEU 82 -14.153 -12.913 4.440 1052 HB3 LEU 82 3HB LEU 82 -14.300 -11.745 3.124 1053 HD11 LEU 82 1HD1 LEU 82 -17.662 -12.916 5.066 1054 HD12 LEU 82 2HD1 LEU 82 -16.682 -11.481 5.230 1055 HD13 LEU 82 3HD1 LEU 82 -16.045 -13.099 5.742 1056 HD21 LEU 82 3HD2 LEU 82 -16.680 -11.964 1.646 1057 HD22 LEU 82 1HD2 LEU 82 -16.577 -10.767 2.946 1058 HD23 LEU 82 2HD2 LEU 82 -17.962 -11.873 2.846 1059 H LYS 83 HN LYS 83 -13.501 -12.054 0.753 1060 HA LYS 83 HA LYS 83 -15.770 -12.195 -1.017 1061 HB2 LYS 83 2HB LYS 83 -14.070 -10.326 -0.835 1062 HB3 LYS 83 3HB LYS 83 -12.898 -11.355 -1.658 1063 HG2 LYS 83 2HG LYS 83 -14.458 -11.406 -3.657 1064 HG3 LYS 83 3HG LYS 83 -15.521 -10.282 -2.784 1065 HD2 LYS 83 2HD LYS 83 -13.539 -8.685 -2.610 1066 HD3 LYS 83 3HD LYS 83 -12.616 -9.818 -3.606 1067 HE2 LYS 83 2HE LYS 83 -13.378 -8.190 -5.126 1068 HE3 LYS 83 3HE LYS 83 -14.457 -9.573 -5.373 1069 HZ1 LYS 83 3HZ LYS 83 -15.050 -7.159 -3.775 1070 HZ2 LYS 83 1HZ LYS 83 -16.059 -8.455 -3.937 1071 HZ3 LYS 83 2HZ LYS 83 -15.684 -7.530 -5.247 1072 H THR 84 HN THR 84 -12.652 -13.944 -0.905 1073 HA THR 84 HA THR 84 -12.970 -15.311 -3.426 1074 HB THR 84 HB THR 84 -11.390 -15.901 -0.908 1075 HG1 THR 84 1HG THR 84 -10.623 -14.213 -1.901 1076 HG21 THR 84 3HG2 THR 84 -11.594 -18.084 -1.866 1077 HG22 THR 84 1HG2 THR 84 -9.991 -17.426 -2.187 1078 HG23 THR 84 2HG2 THR 84 -11.228 -17.443 -3.490 1079 H HIS 85 HN HIS 85 -13.614 -16.294 -0.012 1080 HA HIS 85 HA HIS 85 -14.761 -18.835 -0.605 1081 HD1 HIS 85 1HD HIS 85 -15.781 -20.710 1.682 1082 HD2 HIS 85 2HD HIS 85 -17.478 -16.915 2.452 1083 HE1 HIS 85 1HE HIS 85 -18.207 -21.094 2.452 1084 HB2 HIS 85 2HB HIS 85 -14.097 -18.393 1.641 1085 HB3 HIS 85 3HB HIS 85 -15.007 -16.888 1.707 1086 H THR 86 HN THR 86 -16.119 -15.559 -0.550 1087 HA THR 86 HA THR 86 -18.878 -16.105 -0.660 1088 HB THR 86 HB THR 86 -17.297 -13.953 -2.120 1089 HG1 THR 86 1HG THR 86 -17.081 -13.982 0.164 1090 HG21 THR 86 3HG2 THR 86 -19.486 -13.882 -3.088 1091 HG22 THR 86 1HG2 THR 86 -19.218 -12.537 -1.975 1092 HG23 THR 86 2HG2 THR 86 -20.238 -13.917 -1.465 1093 H ARG 87 HN ARG 87 -16.392 -16.253 -3.264 1094 HA ARG 87 HA ARG 87 -18.232 -16.500 -5.466 1095 HE ARG 87 HE ARG 87 -12.616 -15.475 -5.766 1096 HB2 ARG 87 2HB ARG 87 -15.381 -17.546 -5.202 1097 HB3 ARG 87 3HB ARG 87 -16.302 -17.403 -6.687 1098 HG2 ARG 87 2HG ARG 87 -16.480 -14.905 -6.282 1099 HG3 ARG 87 3HG ARG 87 -15.411 -15.116 -4.905 1100 HD2 ARG 87 2HD ARG 87 -14.183 -16.410 -7.165 1101 HD3 ARG 87 3HD ARG 87 -14.709 -14.844 -7.701 1102 HH11 ARG 87 2HH1 ARG 87 -14.576 -12.852 -7.110 1103 HH12 ARG 87 1HH1 ARG 87 -13.473 -11.633 -6.499 1104 HH21 ARG 87 2HH2 ARG 87 -11.407 -13.852 -4.843 1105 HH22 ARG 87 1HH2 ARG 87 -11.750 -12.179 -5.249 1106 H THR 88 HN THR 88 -17.187 -18.785 -3.007 1107 HA THR 88 HA THR 88 -17.768 -21.232 -4.472 1108 HB THR 88 HB THR 88 -17.719 -22.357 -2.373 1109 HG1 THR 88 1HG THR 88 -17.738 -19.857 -1.027 1110 HG21 THR 88 3HG2 THR 88 -15.515 -21.661 -3.142 1111 HG22 THR 88 1HG2 THR 88 -15.596 -21.703 -1.371 1112 HG23 THR 88 2HG2 THR 88 -15.634 -20.148 -2.231 1113 H HIS 89 HN HIS 89 -19.725 -18.875 -2.679 1114 HA HIS 89 HA HIS 89 -22.148 -20.606 -2.904 1115 HD1 HIS 89 1HD HIS 89 -22.996 -21.366 -0.523 1116 HD2 HIS 89 2HD HIS 89 -20.669 -18.080 0.716 1117 HE1 HIS 89 1HE HIS 89 -22.301 -21.807 1.913 1118 HB2 HIS 89 2HB HIS 89 -21.689 -17.859 -1.658 1119 HB3 HIS 89 3HB HIS 89 -23.245 -18.669 -1.729 1120 H THR 90 HN THR 90 -20.501 -17.928 -4.437 1121 HA THR 90 HA THR 90 -22.919 -16.950 -5.807 1122 HB THR 90 HB THR 90 -20.036 -16.088 -6.239 1123 HG1 THR 90 1HG THR 90 -20.538 -15.949 -4.015 1124 HG21 THR 90 3HG2 THR 90 -21.504 -15.007 -7.852 1125 HG22 THR 90 1HG2 THR 90 -20.999 -13.843 -6.629 1126 HG23 THR 90 2HG2 THR 90 -22.628 -14.546 -6.551 1127 H GLY 91 HN GLY 91 -20.674 -19.444 -6.396 1128 HA2 GLY 91 2HA GLY 91 -20.246 -20.752 -8.267 1129 HA3 GLY 91 3HA GLY 91 -21.650 -20.001 -9.049 1130 H GLU 92 HN GLU 92 -19.218 -17.800 -7.913 1131 HA GLU 92 HA GLU 92 -18.782 -16.858 -10.627 1132 HB2 GLU 92 2HB GLU 92 -19.057 -15.341 -8.719 1133 HB3 GLU 92 3HB GLU 92 -17.621 -15.974 -7.948 1134 HG2 GLU 92 2HG GLU 92 -16.207 -15.029 -9.725 1135 HG3 GLU 92 3HG GLU 92 -17.640 -14.531 -10.633 1136 H LYS 93 HN LYS 93 -17.602 -18.356 -11.819 1137 HA LYS 93 HA LYS 93 -14.789 -18.806 -10.899 1138 HB2 LYS 93 2HB LYS 93 -16.627 -20.675 -12.445 1139 HB3 LYS 93 3HB LYS 93 -14.879 -20.909 -12.328 1140 HG2 LYS 93 2HG LYS 93 -14.991 -21.118 -9.921 1141 HG3 LYS 93 3HG LYS 93 -16.734 -20.789 -9.914 1142 HD2 LYS 93 2HD LYS 93 -17.165 -22.829 -11.184 1143 HD3 LYS 93 3HD LYS 93 -15.434 -23.156 -11.340 1144 HE2 LYS 93 2HE LYS 93 -16.921 -22.993 -8.683 1145 HE3 LYS 93 3HE LYS 93 -16.598 -24.499 -9.556 1146 HZ1 LYS 93 3HZ LYS 93 -14.544 -22.649 -8.539 1147 HZ2 LYS 93 1HZ LYS 93 -14.248 -24.035 -9.380 1148 HZ3 LYS 93 2HZ LYS 93 -14.938 -24.105 -7.886 1149 HA PRO 94 HA PRO 94 -14.825 -16.486 -14.875 1150 HB2 PRO 94 2HB PRO 94 -13.258 -14.365 -14.201 1151 HB3 PRO 94 3HB PRO 94 -14.949 -14.503 -13.633 1152 HG2 PRO 94 2HG PRO 94 -12.416 -15.244 -12.129 1153 HG3 PRO 94 3HG PRO 94 -13.792 -14.253 -11.552 1154 HD2 PRO 94 2HD PRO 94 -13.545 -16.934 -11.020 1155 HD3 PRO 94 3HD PRO 94 -15.133 -16.134 -11.221 1156 H PHE 95 HN PHE 95 -12.231 -17.833 -12.903 1157 HA PHE 95 HA PHE 95 -10.117 -17.225 -14.879 1158 HD1 PHE 95 2HD PHE 95 -7.949 -16.153 -13.488 1159 HD2 PHE 95 1HD PHE 95 -10.966 -17.548 -10.760 1160 HE1 PHE 95 2HE PHE 95 -7.640 -14.107 -12.110 1161 HE2 PHE 95 1HE PHE 95 -10.667 -15.495 -9.381 1162 HZ PHE 95 HZ PHE 95 -8.996 -13.783 -10.050 1163 HB2 PHE 95 2HB PHE 95 -10.081 -19.028 -12.417 1164 HB3 PHE 95 3HB PHE 95 -8.692 -18.546 -13.385 1165 H SER 96 HN SER 96 -11.264 -18.239 -16.731 1166 HA SER 96 HA SER 96 -11.468 -21.163 -16.813 1167 HG SER 96 HG SER 96 -10.551 -18.863 -19.306 1168 HB2 SER 96 2HB SER 96 -11.977 -20.773 -19.219 1169 HB3 SER 96 3HB SER 96 -12.981 -19.768 -18.153 1170 H CYS 97 HN CYS 97 -10.116 -22.628 -17.816 1171 HA CYS 97 HA CYS 97 -7.331 -21.920 -18.106 1172 HB2 CYS 97 2HB CYS 97 -8.303 -24.194 -17.432 1173 HB3 CYS 97 3HB CYS 97 -8.717 -24.384 -19.135 1174 H ARG 98 HN ARG 98 -6.055 -22.362 -20.065 1175 HA ARG 98 HA ARG 98 -7.501 -21.491 -22.545 1176 HE ARG 98 HE ARG 98 -7.549 -16.857 -21.793 1177 HB2 ARG 98 2HB ARG 98 -4.987 -20.413 -21.237 1178 HB3 ARG 98 3HB ARG 98 -5.075 -20.423 -22.986 1179 HG2 ARG 98 2HG ARG 98 -5.748 -18.304 -22.336 1180 HG3 ARG 98 3HG ARG 98 -7.183 -19.129 -22.934 1181 HD2 ARG 98 2HD ARG 98 -8.040 -19.389 -20.669 1182 HD3 ARG 98 3HD ARG 98 -6.515 -18.795 -19.976 1183 HH11 ARG 98 1HH1 ARG 98 -8.410 -18.071 -18.569 1184 HH12 ARG 98 2HH1 ARG 98 -9.073 -16.509 -18.123 1185 HH21 ARG 98 1HH2 ARG 98 -8.460 -14.971 -21.122 1186 HH22 ARG 98 2HH2 ARG 98 -9.132 -14.852 -19.513 1187 H TRP 99 HN TRP 99 -6.117 -24.096 -21.184 1188 HA TRP 99 HA TRP 99 -4.034 -24.830 -23.031 1189 HD1 TRP 99 1HD TRP 99 -4.011 -24.155 -19.850 1190 HE1 TRP 99 1HE TRP 99 -1.750 -24.478 -18.692 1191 HE3 TRP 99 3HE TRP 99 -2.678 -28.624 -21.949 1192 HZ2 TRP 99 2HZ TRP 99 0.388 -26.416 -18.702 1193 HZ3 TRP 99 3HZ TRP 99 -0.494 -29.665 -21.391 1194 HH2 TRP 99 2HH TRP 99 1.047 -28.569 -19.781 1195 HB2 TRP 99 2HB TRP 99 -5.698 -26.242 -20.962 1196 HB3 TRP 99 3HB TRP 99 -4.768 -27.216 -22.074 1197 HA PRO 100 HA PRO 100 -5.897 -26.267 -26.705 1198 HB2 PRO 100 2HB PRO 100 -4.675 -28.988 -26.072 1199 HB3 PRO 100 3HB PRO 100 -4.659 -28.083 -27.615 1200 HG2 PRO 100 2HG PRO 100 -2.488 -28.055 -26.016 1201 HG3 PRO 100 3HG PRO 100 -3.059 -26.519 -26.747 1202 HD2 PRO 100 2HD PRO 100 -3.491 -27.543 -23.940 1203 HD3 PRO 100 3HD PRO 100 -3.076 -25.893 -24.505 1204 H SER 101 HN SER 101 -8.077 -26.432 -26.700 1205 HA SER 101 HA SER 101 -10.186 -27.348 -26.586 1206 HG SER 101 HG SER 101 -10.973 -29.851 -25.865 1207 HB2 SER 101 2HB SER 101 -9.082 -29.200 -27.849 1208 HB3 SER 101 3HB SER 101 -8.717 -30.023 -26.316 1209 H CYS 102 HN CYS 102 -8.757 -26.562 -24.021 1210 HA CYS 102 HA CYS 102 -9.964 -28.313 -21.989 1211 HB2 CYS 102 2HB CYS 102 -7.835 -27.050 -21.597 1212 HB3 CYS 102 3HB CYS 102 -8.732 -25.523 -21.682 1213 H GLN 103 HN GLN 103 -11.330 -27.128 -20.250 1214 HA GLN 103 HA GLN 103 -13.127 -25.033 -21.151 1215 HB2 GLN 103 2HB GLN 103 -15.206 -26.390 -21.104 1216 HB3 GLN 103 3HB GLN 103 -14.173 -26.817 -22.432 1217 HG2 GLN 103 2HG GLN 103 -14.385 -28.426 -19.836 1218 HG3 GLN 103 3HG GLN 103 -15.286 -28.765 -21.310 1219 HE21 GLN 103 1HE2 GLN 103 -13.476 -28.575 -23.355 1220 HE22 GLN 103 2HE2 GLN 103 -12.130 -29.660 -23.087 1221 H LYS 104 HN LYS 104 -11.305 -25.856 -18.860 1222 HA LYS 104 HA LYS 104 -13.253 -26.264 -16.637 1223 HB2 LYS 104 2HB LYS 104 -10.225 -26.543 -16.894 1224 HB3 LYS 104 3HB LYS 104 -11.001 -26.381 -15.324 1225 HG2 LYS 104 2HG LYS 104 -10.824 -28.690 -15.581 1226 HG3 LYS 104 3HG LYS 104 -12.507 -28.318 -15.895 1227 HD2 LYS 104 2HD LYS 104 -12.015 -29.897 -17.533 1228 HD3 LYS 104 3HD LYS 104 -11.847 -28.400 -18.432 1229 HE2 LYS 104 2HE LYS 104 -9.321 -28.537 -17.829 1230 HE3 LYS 104 3HE LYS 104 -9.677 -30.207 -17.320 1231 HZ1 LYS 104 3HZ LYS 104 -9.766 -28.975 -19.943 1232 HZ2 LYS 104 1HZ LYS 104 -10.723 -30.295 -19.686 1233 HZ3 LYS 104 2HZ LYS 104 -9.065 -30.396 -19.520 1234 H LYS 105 HN LYS 105 -13.565 -24.795 -14.997 1235 HA LYS 105 HA LYS 105 -12.198 -22.155 -15.283 1236 HB2 LYS 105 2HB LYS 105 -15.168 -22.591 -14.700 1237 HB3 LYS 105 3HB LYS 105 -14.303 -21.061 -14.723 1238 HG2 LYS 105 2HG LYS 105 -15.135 -20.900 -16.803 1239 HG3 LYS 105 3HG LYS 105 -13.683 -21.814 -17.214 1240 HD2 LYS 105 2HD LYS 105 -15.066 -23.931 -17.082 1241 HD3 LYS 105 3HD LYS 105 -16.496 -22.923 -16.799 1242 HE2 LYS 105 2HE LYS 105 -16.136 -21.781 -18.961 1243 HE3 LYS 105 3HE LYS 105 -14.656 -22.724 -19.222 1244 HZ1 LYS 105 3HZ LYS 105 -17.364 -23.861 -18.983 1245 HZ2 LYS 105 1HZ LYS 105 -15.969 -24.712 -19.219 1246 HZ3 LYS 105 2HZ LYS 105 -16.515 -23.682 -20.388 1247 H PHE 106 HN PHE 106 -11.759 -21.030 -13.427 1248 HA PHE 106 HA PHE 106 -12.407 -22.428 -10.850 1249 HD1 PHE 106 1HD PHE 106 -10.552 -24.269 -9.854 1250 HD2 PHE 106 2HD PHE 106 -9.301 -22.460 -13.561 1251 HE1 PHE 106 1HE PHE 106 -10.248 -26.516 -10.864 1252 HE2 PHE 106 2HE PHE 106 -9.045 -24.703 -14.580 1253 HZ PHE 106 HZ PHE 106 -9.571 -26.732 -13.233 1254 HB2 PHE 106 2HB PHE 106 -9.774 -21.083 -11.631 1255 HB3 PHE 106 3HB PHE 106 -10.157 -21.793 -10.063 1256 H ALA 107 HN ALA 107 -12.202 -21.030 -8.921 1257 HA ALA 107 HA ALA 107 -13.343 -18.363 -9.568 1258 HB1 ALA 107 1HB ALA 107 -13.372 -20.078 -7.030 1259 HB2 ALA 107 2HB ALA 107 -14.105 -18.479 -7.153 1260 HB3 ALA 107 3HB ALA 107 -14.734 -19.796 -8.135 1261 H ARG 108 HN ARG 108 -10.355 -19.682 -8.868 1262 HA ARG 108 HA ARG 108 -9.440 -17.078 -7.758 1263 HE ARG 108 HE ARG 108 -7.310 -19.705 -4.769 1264 HB2 ARG 108 2HB ARG 108 -8.494 -19.817 -6.843 1265 HB3 ARG 108 3HB ARG 108 -7.799 -18.255 -6.393 1266 HG2 ARG 108 2HG ARG 108 -9.498 -17.675 -4.992 1267 HG3 ARG 108 3HG ARG 108 -10.697 -18.720 -5.761 1268 HD2 ARG 108 2HD ARG 108 -10.011 -19.524 -3.526 1269 HD3 ARG 108 3HD ARG 108 -9.790 -20.697 -4.814 1270 HH11 ARG 108 1HH2 ARG 108 -9.278 -20.395 -1.952 1271 HH12 ARG 108 2HH2 ARG 108 -7.910 -21.029 -1.055 1272 HH21 ARG 108 2HH1 ARG 108 -5.643 -20.555 -3.646 1273 HH22 ARG 108 1HH1 ARG 108 -5.885 -21.063 -1.982 1274 H SER 109 HN SER 109 -7.533 -16.334 -8.568 1275 HA SER 109 HA SER 109 -6.689 -17.178 -11.127 1276 HG SER 109 HG SER 109 -5.686 -14.479 -8.522 1277 HB2 SER 109 2HB SER 109 -4.640 -15.729 -10.575 1278 HB3 SER 109 3HB SER 109 -6.209 -14.931 -10.454 1279 H ASP 110 HN ASP 110 -5.346 -17.865 -7.865 1280 HA ASP 110 HA ASP 110 -3.079 -19.353 -8.851 1281 HB2 ASP 110 2HB ASP 110 -2.651 -19.900 -6.626 1282 HB3 ASP 110 3HB ASP 110 -3.269 -18.256 -6.584 1283 H GLU 111 HN GLU 111 -6.463 -20.230 -8.015 1284 HA GLU 111 HA GLU 111 -6.106 -23.099 -8.008 1285 HB2 GLU 111 2HB GLU 111 -8.480 -21.268 -8.468 1286 HB3 GLU 111 3HB GLU 111 -8.576 -22.963 -8.894 1287 HG2 GLU 111 2HG GLU 111 -7.979 -23.649 -6.635 1288 HG3 GLU 111 3HG GLU 111 -7.963 -21.964 -6.112 1289 H LEU 112 HN LEU 112 -6.699 -20.675 -10.593 1290 HA LEU 112 HA LEU 112 -6.823 -22.624 -12.723 1291 HG LEU 112 HG LEU 112 -5.216 -20.773 -14.769 1292 HB2 LEU 112 2HB LEU 112 -7.678 -20.395 -13.018 1293 HB3 LEU 112 3HB LEU 112 -6.090 -19.662 -12.747 1294 HD11 LEU 112 1HD1 LEU 112 -6.619 -21.948 -16.285 1295 HD12 LEU 112 2HD1 LEU 112 -8.079 -21.685 -15.319 1296 HD13 LEU 112 3HD1 LEU 112 -6.770 -22.779 -14.788 1297 HD21 LEU 112 3HD2 LEU 112 -6.364 -19.462 -16.438 1298 HD22 LEU 112 1HD2 LEU 112 -6.212 -18.514 -14.946 1299 HD23 LEU 112 2HD2 LEU 112 -7.771 -19.258 -15.385 1300 H VAL 113 HN VAL 113 -4.108 -20.611 -11.386 1301 HA VAL 113 HA VAL 113 -2.027 -21.616 -13.021 1302 HB VAL 113 HB VAL 113 -1.935 -20.857 -10.063 1303 HG11 VAL 113 1HG1 VAL 113 0.480 -20.399 -10.443 1304 HG12 VAL 113 2HG1 VAL 113 0.081 -22.111 -10.545 1305 HG13 VAL 113 3HG1 VAL 113 0.350 -21.176 -12.035 1306 HG21 VAL 113 3HG2 VAL 113 -1.082 -19.163 -12.427 1307 HG22 VAL 113 1HG2 VAL 113 -2.659 -19.006 -11.675 1308 HG23 VAL 113 2HG2 VAL 113 -1.205 -18.677 -10.724 1309 H ARG 114 HN ARG 114 -3.408 -22.962 -10.014 1310 HA ARG 114 HA ARG 114 -1.682 -25.234 -9.787 1311 HE ARG 114 HE ARG 114 -3.223 -28.607 -6.069 1312 HB2 ARG 114 2HB ARG 114 -3.097 -24.538 -7.939 1313 HB3 ARG 114 3HB ARG 114 -4.537 -24.699 -8.900 1314 HG2 ARG 114 2HG ARG 114 -4.629 -26.461 -7.442 1315 HG3 ARG 114 3HG ARG 114 -4.185 -27.213 -8.960 1316 HD2 ARG 114 2HD ARG 114 -2.243 -28.001 -8.104 1317 HD3 ARG 114 3HD ARG 114 -1.791 -26.431 -7.435 1318 HH11 ARG 114 1HH2 ARG 114 -2.231 -25.201 -5.705 1319 HH12 ARG 114 2HH2 ARG 114 -2.523 -25.315 -3.968 1320 HH21 ARG 114 1HH1 ARG 114 -3.746 -28.473 -3.951 1321 HH22 ARG 114 2HH1 ARG 114 -3.247 -27.072 -3.054 1322 H HIS 115 HN HIS 115 -4.970 -24.916 -11.284 1323 HA HIS 115 HA HIS 115 -5.209 -27.477 -12.332 1324 HD1 HIS 115 1HD HIS 115 -7.559 -28.411 -13.587 1325 HD2 HIS 115 2HD HIS 115 -6.405 -25.277 -16.149 1326 HE1 HIS 115 1HE HIS 115 -8.236 -29.096 -15.954 1327 HB2 HIS 115 2HB HIS 115 -6.986 -25.838 -12.462 1328 HB3 HIS 115 3HB HIS 115 -6.076 -24.828 -13.575 1329 H HIS 116 HN HIS 116 -3.652 -24.652 -13.956 1330 HA HIS 116 HA HIS 116 -2.848 -25.988 -16.309 1331 HD1 HIS 116 1HD HIS 116 -4.403 -24.300 -17.384 1332 HD2 HIS 116 2HD HIS 116 -1.862 -21.307 -15.772 1333 HE1 HIS 116 1HE HIS 116 -5.227 -22.119 -18.220 1334 HB2 HIS 116 2HB HIS 116 -1.491 -23.748 -14.761 1335 HB3 HIS 116 3HB HIS 116 -1.019 -24.267 -16.366 1336 H ASN 117 HN ASN 117 -1.329 -25.929 -13.043 1337 HA ASN 117 HA ASN 117 1.173 -27.168 -13.955 1338 HB2 ASN 117 2HB ASN 117 -0.030 -26.441 -11.260 1339 HB3 ASN 117 3HB ASN 117 1.327 -27.561 -11.343 1340 HD21 ASN 117 1HD2 ASN 117 0.350 -24.210 -12.217 1341 HD22 ASN 117 2HD2 ASN 117 2.051 -23.679 -12.261 1342 H MET 118 HN MET 118 -2.018 -28.305 -13.244 1343 HA MET 118 HA MET 118 -1.022 -31.105 -12.862 1344 HB2 MET 118 2HB MET 118 -3.786 -29.874 -12.448 1345 HB3 MET 118 3HB MET 118 -3.397 -31.584 -12.233 1346 HG2 MET 118 2HG MET 118 -1.803 -31.029 -10.443 1347 HG3 MET 118 3HG MET 118 -2.118 -29.313 -10.671 1348 HE1 MET 118 3HE MET 118 -3.386 -32.707 -9.289 1349 HE2 MET 118 1HE MET 118 -5.033 -32.348 -8.731 1350 HE3 MET 118 2HE MET 118 -4.688 -32.430 -10.470 1351 H HIS 119 HN HIS 119 -1.904 -28.998 -15.327 1352 HA HIS 119 HA HIS 119 -3.846 -30.504 -16.749 1353 HD1 HIS 119 1HD HIS 119 -3.997 -30.457 -19.706 1354 HD2 HIS 119 2HD HIS 119 -5.003 -26.934 -17.655 1355 HE1 HIS 119 1HE HIS 119 -6.373 -29.745 -20.517 1356 HB2 HIS 119 2HB HIS 119 -2.854 -28.016 -16.964 1357 HB3 HIS 119 3HB HIS 119 -1.941 -28.760 -18.273 Start of MODEL 15 1 H5 DC 124 5H C 124 -3.931 -31.213 -4.983 2 H6 DC 124 6H C 124 -5.848 -30.932 -6.493 3 H5' DC 124 H5' C 124 -9.081 -32.507 -9.787 4 H5'' DC 124 H5" C 124 -7.615 -32.289 -8.807 5 H4' DC 124 H4' C 124 -10.455 -32.459 -7.690 6 H3' DC 124 H3' C 124 -9.159 -30.301 -8.944 7 H2' DC 124 H2' C 124 -7.439 -30.019 -7.433 8 H2'' DC 124 H2" C 124 -8.660 -29.044 -6.562 9 H1' DC 124 H1' C 124 -9.404 -30.866 -5.266 10 H41 DC 124 1H4 C 124 -4.452 -32.358 -1.544 11 H42 DC 124 2H4 C 124 -3.304 -32.000 -2.819 12 H8 DG 125 8H G 125 -9.130 -26.873 -5.714 13 H1 DG 125 1H G 125 -6.428 -29.042 -0.278 14 H5' DG 125 H5' G 125 -12.966 -29.575 -6.446 15 H5'' DG 125 H5" G 125 -13.969 -28.177 -6.854 16 H4' DG 125 H4' G 125 -13.775 -28.542 -4.407 17 H3' DG 125 H3' G 125 -13.392 -26.076 -5.724 18 H2' DG 125 H2' G 125 -11.105 -25.946 -5.310 19 H2'' DG 125 H2" G 125 -11.633 -25.267 -3.749 20 H1' DG 125 H1' G 125 -11.524 -27.381 -2.665 21 H21 DG 125 1H2 G 125 -7.915 -29.169 1.296 22 H22 DG 125 2H2 G 125 -9.614 -28.836 0.987 23 H5 DC 126 5H C 126 -8.042 -24.045 -4.365 24 H6 DC 126 6H C 126 -10.015 -23.596 -2.973 25 H5' DC 126 H5' C 126 -13.551 -26.203 -1.090 26 H5'' DC 126 H5" C 126 -14.574 -24.878 -0.485 27 H4' DC 126 H4' C 126 -12.629 -25.124 0.920 28 H3' DC 126 H3' C 126 -13.277 -22.638 -0.336 29 H2' DC 126 H2' C 126 -11.347 -22.709 -1.687 30 H2'' DC 126 H2" C 126 -10.616 -21.924 -0.255 31 H1' DC 126 H1' C 126 -10.035 -24.153 0.730 32 H41 DC 126 1H4 C 126 -4.967 -25.383 -2.853 33 H42 DC 126 2H4 C 126 -5.776 -24.890 -4.323 34 H8 DG 127 8H G 127 -9.646 -21.680 1.651 35 H1 DG 127 1H G 127 -3.408 -22.900 0.644 36 H5' DG 127 H5' G 127 -12.147 -23.647 3.944 37 H5'' DG 127 H5" G 127 -12.635 -22.636 5.300 38 H4' DG 127 H4' G 127 -10.519 -23.733 5.841 39 H3' DG 127 H3' G 127 -10.733 -20.884 5.731 40 H2' DG 127 H2' G 127 -9.214 -20.525 4.094 41 H2'' DG 127 H2" G 127 -7.987 -20.788 5.361 42 H1' DG 127 H1' G 127 -7.638 -23.027 4.722 43 H21 DG 127 1H2 G 127 -2.432 -23.398 2.522 44 H22 DG 127 2H2 G 127 -3.280 -23.315 4.054 45 H8 DG 128 8H G 128 -7.487 -18.691 4.222 46 H1 DG 128 1H G 128 -2.665 -19.768 0.081 47 H5' DG 128 H5' G 128 -6.753 -21.961 7.536 48 H5'' DG 128 H5" G 128 -6.634 -21.171 9.124 49 H4' DG 128 H4' G 128 -4.564 -20.705 8.031 50 H3' DG 128 H3' G 128 -6.252 -18.512 8.627 51 H2' DG 128 H2' G 128 -6.823 -18.132 6.331 52 H2'' DG 128 H2" G 128 -5.339 -17.106 6.464 53 H1' DG 128 H1' G 128 -3.914 -18.982 5.762 54 H21 DG 128 1H2 G 128 -0.797 -20.020 1.169 55 H22 DG 128 2H2 G 128 -0.751 -20.085 2.919 56 H8 DG 129 8H G 129 -3.421 -16.226 5.637 57 H1 DG 129 1H G 129 -1.031 -16.506 -0.308 58 H5' DG 129 H5' G 129 -1.578 -18.353 8.763 59 H5'' DG 129 H5" G 129 -0.965 -17.264 9.994 60 H4' DG 129 H4' G 129 0.672 -17.327 8.196 61 H3' DG 129 H3' G 129 -0.614 -14.835 8.763 62 H2' DG 129 H2' G 129 -1.877 -14.865 6.827 63 H2'' DG 129 H2" G 129 -0.452 -14.044 6.154 64 H1' DG 129 H1' G 129 0.484 -16.153 5.364 65 H21 DG 129 1H2 G 129 1.148 -16.467 -0.266 66 H22 DG 129 2H2 G 129 2.048 -16.413 1.240 67 H8 DG 130 8H G 130 0.564 -13.505 4.215 68 H1 DG 130 1H G 130 -0.613 -12.857 -2.037 69 H5' DG 130 H5' G 130 2.983 -15.546 5.518 70 H5'' DG 130 H5" G 130 4.053 -14.643 6.595 71 H4' DG 130 H4' G 130 5.110 -14.473 4.523 72 H3' DG 130 H3' G 130 4.145 -12.169 5.761 73 H2' DG 130 H2' G 130 2.314 -11.764 4.425 74 H2'' DG 130 H2" G 130 3.487 -10.972 3.372 75 H1' DG 130 H1' G 130 3.631 -12.773 1.921 76 H21 DG 130 1H2 G 130 1.188 -12.368 -3.133 77 H22 DG 130 2H2 G 130 2.709 -12.073 -2.303 78 H8 DG 131 8H G 131 2.613 -9.439 2.364 79 H1 DG 131 1H G 131 -1.901 -9.360 -2.185 80 H5' DG 131 H5' G 131 5.884 -11.757 1.686 81 H5'' DG 131 H5" G 131 7.329 -10.754 1.881 82 H4' DG 131 H4' G 131 6.602 -10.330 -0.313 83 H3' DG 131 H3' G 131 6.580 -8.179 1.517 84 H2' DG 131 H2' G 131 4.267 -8.076 1.672 85 H2'' DG 131 H2" G 131 4.444 -7.027 0.266 86 H1' DG 131 H1' G 131 3.892 -8.828 -1.274 87 H21 DG 131 1H2 G 131 -1.021 -8.944 -4.118 88 H22 DG 131 2H2 G 131 0.697 -8.629 -4.302 89 H5 DC 132 5H C 132 1.290 -6.433 1.608 90 H6 DC 132 6H C 132 2.800 -5.771 -0.200 91 H5' DC 132 H5' C 132 5.263 -7.685 -2.839 92 H5'' DC 132 H5" C 132 6.312 -6.437 -3.533 93 H4' DC 132 H4' C 132 4.238 -6.186 -4.642 94 H3' DC 132 H3' C 132 5.223 -4.097 -2.912 95 H2' DC 132 H2' C 132 3.451 -4.098 -1.491 96 H2'' DC 132 H2" C 132 2.626 -3.178 -2.767 97 H1' DC 132 H1' C 132 1.602 -5.127 -3.695 98 H41 DC 132 1H4 C 132 -2.343 -6.652 1.054 99 H42 DC 132 2H4 C 132 -1.013 -6.938 2.157 100 H8 DG 133 8H G 133 1.209 -1.722 -3.103 101 H1 DG 133 1H G 133 -4.935 -2.751 -1.581 102 H5' DG 133 H5' G 133 2.561 -3.302 -6.684 103 H5'' DG 133 H5" G 133 3.265 -1.875 -7.459 104 H4' DG 133 H4' G 133 0.956 -1.996 -8.058 105 H3' DG 133 H3' G 133 2.076 0.274 -6.910 106 H2' DG 133 H2' G 133 1.254 -0.152 -4.723 107 H2'' DG 133 H2" G 133 -0.085 0.833 -5.304 108 H1' DG 133 H1' G 133 -1.391 -1.115 -5.927 109 H21 DG 133 1H2 G 133 -6.208 -2.240 -3.260 110 H22 DG 133 2H2 G 133 -5.559 -1.739 -4.802 111 H5' DT 134 H5' T 134 -2.416 -0.119 -7.348 112 H5'' DT 134 H5" T 134 -2.811 1.146 -8.508 113 H4' DT 134 H4' T 134 -4.734 1.051 -7.177 114 H3' DT 134 H3' T 134 -3.087 3.333 -7.206 115 H2' DT 134 H2' T 134 -2.251 3.049 -5.108 116 H2'' DT 134 H2" T 134 -3.673 4.016 -4.687 117 H1' DT 134 H1' T 134 -5.044 2.024 -4.269 118 H3 DT 134 3H T 134 -4.158 0.428 -0.141 119 H71 DT 134 1H7 T 134 0.249 2.240 -0.844 120 H72 DT 134 2H7 T 134 0.538 0.517 -1.186 121 H73 DT 134 3H7 T 134 0.571 1.704 -2.512 122 H6 DT 134 6H T 134 -1.356 1.847 -3.794 123 H5 DC 135 5H C 135 -3.680 4.938 -2.663 124 H6 DC 135 6H C 135 -5.494 5.319 -4.246 125 H5' DC 135 H5' C 135 -7.484 3.559 -7.381 126 H5'' DC 135 H5" C 135 -8.292 4.912 -8.195 127 H4' DC 135 H4' C 135 -9.604 4.293 -6.255 128 H3' DC 135 H3' C 135 -8.602 6.940 -6.475 129 H2' DC 135 H2' C 135 -7.021 6.635 -4.800 130 H2'' DC 135 H2" C 135 -8.334 7.191 -3.771 131 H1' DC 135 H1' C 135 -9.079 4.869 -3.319 132 H41 DC 135 1H4 C 135 -4.248 3.259 0.511 133 H42 DC 135 2H4 C 135 -3.107 4.047 -0.537 134 H5' DT 136 H5' T 136 -10.983 5.302 -2.624 135 H5'' DT 136 H5" T 136 -12.445 6.216 -3.025 136 H4' DT 136 H4' T 136 -12.532 6.044 -0.700 137 H3' DT 136 H3' T 136 -12.309 8.588 -1.833 138 H2' DT 136 H2' T 136 -10.144 9.021 -1.349 139 H2'' DT 136 H2" T 136 -10.706 9.529 0.204 140 H1' DT 136 H1' T 136 -10.248 7.497 1.317 141 H3 DT 136 3H T 136 -5.835 6.458 1.747 142 H71 DT 136 1H7 T 136 -5.342 7.563 -2.937 143 H72 DT 136 2H7 T 136 -6.597 8.811 -3.092 144 H73 DT 136 3H7 T 136 -5.125 9.142 -2.149 145 H6 DT 136 6H T 136 -8.475 8.200 -1.868 146 H8 DG 137 8H G 137 -9.646 10.392 1.725 147 H1 DG 137 1H G 137 -3.758 9.338 4.006 148 H5' DG 137 H5' G 137 -12.221 7.510 2.481 149 H5'' DG 137 H5" G 137 -13.662 8.313 3.110 150 H4' DG 137 H4' G 137 -12.317 7.951 4.986 151 H3' DG 137 H3' G 137 -13.006 10.554 4.235 152 H2' DG 137 H2' G 137 -10.944 11.120 3.382 153 H2'' DG 137 H2" G 137 -10.627 11.617 5.027 154 H1' DG 137 H1' G 137 -9.429 9.569 5.527 155 H21 DG 137 1H2 G 137 -3.818 8.890 6.119 156 H22 DG 137 2H2 G 137 -5.322 8.946 7.028 157 H5 DC 138 5H C 138 -8.601 13.018 4.038 158 H6 DC 138 6H C 138 -9.165 12.311 6.305 159 H5' DC 138 H5' C 138 -10.350 9.284 7.599 160 H5'' DC 138 H5" C 138 -11.306 9.799 8.994 161 H4' DC 138 H4' C 138 -9.134 9.568 9.813 162 H3' DC 138 H3' C 138 -10.373 12.068 9.938 163 H2' DC 138 H2' C 138 -9.191 13.088 8.261 164 H2'' DC 138 H2" C 138 -8.026 13.427 9.514 165 H1' DC 138 H1' C 138 -6.588 11.647 8.917 166 H41 DC 138 1H4 C 138 -5.108 13.253 2.954 167 H42 DC 138 2H4 C 138 -6.798 13.370 2.506 168 H8 DG 139 8H G 139 -6.396 14.685 9.685 169 H1 DG 139 1H G 139 -2.120 15.861 5.051 170 H5' DG 139 H5' G 139 -6.132 11.122 11.196 171 H5'' DG 139 H5" G 139 -6.195 11.402 12.940 172 H4' DG 139 H4' G 139 -3.919 11.521 12.388 173 H3' DG 139 H3' G 139 -5.148 13.735 13.552 174 H2' DG 139 H2' G 139 -5.345 14.993 11.624 175 H2'' DG 139 H2" G 139 -3.738 15.548 12.070 176 H1' DG 139 H1' G 139 -2.659 14.058 10.573 177 H21 DG 139 1H2 G 139 -0.119 15.308 5.691 178 H22 DG 139 2H2 G 139 0.202 14.743 7.324 179 H5 DC 140 5H C 140 -4.133 17.599 10.540 180 H6 DC 140 6H C 140 -2.099 16.813 11.644 181 H5' DC 140 H5' C 140 -0.804 13.425 12.057 182 H5'' DC 140 H5" C 140 0.129 13.671 13.540 183 H4' DC 140 H4' C 140 1.572 14.153 11.690 184 H3' DC 140 H3' C 140 1.217 15.985 13.735 185 H2' DC 140 H2' C 140 -0.298 17.405 12.639 186 H2'' DC 140 H2" C 140 1.215 18.180 12.102 187 H1' DC 140 H1' C 140 1.265 17.024 10.044 188 H41 DC 140 1H4 C 140 -4.011 19.009 7.165 189 H42 DC 140 2H4 C 140 -5.007 18.521 8.520 190 H8 DG 141 8H G 141 -3.471 21.510 0.829 191 H1 DG 141 1H G 141 -1.625 18.737 6.321 192 H5' DG 141 H5' G 141 -0.813 24.575 -0.696 193 H5'' DG 141 H5" G 141 -1.040 23.852 -2.298 194 H4' DG 141 H4' G 141 0.867 22.897 -0.968 195 H3' DG 141 H3' G 141 -0.916 21.441 -2.557 196 H2' DG 141 H2' G 141 -2.189 20.635 -0.813 197 H2'' DG 141 H2" G 141 -1.004 19.330 -0.812 198 H1' DG 141 H1' G 141 0.242 20.312 0.990 199 H21 DG 141 1H2 G 141 0.502 18.288 6.282 200 H22 DG 141 2H2 G 141 1.477 18.550 4.844 201 H5 DC 142 5H C 142 -2.640 17.757 0.416 202 H6 DC 142 6H C 142 -0.272 17.347 -0.009 203 H5' DC 142 H5' C 142 2.085 19.657 0.380 204 H5'' DC 142 H5" C 142 3.275 19.234 -0.840 205 H4' DC 142 H4' C 142 3.957 18.025 0.960 206 H3' DC 142 H3' C 142 3.166 16.563 -1.255 207 H2' DC 142 H2' C 142 1.112 15.901 -0.501 208 H2'' DC 142 H2" C 142 1.959 14.587 0.230 209 H1' DC 142 H1' C 142 1.935 15.546 2.400 210 H41 DC 142 1H4 C 142 -4.156 16.817 3.618 211 H42 DC 142 2H4 C 142 -4.358 17.636 2.082 212 H8 DG 143 8H G 143 1.513 12.918 1.263 213 H1 DG 143 1H G 143 -3.716 12.455 4.944 214 H5' DG 143 H5' G 143 4.034 15.325 3.215 215 H5'' DG 143 H5" G 143 5.575 14.550 2.827 216 H4' DG 143 H4' G 143 4.906 13.558 4.849 217 H3' DG 143 H3' G 143 5.297 11.943 2.619 218 H2' DG 143 H2' G 143 3.097 11.736 1.965 219 H2'' DG 143 H2" G 143 3.075 10.372 3.039 220 H1' DG 143 H1' G 143 2.083 11.548 4.812 221 H21 DG 143 1H2 G 143 -3.215 11.655 6.902 222 H22 DG 143 2H2 G 143 -1.562 11.223 7.319 223 H5 DC 144 5H C 144 0.779 9.444 1.915 224 H6 DC 144 6H C 144 1.795 8.690 3.998 225 H5' DC 144 H5' C 144 3.059 10.975 6.396 226 H5'' DC 144 H5" C 144 4.343 10.002 7.082 227 H4' DC 144 H4' C 144 2.522 9.431 8.319 228 H3' DC 144 H3' C 144 3.747 7.401 6.867 229 H2' DC 144 H2' C 144 2.171 7.101 5.236 230 H2'' DC 144 H2" C 144 1.351 6.125 6.424 231 H1' DC 144 H1' C 144 -0.201 7.780 7.005 232 H41 DC 144 1H4 C 144 -2.841 9.952 1.666 233 H42 DC 144 2H4 C 144 -1.269 10.207 0.932 234 H8 DA 145 8H A 145 -0.220 4.966 5.996 235 H2 DA 145 2H A 145 -6.257 6.262 4.313 236 H5' DA 145 H5' A 145 0.008 7.319 9.472 237 H5'' DA 145 H5" A 145 0.239 6.111 10.749 238 H4' DA 145 H4' A 145 -2.111 6.284 10.404 239 H3' DA 145 H3' A 145 -0.907 3.782 10.097 240 H2' DA 145 H2' A 145 -0.895 3.870 7.739 241 H2'' DA 145 H2" A 145 -2.463 3.099 7.935 242 H1' DA 145 H1' A 145 -3.660 5.177 7.784 243 H61 DA 145 2H6 A 145 -1.840 5.915 1.543 244 H62 DA 145 1H6 A 145 -3.410 6.350 0.891 245 H8 DG 146 8H G 146 -3.900 1.548 7.195 246 H1 DG 146 1H G 146 -5.696 3.544 1.355 247 H5' DG 146 H5' G 146 -5.254 4.650 9.913 248 H5'' DG 146 H5" G 146 -6.433 4.397 11.174 249 H4' DG 146 H4' G 146 -7.824 3.899 9.531 250 H3' DG 146 H3' G 146 -6.724 1.392 10.367 251 H2' DG 146 H2' G 146 -5.623 0.941 8.390 252 H2'' DG 146 H2" G 146 -7.220 0.468 7.802 253 H1' DG 146 H1' G 146 -7.643 2.556 6.793 254 H21 DG 146 1H2 G 146 -7.837 3.751 1.276 255 H22 DG 146 2H2 G 146 -8.815 3.755 2.722 256 H8 DA 147 8H A 147 -6.927 -1.141 6.427 257 H2 DA 147 2H A 147 -6.463 0.291 0.208 258 H5' DA 147 H5' A 147 -10.151 1.854 7.506 259 H5'' DA 147 H5" A 147 -11.497 0.747 7.829 260 H4' DA 147 H4' A 147 -11.273 1.110 5.436 261 H3' DA 147 H3' A 147 -11.239 -1.482 6.620 262 H2' DA 147 H2' A 147 -9.066 -1.981 6.014 263 H2'' DA 147 H2" A 147 -9.808 -2.413 4.444 264 H1' DA 147 H1' A 147 -9.384 -0.242 3.524 265 H61 DA 147 2H6 A 147 -2.819 -0.576 3.841 266 H62 DA 147 1H6 A 147 -2.511 -0.199 2.157 267 H5 DC 148 5H C 148 -7.083 -3.521 3.281 268 H6 DC 148 6H C 148 -9.385 -3.501 2.429 269 H5' DC 148 H5' C 148 -12.237 -0.793 1.934 270 H5'' DC 148 H5" C 148 -13.730 -1.728 1.759 271 H4' DC 148 H4' C 148 -12.714 -1.691 -0.390 272 H3' DC 148 H3' C 148 -13.173 -4.176 0.840 273 H2' DC 148 H2' C 148 -10.942 -4.516 1.452 274 H2'' DC 148 H2" C 148 -10.847 -5.286 -0.143 275 H1' DC 148 H1' C 148 -10.156 -3.250 -1.218 276 H41 DC 148 1H4 C 148 -4.217 -3.163 0.957 277 H42 DC 148 2H4 C 148 -4.726 -3.432 2.626 278 H8 DG 149 8H G 149 -9.170 -7.143 -1.038 279 H1 DG 149 1H G 149 -2.882 -5.869 -1.109 280 H5' DG 149 H5' G 149 -10.827 -3.520 -3.100 281 H5'' DG 149 H5" G 149 -12.081 -4.170 -4.165 282 H4' DG 149 H4' G 149 -10.106 -4.466 -5.396 283 H3' DG 149 H3' G 149 -11.551 -6.714 -4.570 284 H2' DG 149 H2' G 149 -10.087 -7.379 -2.913 285 H2'' DG 149 H2" G 149 -9.317 -8.268 -4.216 286 H1' DG 149 H1' G 149 -7.631 -6.502 -4.541 287 H21 DG 149 1H2 G 149 -2.218 -5.588 -3.159 288 H22 DG 149 2H2 G 149 -3.360 -5.461 -4.485 289 H5 DC 150 5H C 150 -7.019 -9.601 -1.668 290 H6 DC 150 6H C 150 -7.152 -9.801 -4.094 291 H5' DC 150 H5' C 150 -8.228 -9.150 -5.745 292 H5'' DC 150 H5" C 150 -7.999 -7.447 -6.244 293 H4' DC 150 H4' C 150 -6.695 -8.224 -8.187 294 H3' DC 150 H3' C 150 -7.709 -10.779 -7.588 295 H2' DC 150 H2' C 150 -6.498 -11.236 -5.696 296 H2'' DC 150 H2" C 150 -5.149 -11.495 -6.787 297 H1' DC 150 H1' C 150 -4.098 -9.556 -6.299 298 H41 DC 150 1H4 C 150 -3.775 -9.358 0.029 299 H42 DC 150 2H4 C 150 -5.518 -9.290 0.211 300 H5 DC 151 5H C 151 -5.119 -12.966 -4.315 301 H6 DC 151 6H C 151 -3.939 -12.995 -6.459 302 H5' DC 151 H5' C 151 -3.435 -10.171 -9.067 303 H5'' DC 151 H5" C 151 -3.207 -11.133 -10.540 304 H4' DC 151 H4' C 151 -1.060 -10.934 -9.443 305 H3' DC 151 H3' C 151 -2.139 -13.457 -10.012 306 H2' DC 151 H2' C 151 -2.746 -13.998 -7.836 307 H2'' DC 151 H2" C 151 -1.096 -14.599 -7.741 308 H1' DC 151 H1' C 151 -0.244 -12.545 -6.749 309 H41 DC 151 1H4 C 151 -3.282 -12.882 -1.184 310 H42 DC 151 2H4 C 151 -4.845 -12.858 -1.968 311 H5 DC 152 5H C 152 -3.181 -15.870 -4.980 312 H6 DC 152 6H C 152 -1.002 -15.957 -6.107 313 H5' DC 152 H5' C 152 1.612 -13.292 -7.580 314 H5'' DC 152 H5" C 152 2.902 -14.039 -8.549 315 H4' DC 152 H4' C 152 3.488 -14.658 -6.401 316 H3' DC 152 H3' C 152 2.531 -16.790 -8.051 317 H2' DC 152 H2' C 152 0.652 -17.199 -6.745 318 H2'' DC 152 H2" C 152 1.796 -18.167 -5.785 319 H1' DC 152 H1' C 152 2.238 -16.340 -4.251 320 H41 DC 152 1H4 C 152 -3.430 -16.214 -1.328 321 H42 DC 152 2H4 C 152 -4.285 -16.089 -2.854 322 H5 DC 153 5H C 153 -1.285 -19.445 -4.652 323 H6 DC 153 6H C 153 1.101 -19.930 -4.448 324 H5' DC 153 H5' C 153 4.433 -17.583 -4.040 325 H5'' DC 153 H5" C 153 5.861 -18.583 -4.363 326 H4' DC 153 H4' C 153 5.199 -19.240 -2.230 327 H3' DC 153 H3' C 153 4.908 -21.177 -4.314 328 H2' DC 153 H2' C 153 2.622 -21.289 -4.186 329 H2'' DC 153 H2" C 153 2.919 -22.395 -2.843 330 H1' DC 153 H1' C 153 2.749 -20.650 -1.176 331 H41 DC 153 1H4 C 153 -3.444 -19.184 -1.681 332 H42 DC 153 2H4 C 153 -3.325 -19.009 -3.423 333 H5 DC 154 5H C 154 -0.197 -23.055 -3.109 334 H6 DC 154 6H C 154 1.677 -23.573 -1.620 335 H5' DC 154 H5' C 154 4.638 -21.832 0.108 336 H5'' DC 154 H5" C 154 5.761 -23.137 0.516 337 H4' DC 154 H4' C 154 4.088 -23.074 2.220 338 H3' DC 154 H3' C 154 4.521 -25.372 0.534 339 H2' DC 154 H2' C 154 2.399 -25.415 -0.376 340 H2'' DC 154 H2" C 154 1.930 -26.113 1.200 341 H1' DC 154 H1' C 154 1.206 -24.053 2.072 342 H41 DC 154 1H4 C 154 -3.602 -22.783 -1.774 343 H42 DC 154 2H4 C 154 -2.569 -22.730 -3.187 344 H8 DG 155 8H G 155 0.557 -27.607 0.912 345 H1 DG 155 1H G 155 -5.487 -25.861 -0.310 346 H5' DG 155 H5' G 155 2.240 -25.491 4.456 347 H5'' DG 155 H5" G 155 2.736 -26.836 5.501 348 H4' DG 155 H4' G 155 0.387 -26.428 5.836 349 H3' DG 155 H3' G 155 1.450 -28.917 5.039 350 H2' DG 155 H2' G 155 0.586 -28.851 2.866 351 H2'' DG 155 H2" G 155 -0.837 -29.562 3.685 352 H1' DG 155 H1' G 155 -1.859 -27.434 3.987 353 H21 DG 155 1H2 G 155 -6.663 -25.838 1.526 354 H22 DG 155 2H2 G 155 -5.954 -26.255 3.080 355 H5 DC 156 5H C 156 -1.609 -30.617 1.109 356 H6 DC 156 6H C 156 -2.461 -30.909 3.384 357 H5' DC 156 H5' C 156 -2.668 -28.720 6.917 358 H5'' DC 156 H5" C 156 -3.003 -29.976 8.119 359 H4' DC 156 H4' C 156 -5.044 -29.431 6.992 360 H3' DC 156 H3' C 156 -3.947 -32.059 6.975 361 H2' DC 156 H2' C 156 -3.655 -32.161 4.676 362 H2'' DC 156 H2" C 156 -5.409 -32.475 4.720 363 H1' DC 156 H1' C 156 -6.030 -30.264 4.289 364 H41 DC 156 1H4 C 156 -3.776 -29.261 -1.538 365 H42 DC 156 2H4 C 156 -2.146 -29.676 -1.050 366 H8 DG 157 8H G 157 -6.342 -34.738 4.714 367 H1 DG 157 1H G 157 -6.897 -32.255 -1.172 368 H5' DG 157 H5' G 157 -8.636 -31.468 7.186 369 H5'' DG 157 H5" G 157 -9.469 -32.581 8.293 370 H4' DG 157 H4' G 157 -10.765 -32.312 6.215 371 H3' DG 157 H3' G 157 -10.148 -34.869 7.152 372 H2' DG 157 H2' G 157 -8.287 -35.214 5.705 373 H2'' DG 157 H2" G 157 -9.588 -35.889 4.669 374 H1' DG 157 H1' G 157 -9.934 -33.796 3.560 375 H21 DG 157 1H2 G 157 -8.990 -31.806 -1.564 376 H22 DG 157 2H2 G 157 -10.211 -31.956 -0.313 377 HA ALA 1 HA ALA 1 19.877 22.220 -11.744 378 H1 ALA 1 HN ALA 1 21.567 20.382 -11.591 379 HB1 ALA 1 1HB ALA 1 21.209 23.563 -13.340 380 HB2 ALA 1 2HB ALA 1 20.907 22.363 -14.615 381 HB3 ALA 1 3HB ALA 1 19.560 23.311 -13.946 382 H SER 2 HN SER 2 20.772 19.365 -13.496 383 HA SER 2 HA SER 2 18.169 18.757 -14.655 384 HG SER 2 HG SER 2 20.920 17.194 -16.209 385 HB2 SER 2 2HB SER 2 20.575 17.012 -13.979 386 HB3 SER 2 3HB SER 2 19.155 16.447 -14.876 387 H GLU 3 HN GLU 3 19.325 18.846 -11.461 388 HA GLU 3 HA GLU 3 17.063 17.165 -10.502 389 HB2 GLU 3 2HB GLU 3 18.503 16.044 -8.881 390 HB3 GLU 3 3HB GLU 3 19.084 15.729 -10.503 391 HG2 GLU 3 2HG GLU 3 20.303 17.759 -8.567 392 HG3 GLU 3 3HG GLU 3 20.903 16.136 -8.859 393 H LYS 4 HN LYS 4 17.117 17.373 -7.900 394 HA LYS 4 HA LYS 4 16.915 18.712 -6.018 395 HB2 LYS 4 2HB LYS 4 19.290 19.436 -6.691 396 HB3 LYS 4 3HB LYS 4 18.551 20.897 -7.385 397 HG2 LYS 4 2HG LYS 4 17.643 21.549 -5.242 398 HG3 LYS 4 3HG LYS 4 18.142 20.019 -4.514 399 HD2 LYS 4 2HD LYS 4 19.636 21.771 -3.826 400 HD3 LYS 4 3HD LYS 4 20.522 20.610 -4.807 401 HE2 LYS 4 2HE LYS 4 19.370 23.168 -5.993 402 HE3 LYS 4 3HE LYS 4 20.922 23.163 -5.146 403 HZ1 LYS 4 3HZ LYS 4 21.225 22.878 -7.496 404 HZ2 LYS 4 1HZ LYS 4 20.301 21.516 -7.505 405 HZ3 LYS 4 2HZ LYS 4 21.733 21.534 -6.693 406 H ARG 5 HN ARG 5 16.690 20.711 -9.029 407 HA ARG 5 HA ARG 5 14.671 22.487 -7.926 408 HE ARG 5 HE ARG 5 17.370 22.601 -12.252 409 HB2 ARG 5 2HB ARG 5 15.289 22.017 -10.894 410 HB3 ARG 5 3HB ARG 5 14.485 23.376 -10.153 411 HG2 ARG 5 2HG ARG 5 16.585 23.951 -8.924 412 HG3 ARG 5 3HG ARG 5 17.418 22.632 -9.766 413 HD2 ARG 5 2HD ARG 5 16.076 25.023 -11.084 414 HD3 ARG 5 3HD ARG 5 17.819 24.815 -10.852 415 HH11 ARG 5 2HH1 ARG 5 15.930 25.739 -13.000 416 HH12 ARG 5 1HH1 ARG 5 15.710 25.283 -14.677 417 HH21 ARG 5 1HH2 ARG 5 17.086 22.138 -14.255 418 HH22 ARG 5 2HH2 ARG 5 16.357 23.267 -15.403 419 HA PRO 6 HA PRO 6 11.583 19.697 -10.468 420 HB2 PRO 6 2HB PRO 6 12.998 17.084 -10.690 421 HB3 PRO 6 3HB PRO 6 12.144 18.004 -11.957 422 HG2 PRO 6 2HG PRO 6 14.863 17.756 -11.942 423 HG3 PRO 6 3HG PRO 6 14.060 19.271 -12.470 424 HD2 PRO 6 2HD PRO 6 15.198 18.611 -9.749 425 HD3 PRO 6 3HD PRO 6 15.509 20.037 -10.775 426 H PHE 7 HN PHE 7 10.254 17.684 -9.789 427 HA PHE 7 HA PHE 7 10.463 17.308 -6.853 428 HD1 PHE 7 1HD PHE 7 7.477 17.685 -5.786 429 HD2 PHE 7 2HD PHE 7 7.819 18.130 -10.062 430 HE1 PHE 7 1HE PHE 7 5.792 19.499 -5.733 431 HE2 PHE 7 2HE PHE 7 6.169 19.983 -9.993 432 HZ PHE 7 HZ PHE 7 5.168 20.681 -7.829 433 HB2 PHE 7 2HB PHE 7 8.543 16.085 -8.899 434 HB3 PHE 7 3HB PHE 7 8.452 15.968 -7.145 435 H MET 8 HN MET 8 12.217 15.924 -6.322 436 HA MET 8 HA MET 8 12.585 13.564 -8.116 437 HB2 MET 8 2HB MET 8 14.935 13.499 -7.144 438 HB3 MET 8 3HB MET 8 14.590 14.806 -8.277 439 HG2 MET 8 2HG MET 8 14.414 16.395 -6.447 440 HG3 MET 8 3HG MET 8 14.568 15.106 -5.249 441 HE1 MET 8 3HE MET 8 16.719 13.902 -4.583 442 HE2 MET 8 1HE MET 8 16.952 13.243 -6.218 443 HE3 MET 8 2HE MET 8 18.288 14.075 -5.399 444 H CYS 9 HN CYS 9 12.827 11.557 -7.240 445 HA CYS 9 HA CYS 9 11.837 11.216 -4.473 446 HB2 CYS 9 2HB CYS 9 11.038 9.653 -6.224 447 HB3 CYS 9 3HB CYS 9 12.718 9.137 -6.544 448 H ALA 10 HN ALA 10 13.066 10.463 -2.777 449 HA ALA 10 HA ALA 10 15.961 9.990 -3.238 450 HB1 ALA 10 1HB ALA 10 14.843 11.927 -1.158 451 HB2 ALA 10 2HB ALA 10 16.554 11.494 -1.374 452 HB3 ALA 10 3HB ALA 10 15.702 12.389 -2.645 453 H TYR 11 HN TYR 11 13.229 8.592 -2.277 454 HA TYR 11 HA TYR 11 13.690 7.746 0.428 455 HD1 TYR 11 1HD TYR 11 11.313 7.150 1.705 456 HD2 TYR 11 2HD TYR 11 12.530 4.040 -1.015 457 HE1 TYR 11 1HE TYR 11 11.299 5.531 3.557 458 HE2 TYR 11 2HE TYR 11 12.450 2.387 0.844 459 HH TYR 11 HH TYR 11 11.568 3.312 4.177 460 HB2 TYR 11 2HB TYR 11 11.508 7.551 -0.775 461 HB3 TYR 11 3HB TYR 11 12.215 6.317 -1.819 462 HA PRO 12 HA PRO 12 17.439 5.360 -0.260 463 HB2 PRO 12 2HB PRO 12 16.332 4.006 2.241 464 HB3 PRO 12 3HB PRO 12 18.019 4.485 1.877 465 HG2 PRO 12 2HG PRO 12 16.490 6.038 3.466 466 HG3 PRO 12 3HG PRO 12 17.490 6.803 2.188 467 HD2 PRO 12 2HD PRO 12 14.523 6.232 2.163 468 HD3 PRO 12 3HD PRO 12 15.426 7.670 1.578 469 H GLY 13 HN GLY 13 17.158 4.058 -2.076 470 HA2 GLY 13 2HA GLY 13 16.899 1.496 -2.498 471 HA3 GLY 13 3HA GLY 13 15.263 1.771 -1.867 472 H CYS 14 HN CYS 14 14.798 4.335 -2.929 473 HA CYS 14 HA CYS 14 14.767 3.843 -5.883 474 HB2 CYS 14 2HB CYS 14 12.568 3.984 -4.635 475 HB3 CYS 14 3HB CYS 14 12.955 5.675 -4.266 476 H ASN 15 HN ASN 15 14.502 6.063 -7.076 477 HA ASN 15 HA ASN 15 15.579 8.470 -6.123 478 HB2 ASN 15 2HB ASN 15 17.718 6.534 -6.498 479 HB3 ASN 15 3HB ASN 15 17.839 7.705 -7.788 480 HD21 ASN 15 1HD2 ASN 15 17.245 7.618 -4.275 481 HD22 ASN 15 2HD2 ASN 15 18.272 9.051 -3.934 482 H LYS 16 HN LYS 16 14.760 9.928 -7.583 483 HA LYS 16 HA LYS 16 14.700 9.294 -10.452 484 HB2 LYS 16 2HB LYS 16 12.149 9.500 -8.866 485 HB3 LYS 16 3HB LYS 16 12.207 9.324 -10.616 486 HG2 LYS 16 2HG LYS 16 13.029 7.206 -8.597 487 HG3 LYS 16 3HG LYS 16 11.459 7.313 -9.349 488 HD2 LYS 16 2HD LYS 16 12.220 6.675 -11.466 489 HD3 LYS 16 3HD LYS 16 13.890 7.147 -11.131 490 HE2 LYS 16 2HE LYS 16 13.676 4.706 -11.172 491 HE3 LYS 16 3HE LYS 16 14.192 5.300 -9.586 492 HZ1 LYS 16 3HZ LYS 16 11.397 4.612 -10.224 493 HZ2 LYS 16 1HZ LYS 16 12.040 4.982 -8.741 494 HZ3 LYS 16 2HZ LYS 16 12.467 3.590 -9.481 495 H ARG 17 HN ARG 17 13.303 11.011 -11.619 496 HA ARG 17 HA ARG 17 13.039 13.499 -10.038 497 HE ARG 17 HE ARG 17 15.612 13.258 -15.607 498 HB2 ARG 17 2HB ARG 17 14.035 14.881 -11.744 499 HB3 ARG 17 3HB ARG 17 15.212 13.708 -11.173 500 HG2 ARG 17 2HG ARG 17 14.892 12.368 -13.257 501 HG3 ARG 17 3HG ARG 17 13.697 13.563 -13.820 502 HD2 ARG 17 2HD ARG 17 15.435 15.342 -13.535 503 HD3 ARG 17 3HD ARG 17 16.640 14.073 -13.249 504 HH11 ARG 17 1HH1 ARG 17 16.668 16.478 -14.645 505 HH12 ARG 17 2HH1 ARG 17 16.906 16.983 -16.316 506 HH21 ARG 17 1HH2 ARG 17 16.027 13.946 -17.686 507 HH22 ARG 17 2HH2 ARG 17 16.586 15.578 -17.964 508 H TYR 18 HN TYR 18 11.182 14.495 -10.400 509 HA TYR 18 HA TYR 18 9.534 13.655 -12.752 510 HD1 TYR 18 2HD TYR 18 10.169 12.176 -9.022 511 HD2 TYR 18 1HD TYR 18 7.083 11.667 -11.987 512 HE1 TYR 18 2HE TYR 18 10.124 9.718 -8.607 513 HE2 TYR 18 1HE TYR 18 7.192 9.224 -11.695 514 HH TYR 18 HH TYR 18 9.192 7.680 -9.236 515 HB2 TYR 18 2HB TYR 18 8.701 14.104 -9.856 516 HB3 TYR 18 3HB TYR 18 7.622 13.853 -11.148 517 H PHE 19 HN PHE 19 7.710 15.145 -13.225 518 HA PHE 19 HA PHE 19 8.453 17.991 -12.616 519 HD1 PHE 19 1HD PHE 19 5.366 17.355 -15.710 520 HD2 PHE 19 2HD PHE 19 9.224 15.435 -15.777 521 HE1 PHE 19 1HE PHE 19 4.536 15.731 -17.403 522 HE2 PHE 19 2HE PHE 19 8.403 13.843 -17.490 523 HZ PHE 19 HZ PHE 19 6.057 13.989 -18.304 524 HB2 PHE 19 2HB PHE 19 7.413 18.491 -14.861 525 HB3 PHE 19 3HB PHE 19 8.946 17.667 -14.874 526 H LYS 20 HN LYS 20 5.745 15.744 -13.442 527 HA LYS 20 HA LYS 20 3.722 17.686 -12.670 528 HB2 LYS 20 2HB LYS 20 3.754 15.191 -14.072 529 HB3 LYS 20 3HB LYS 20 2.774 14.942 -12.616 530 HG2 LYS 20 2HG LYS 20 1.287 15.609 -14.283 531 HG3 LYS 20 3HG LYS 20 1.452 16.973 -13.173 532 HD2 LYS 20 2HD LYS 20 3.062 18.042 -14.785 533 HD3 LYS 20 3HD LYS 20 2.830 16.683 -15.891 534 HE2 LYS 20 2HE LYS 20 0.614 18.538 -14.916 535 HE3 LYS 20 3HE LYS 20 1.483 18.732 -16.445 536 HZ1 LYS 20 3HZ LYS 20 -0.589 17.568 -16.744 537 HZ2 LYS 20 1HZ LYS 20 -0.126 16.379 -15.703 538 HZ3 LYS 20 2HZ LYS 20 0.675 16.585 -17.127 539 H LEU 21 HN LEU 21 3.441 18.303 -10.659 540 HA LEU 21 HA LEU 21 4.335 17.202 -8.268 541 HG LEU 21 HG LEU 21 3.133 18.432 -6.150 542 HB2 LEU 21 2HB LEU 21 3.256 19.380 -8.522 543 HB3 LEU 21 3HB LEU 21 1.708 18.652 -8.838 544 HD11 LEU 21 1HD1 LEU 21 2.691 20.786 -6.742 545 HD12 LEU 21 2HD1 LEU 21 1.559 20.271 -5.493 546 HD13 LEU 21 3HD1 LEU 21 1.012 20.385 -7.172 547 HD21 LEU 21 3HD2 LEU 21 0.689 18.101 -5.405 548 HD22 LEU 21 1HD2 LEU 21 1.402 16.744 -6.233 549 HD23 LEU 21 2HD2 LEU 21 0.283 17.834 -7.100 550 H SER 22 HN SER 22 1.162 16.512 -9.857 551 HA SER 22 HA SER 22 0.265 14.590 -7.911 552 HG SER 22 HG SER 22 -1.349 15.291 -11.574 553 HB2 SER 22 2HB SER 22 -1.391 13.985 -9.722 554 HB3 SER 22 3HB SER 22 -1.346 15.701 -9.280 555 H HIS 23 HN HIS 23 2.396 14.275 -10.665 556 HA HIS 23 HA HIS 23 1.810 11.371 -11.000 557 HD1 HIS 23 1HD HIS 23 4.303 11.852 -14.924 558 HD2 HIS 23 2HD HIS 23 5.559 13.899 -11.496 559 HE1 HIS 23 1HE HIS 23 6.547 12.916 -15.486 560 HB2 HIS 23 2HB HIS 23 2.996 11.326 -12.836 561 HB3 HIS 23 3HB HIS 23 2.353 12.889 -12.987 562 H LEU 24 HN LEU 24 4.331 13.606 -9.791 563 HA LEU 24 HA LEU 24 5.919 11.532 -8.631 564 HG LEU 24 HG LEU 24 8.228 13.900 -7.483 565 HB2 LEU 24 2HB LEU 24 6.664 13.831 -9.068 566 HB3 LEU 24 3HB LEU 24 5.630 14.466 -7.836 567 HD11 LEU 24 1HD1 LEU 24 6.756 15.027 -5.846 568 HD12 LEU 24 2HD1 LEU 24 7.901 13.919 -5.070 569 HD13 LEU 24 3HD1 LEU 24 6.203 13.451 -5.262 570 HD21 LEU 24 3HD2 LEU 24 7.796 11.324 -7.737 571 HD22 LEU 24 1HD2 LEU 24 7.371 11.453 -6.025 572 HD23 LEU 24 2HD2 LEU 24 8.947 11.980 -6.572 573 H GLN 25 HN GLN 25 3.146 13.448 -7.345 574 HA GLN 25 HA GLN 25 3.220 12.489 -4.664 575 HB2 GLN 25 2HB GLN 25 1.764 14.326 -5.588 576 HB3 GLN 25 3HB GLN 25 0.702 13.106 -6.300 577 HG2 GLN 25 2HG GLN 25 1.348 12.974 -3.337 578 HG3 GLN 25 3HG GLN 25 0.285 14.246 -3.915 579 HE21 GLN 25 1HE2 GLN 25 0.565 10.608 -3.821 580 HE22 GLN 25 2HE2 GLN 25 -1.207 10.468 -3.923 581 H MET 26 HN MET 26 1.722 11.122 -7.627 582 HA MET 26 HA MET 26 0.586 8.802 -6.405 583 HB2 MET 26 2HB MET 26 0.034 9.607 -8.681 584 HB3 MET 26 3HB MET 26 1.656 9.200 -9.240 585 HG2 MET 26 2HG MET 26 0.030 7.514 -9.889 586 HG3 MET 26 3HG MET 26 1.246 6.827 -8.817 587 HE1 MET 26 3HE MET 26 -2.033 4.789 -8.204 588 HE2 MET 26 1HE MET 26 -1.669 5.639 -9.717 589 HE3 MET 26 2HE MET 26 -0.376 4.780 -8.846 590 H HIS 27 HN HIS 27 3.798 9.338 -8.020 591 HA HIS 27 HA HIS 27 4.818 6.715 -7.657 592 HD1 HIS 27 1HD HIS 27 7.237 5.678 -8.123 593 HD2 HIS 27 2HD HIS 27 8.451 9.316 -6.379 594 HE1 HIS 27 1HE HIS 27 9.385 5.198 -6.784 595 HB2 HIS 27 2HB HIS 27 6.045 8.251 -9.053 596 HB3 HIS 27 3HB HIS 27 6.210 9.431 -7.746 597 H SER 28 HN SER 28 4.742 9.508 -5.400 598 HA SER 28 HA SER 28 6.561 8.496 -3.471 599 HG SER 28 HG SER 28 5.590 11.097 -4.717 600 HB2 SER 28 2HB SER 28 4.153 10.326 -3.059 601 HB3 SER 28 3HB SER 28 5.561 10.168 -1.998 602 H ARG 29 HN ARG 29 3.191 7.752 -4.212 603 HA ARG 29 HA ARG 29 2.289 6.878 -1.682 604 HE ARG 29 HE ARG 29 -1.481 6.099 -5.353 605 HB2 ARG 29 2HB ARG 29 0.962 7.156 -3.847 606 HB3 ARG 29 3HB ARG 29 1.597 5.573 -4.340 607 HG2 ARG 29 2HG ARG 29 0.621 4.632 -2.177 608 HG3 ARG 29 3HG ARG 29 -0.148 6.199 -1.919 609 HD2 ARG 29 2HD ARG 29 -0.502 4.333 -4.304 610 HD3 ARG 29 3HD ARG 29 -1.644 4.518 -2.981 611 HH11 ARG 29 1HH2 ARG 29 -2.097 6.752 -1.928 612 HH12 ARG 29 2HH2 ARG 29 -3.145 8.079 -2.306 613 HH21 ARG 29 1HH1 ARG 29 -2.820 7.743 -5.741 614 HH22 ARG 29 2HH1 ARG 29 -3.509 8.664 -4.419 615 H LYS 30 HN LYS 30 4.313 5.203 -4.132 616 HA LYS 30 HA LYS 30 4.205 2.552 -2.978 617 HB2 LYS 30 2HB LYS 30 6.317 4.010 -4.642 618 HB3 LYS 30 3HB LYS 30 6.495 2.331 -4.106 619 HG2 LYS 30 2HG LYS 30 4.335 1.736 -5.174 620 HG3 LYS 30 3HG LYS 30 4.180 3.393 -5.786 621 HD2 LYS 30 2HD LYS 30 6.169 3.122 -7.176 622 HD3 LYS 30 3HD LYS 30 6.529 1.557 -6.426 623 HE2 LYS 30 2HE LYS 30 5.530 1.169 -8.598 624 HE3 LYS 30 3HE LYS 30 4.436 0.607 -7.328 625 HZ1 LYS 30 3HZ LYS 30 3.174 2.642 -7.602 626 HZ2 LYS 30 1HZ LYS 30 3.282 1.847 -9.039 627 HZ3 LYS 30 2HZ LYS 30 4.212 3.177 -8.763 628 H HIS 31 HN HIS 31 6.053 5.473 -2.165 629 HA HIS 31 HA HIS 31 7.716 4.032 -0.184 630 HD1 HIS 31 1HD HIS 31 9.638 3.625 -1.214 631 HD2 HIS 31 2HD HIS 31 9.218 7.311 -3.224 632 HE1 HIS 31 1HE HIS 31 11.022 3.467 -3.348 633 HB2 HIS 31 2HB HIS 31 7.660 6.958 -1.044 634 HB3 HIS 31 3HB HIS 31 8.784 6.265 0.134 635 H THR 32 HN THR 32 4.554 4.914 0.004 636 HA THR 32 HA THR 32 4.709 6.564 2.493 637 HB THR 32 HB THR 32 2.257 6.439 2.491 638 HG1 THR 32 1HG THR 32 2.485 5.068 -0.002 639 HG21 THR 32 3HG2 THR 32 3.483 7.598 -0.007 640 HG22 THR 32 1HG2 THR 32 3.171 8.391 1.533 641 HG23 THR 32 2HG2 THR 32 1.810 7.882 0.511 642 H GLY 33 HN GLY 33 3.924 3.331 1.194 643 HA2 GLY 33 2HA GLY 33 3.434 2.249 3.899 644 HA3 GLY 33 3HA GLY 33 3.379 1.357 2.366 645 H GLU 34 HN GLU 34 5.930 3.413 3.868 646 HA GLU 34 HA GLU 34 7.856 1.144 3.519 647 HB2 GLU 34 2HB GLU 34 9.562 2.741 3.354 648 HB3 GLU 34 3HB GLU 34 8.271 3.376 2.375 649 HG2 GLU 34 2HG GLU 34 8.977 5.289 3.538 650 HG3 GLU 34 3HG GLU 34 7.592 4.777 4.482 651 H LYS 35 HN LYS 35 6.149 2.999 5.900 652 HA LYS 35 HA LYS 35 7.997 3.324 7.965 653 HB2 LYS 35 2HB LYS 35 5.605 4.176 7.768 654 HB3 LYS 35 3HB LYS 35 5.063 2.632 8.407 655 HG2 LYS 35 2HG LYS 35 6.890 4.660 9.800 656 HG3 LYS 35 3HG LYS 35 5.174 4.417 10.104 657 HD2 LYS 35 2HD LYS 35 5.811 1.980 10.738 658 HD3 LYS 35 3HD LYS 35 7.468 2.595 10.828 659 HE2 LYS 35 2HE LYS 35 6.877 4.186 12.528 660 HE3 LYS 35 3HE LYS 35 5.154 3.775 12.386 661 HZ1 LYS 35 3HZ LYS 35 7.226 1.809 13.109 662 HZ2 LYS 35 1HZ LYS 35 5.602 1.609 13.164 663 HZ3 LYS 35 2HZ LYS 35 6.328 2.641 14.230 664 HA PRO 36 HA PRO 36 8.957 -0.998 8.974 665 HB2 PRO 36 2HB PRO 36 10.399 0.490 11.197 666 HB3 PRO 36 3HB PRO 36 10.988 -0.838 10.160 667 HG2 PRO 36 2HG PRO 36 11.769 1.706 9.700 668 HG3 PRO 36 3HG PRO 36 11.303 0.656 8.319 669 HD2 PRO 36 2HD PRO 36 9.631 2.757 9.722 670 HD3 PRO 36 3HD PRO 36 9.875 2.469 7.971 671 H TYR 37 HN TYR 37 7.175 -1.997 9.787 672 HA TYR 37 HA TYR 37 6.388 -1.360 12.626 673 HD1 TYR 37 1HD TYR 37 4.137 -0.674 13.620 674 HD2 TYR 37 2HD TYR 37 3.959 -0.107 9.351 675 HE1 TYR 37 1HE TYR 37 3.029 1.544 13.953 676 HE2 TYR 37 2HE TYR 37 2.887 2.116 9.685 677 HH TYR 37 HH TYR 37 2.487 3.845 11.345 678 HB2 TYR 37 2HB TYR 37 4.786 -2.100 10.177 679 HB3 TYR 37 3HB TYR 37 4.203 -2.623 11.696 680 H GLN 38 HN GLN 38 7.395 -2.905 13.882 681 HA GLN 38 HA GLN 38 7.548 -5.688 12.816 682 HB2 GLN 38 2HB GLN 38 9.226 -6.111 14.421 683 HB3 GLN 38 3HB GLN 38 9.676 -4.606 13.647 684 HG2 GLN 38 2HG GLN 38 9.354 -3.363 15.613 685 HG3 GLN 38 3HG GLN 38 8.228 -4.516 16.321 686 HE21 GLN 38 1HE2 GLN 38 8.977 -6.342 17.463 687 HE22 GLN 38 2HE2 GLN 38 10.666 -6.553 17.891 688 H CYS 39 HN CYS 39 6.969 -7.445 14.175 689 HA CYS 39 HA CYS 39 4.608 -6.984 15.832 690 HB2 CYS 39 2HB CYS 39 6.216 -9.329 14.912 691 HB3 CYS 39 3HB CYS 39 5.345 -9.548 16.417 692 H ASP 40 HN ASP 40 4.427 -7.514 18.080 693 HA ASP 40 HA ASP 40 6.942 -7.656 19.644 694 HB2 ASP 40 2HB ASP 40 4.754 -5.563 20.086 695 HB3 ASP 40 3HB ASP 40 6.033 -5.929 21.252 696 H PHE 41 HN PHE 41 5.499 -9.848 19.180 697 HA PHE 41 HA PHE 41 3.389 -10.085 21.283 698 HD1 PHE 41 1HD PHE 41 0.760 -11.253 20.327 699 HD2 PHE 41 2HD PHE 41 3.527 -9.945 17.299 700 HE1 PHE 41 1HE PHE 41 -1.055 -9.958 19.222 701 HE2 PHE 41 2HE PHE 41 1.758 -8.601 16.244 702 HZ PHE 41 HZ PHE 41 -0.533 -8.579 17.217 703 HB2 PHE 41 2HB PHE 41 4.109 -11.740 18.839 704 HB3 PHE 41 3HB PHE 41 2.958 -12.293 20.033 705 H LYS 42 HN LYS 42 6.690 -10.609 20.949 706 HA LYS 42 HA LYS 42 8.258 -11.863 22.139 707 HB2 LYS 42 2HB LYS 42 6.599 -11.639 24.081 708 HB3 LYS 42 3HB LYS 42 5.988 -13.235 23.697 709 HG2 LYS 42 2HG LYS 42 8.862 -12.599 24.437 710 HG3 LYS 42 3HG LYS 42 7.620 -13.171 25.540 711 HD2 LYS 42 2HD LYS 42 8.892 -14.729 23.269 712 HD3 LYS 42 3HD LYS 42 9.034 -15.017 24.993 713 HE2 LYS 42 2HE LYS 42 6.674 -15.665 25.153 714 HE3 LYS 42 3HE LYS 42 6.411 -15.246 23.458 715 HZ1 LYS 42 3HZ LYS 42 6.714 -17.552 23.603 716 HZ2 LYS 42 1HZ LYS 42 8.127 -17.414 24.455 717 HZ3 LYS 42 2HZ LYS 42 8.051 -16.938 22.877 718 H ASP 43 HN ASP 43 5.304 -13.840 21.508 719 HA ASP 43 HA ASP 43 6.838 -16.107 20.469 720 HB2 ASP 43 2HB ASP 43 3.881 -15.361 20.292 721 HB3 ASP 43 3HB ASP 43 4.570 -16.888 19.720 722 H CYS 44 HN CYS 44 5.877 -13.014 19.238 723 HA CYS 44 HA CYS 44 6.940 -13.810 16.598 724 HB2 CYS 44 2HB CYS 44 4.400 -13.760 16.401 725 HB3 CYS 44 3HB CYS 44 4.474 -12.012 16.791 726 H GLU 45 HN GLU 45 8.294 -12.376 15.747 727 HA GLU 45 HA GLU 45 8.121 -9.539 16.481 728 HB2 GLU 45 2HB GLU 45 10.607 -11.236 17.022 729 HB3 GLU 45 3HB GLU 45 10.709 -9.507 16.687 730 HG2 GLU 45 2HG GLU 45 8.926 -9.209 18.558 731 HG3 GLU 45 3HG GLU 45 9.452 -10.815 19.075 732 H ARG 46 HN ARG 46 7.233 -10.674 14.171 733 HA ARG 46 HA ARG 46 9.254 -10.730 12.056 734 HE ARG 46 HE ARG 46 6.246 -14.874 10.178 735 HB2 ARG 46 2HB ARG 46 6.213 -10.608 12.111 736 HB3 ARG 46 3HB ARG 46 7.108 -10.589 10.590 737 HG2 ARG 46 2HG ARG 46 8.010 -12.768 10.937 738 HG3 ARG 46 3HG ARG 46 7.473 -12.822 12.623 739 HD2 ARG 46 2HD ARG 46 5.128 -12.760 11.925 740 HD3 ARG 46 3HD ARG 46 5.597 -12.614 10.230 741 HH11 ARG 46 1HH1 ARG 46 5.211 -14.116 13.516 742 HH12 ARG 46 2HH1 ARG 46 5.000 -15.802 13.878 743 HH21 ARG 46 1HH2 ARG 46 6.022 -16.980 10.804 744 HH22 ARG 46 2HH2 ARG 46 5.425 -17.344 12.414 745 H ARG 47 HN ARG 47 8.663 -9.182 10.062 746 HA ARG 47 HA ARG 47 8.253 -6.417 11.114 747 HE ARG 47 HE ARG 47 11.372 -8.811 13.238 748 HB2 ARG 47 2HB ARG 47 10.493 -7.359 9.242 749 HB3 ARG 47 3HB ARG 47 9.989 -5.685 9.407 750 HG2 ARG 47 2HG ARG 47 11.643 -5.592 10.916 751 HG3 ARG 47 3HG ARG 47 10.346 -6.105 11.986 752 HD2 ARG 47 2HD ARG 47 11.434 -8.516 10.984 753 HD3 ARG 47 3HD ARG 47 12.843 -7.473 11.193 754 HH11 ARG 47 1HH1 ARG 47 12.695 -5.511 12.955 755 HH12 ARG 47 2HH1 ARG 47 12.470 -5.329 14.701 756 HH21 ARG 47 2HH2 ARG 47 11.343 -8.465 15.264 757 HH22 ARG 47 1HH2 ARG 47 11.860 -6.912 15.952 758 H PHE 48 HN PHE 48 7.248 -4.997 9.761 759 HA PHE 48 HA PHE 48 6.461 -5.909 7.038 760 HD1 PHE 48 1HD PHE 48 4.088 -7.658 6.861 761 HD2 PHE 48 2HD PHE 48 4.796 -6.338 10.903 762 HE1 PHE 48 1HE PHE 48 3.784 -9.975 7.683 763 HE2 PHE 48 2HE PHE 48 4.528 -8.664 11.719 764 HZ PHE 48 HZ PHE 48 4.101 -10.493 10.089 765 HB2 PHE 48 2HB PHE 48 4.535 -4.709 9.080 766 HB3 PHE 48 3HB PHE 48 4.153 -5.231 7.447 767 H SER 49 HN SER 49 5.533 -4.030 5.750 768 HA SER 49 HA SER 49 7.139 -1.587 6.435 769 HG SER 49 HG SER 49 5.622 -1.127 3.188 770 HB2 SER 49 2HB SER 49 7.422 -1.233 4.167 771 HB3 SER 49 3HB SER 49 7.388 -2.997 4.218 772 H ARG 50 HN ARG 50 3.905 -2.736 6.349 773 HA ARG 50 HA ARG 50 2.877 0.077 6.331 774 HE ARG 50 HE ARG 50 1.613 -0.926 2.064 775 HB2 ARG 50 2HB ARG 50 2.511 -1.524 4.218 776 HB3 ARG 50 3HB ARG 50 1.196 -2.160 5.208 777 HG2 ARG 50 2HG ARG 50 0.357 0.259 5.358 778 HG3 ARG 50 3HG ARG 50 1.600 0.676 4.173 779 HD2 ARG 50 2HD ARG 50 -0.727 -1.241 3.829 780 HD3 ARG 50 3HD ARG 50 -0.531 0.335 3.047 781 HH11 ARG 50 1HH2 ARG 50 -1.695 -2.107 2.250 782 HH12 ARG 50 2HH2 ARG 50 -1.519 -3.094 0.838 783 HH21 ARG 50 1HH1 ARG 50 1.819 -2.200 0.338 784 HH22 ARG 50 2HH1 ARG 50 0.424 -3.052 -0.266 785 H SER 51 HN SER 51 1.225 0.535 7.765 786 HA SER 51 HA SER 51 0.994 -1.024 10.119 787 HG SER 51 HG SER 51 -1.298 1.163 11.423 788 HB2 SER 51 2HB SER 51 0.426 1.442 9.851 789 HB3 SER 51 3HB SER 51 -1.103 0.933 9.090 790 H ASP 52 HN ASP 52 -1.089 -0.870 7.196 791 HA ASP 52 HA ASP 52 -3.125 -2.614 8.045 792 HB2 ASP 52 2HB ASP 52 -3.093 -1.278 5.939 793 HB3 ASP 52 3HB ASP 52 -1.921 -2.396 5.260 794 H GLN 53 HN GLN 53 0.067 -3.395 6.577 795 HA GLN 53 HA GLN 53 -0.371 -6.212 6.287 796 HB2 GLN 53 2HB GLN 53 2.164 -4.597 6.701 797 HB3 GLN 53 3HB GLN 53 2.155 -6.308 6.325 798 HG2 GLN 53 2HG GLN 53 1.423 -5.957 4.107 799 HG3 GLN 53 3HG GLN 53 0.893 -4.303 4.437 800 HE21 GLN 53 1HE2 GLN 53 2.375 -3.619 2.516 801 HE22 GLN 53 2HE2 GLN 53 4.092 -3.475 2.993 802 H LEU 54 HN LEU 54 1.264 -4.281 8.876 803 HA LEU 54 HA LEU 54 1.767 -6.503 10.624 804 HG LEU 54 HG LEU 54 1.018 -4.662 13.278 805 HB2 LEU 54 2HB LEU 54 2.935 -4.396 10.920 806 HB3 LEU 54 3HB LEU 54 1.426 -3.509 11.138 807 HD11 LEU 54 1HD1 LEU 54 3.757 -5.959 12.910 808 HD12 LEU 54 2HD1 LEU 54 2.205 -6.819 12.890 809 HD13 LEU 54 3HD1 LEU 54 2.757 -6.030 14.362 810 HD21 LEU 54 3HD2 LEU 54 3.849 -3.633 13.475 811 HD22 LEU 54 1HD2 LEU 54 2.528 -3.508 14.614 812 HD23 LEU 54 2HD2 LEU 54 2.447 -2.541 13.138 813 H LYS 55 HN LYS 55 -0.960 -4.126 10.536 814 HA LYS 55 HA LYS 55 -2.329 -5.100 12.821 815 HB2 LYS 55 2HB LYS 55 -2.719 -2.924 11.707 816 HB3 LYS 55 3HB LYS 55 -3.502 -3.741 10.347 817 HG2 LYS 55 2HG LYS 55 -5.279 -4.566 11.860 818 HG3 LYS 55 3HG LYS 55 -4.465 -3.832 13.249 819 HD2 LYS 55 2HD LYS 55 -5.568 -2.302 10.845 820 HD3 LYS 55 3HD LYS 55 -6.396 -2.504 12.395 821 HE2 LYS 55 2HE LYS 55 -4.469 -1.372 13.540 822 HE3 LYS 55 3HE LYS 55 -3.738 -1.075 11.952 823 HZ1 LYS 55 3HZ LYS 55 -6.359 -0.078 12.858 824 HZ2 LYS 55 1HZ LYS 55 -5.724 0.156 11.359 825 HZ3 LYS 55 2HZ LYS 55 -4.990 0.820 12.674 826 H ARG 56 HN ARG 56 -2.670 -5.999 9.352 827 HA ARG 56 HA ARG 56 -4.773 -7.941 9.747 828 HE ARG 56 HE ARG 56 -1.961 -8.897 5.994 829 HB2 ARG 56 2HB ARG 56 -4.144 -7.031 7.539 830 HB3 ARG 56 3HB ARG 56 -2.553 -7.782 7.661 831 HG2 ARG 56 2HG ARG 56 -3.633 -10.041 7.616 832 HG3 ARG 56 3HG ARG 56 -5.221 -9.267 7.535 833 HD2 ARG 56 2HD ARG 56 -4.542 -9.964 5.304 834 HD3 ARG 56 3HD ARG 56 -4.571 -8.194 5.373 835 HH11 ARG 56 1HH1 ARG 56 -3.976 -9.537 3.145 836 HH12 ARG 56 2HH1 ARG 56 -2.564 -9.637 2.104 837 HH21 ARG 56 1HH2 ARG 56 -0.284 -9.078 4.634 838 HH22 ARG 56 2HH2 ARG 56 -0.538 -9.443 2.939 839 H HIS 57 HN HIS 57 -1.194 -8.167 9.641 840 HA HIS 57 HA HIS 57 -0.990 -10.957 10.008 841 HD1 HIS 57 1HD HIS 57 1.160 -12.419 9.803 842 HD2 HIS 57 2HD HIS 57 2.331 -9.639 12.673 843 HE1 HIS 57 1HE HIS 57 2.645 -13.714 11.498 844 HB2 HIS 57 2HB HIS 57 0.898 -9.591 9.302 845 HB3 HIS 57 3HB HIS 57 0.899 -8.707 10.835 846 H GLN 58 HN GLN 58 -1.282 -8.323 12.427 847 HA GLN 58 HA GLN 58 -0.752 -9.694 14.786 848 HB2 GLN 58 2HB GLN 58 -1.134 -7.505 15.158 849 HB3 GLN 58 3HB GLN 58 -2.413 -7.358 14.016 850 HG2 GLN 58 2HG GLN 58 -2.795 -8.628 16.751 851 HG3 GLN 58 3HG GLN 58 -2.966 -6.912 16.438 852 HE21 GLN 58 1HE2 GLN 58 -4.464 -7.026 13.824 853 HE22 GLN 58 2HE2 GLN 58 -6.002 -7.690 14.391 854 H ARG 59 HN ARG 59 -3.711 -9.837 12.772 855 HA ARG 59 HA ARG 59 -5.456 -11.087 14.652 856 HE ARG 59 HE ARG 59 -7.779 -10.057 9.867 857 HB2 ARG 59 2HB ARG 59 -5.391 -11.365 11.600 858 HB3 ARG 59 3HB ARG 59 -6.699 -11.876 12.678 859 HG2 ARG 59 2HG ARG 59 -6.614 -9.482 13.661 860 HG3 ARG 59 3HG ARG 59 -5.707 -9.030 12.221 861 HD2 ARG 59 2HD ARG 59 -8.414 -10.396 12.068 862 HD3 ARG 59 3HD ARG 59 -8.284 -8.665 12.373 863 HH11 ARG 59 1HH2 ARG 59 -7.131 -6.989 11.483 864 HH12 ARG 59 2HH2 ARG 59 -7.170 -6.128 9.958 865 HH21 ARG 59 2HH1 ARG 59 -7.811 -8.974 8.109 866 HH22 ARG 59 1HH1 ARG 59 -7.515 -7.230 8.046 867 H ARG 60 HN ARG 60 -2.832 -12.444 12.660 868 HA ARG 60 HA ARG 60 -3.506 -15.220 12.787 869 HE ARG 60 HE ARG 60 0.891 -17.896 12.268 870 HB2 ARG 60 2HB ARG 60 -1.684 -14.295 11.385 871 HB3 ARG 60 3HB ARG 60 -0.764 -13.882 12.841 872 HG2 ARG 60 2HG ARG 60 -0.541 -16.259 13.433 873 HG3 ARG 60 3HG ARG 60 -1.479 -16.708 12.001 874 HD2 ARG 60 2HD ARG 60 0.295 -15.571 10.593 875 HD3 ARG 60 3HD ARG 60 1.176 -15.207 12.078 876 HH11 ARG 60 1HH1 ARG 60 2.210 -15.987 9.561 877 HH12 ARG 60 2HH1 ARG 60 3.419 -17.209 9.258 878 HH21 ARG 60 1HH2 ARG 60 2.393 -19.382 11.695 879 HH22 ARG 60 2HH2 ARG 60 3.480 -19.077 10.359 880 H HIS 61 HN HIS 61 -2.010 -13.063 15.222 881 HA HIS 61 HA HIS 61 -1.394 -15.326 17.031 882 HD1 HIS 61 1HD HIS 61 -0.909 -11.312 15.554 883 HD2 HIS 61 2HD HIS 61 2.086 -13.808 17.001 884 HE1 HIS 61 1HE HIS 61 1.278 -10.628 14.358 885 HB2 HIS 61 2HB HIS 61 -1.263 -12.461 17.928 886 HB3 HIS 61 3HB HIS 61 -0.211 -13.804 18.318 887 H THR 62 HN THR 62 -3.606 -12.499 16.881 888 HA THR 62 HA THR 62 -4.756 -13.053 19.489 889 HB THR 62 HB THR 62 -6.266 -11.207 19.000 890 HG1 THR 62 1HG THR 62 -5.729 -10.210 16.777 891 HG21 THR 62 3HG2 THR 62 -3.834 -10.722 19.513 892 HG22 THR 62 1HG2 THR 62 -4.656 -9.442 18.623 893 HG23 THR 62 2HG2 THR 62 -3.541 -10.539 17.777 894 H GLY 63 HN GLY 63 -5.307 -14.346 16.335 895 HA2 GLY 63 2HA GLY 63 -6.713 -16.074 15.707 896 HA3 GLY 63 3HA GLY 63 -7.284 -16.164 17.382 897 H VAL 64 HN VAL 64 -7.707 -12.990 16.329 898 HA VAL 64 HA VAL 64 -10.561 -13.256 16.408 899 HB VAL 64 HB VAL 64 -9.186 -11.276 17.118 900 HG11 VAL 64 1HG1 VAL 64 -9.242 -10.299 14.262 901 HG12 VAL 64 2HG1 VAL 64 -8.503 -9.545 15.688 902 HG13 VAL 64 3HG1 VAL 64 -7.806 -11.032 15.019 903 HG21 VAL 64 3HG2 VAL 64 -10.888 -9.629 16.546 904 HG22 VAL 64 1HG2 VAL 64 -11.527 -10.687 15.275 905 HG23 VAL 64 2HG2 VAL 64 -11.608 -11.185 16.977 906 H LYS 65 HN LYS 65 -11.965 -13.785 14.867 907 HA LYS 65 HA LYS 65 -11.207 -13.362 11.996 908 HB2 LYS 65 2HB LYS 65 -12.706 -15.682 13.281 909 HB3 LYS 65 3HB LYS 65 -12.629 -15.392 11.535 910 HG2 LYS 65 2HG LYS 65 -10.322 -15.808 11.422 911 HG3 LYS 65 3HG LYS 65 -10.127 -15.793 13.191 912 HD2 LYS 65 2HD LYS 65 -11.570 -17.829 13.315 913 HD3 LYS 65 3HD LYS 65 -11.650 -17.865 11.546 914 HE2 LYS 65 2HE LYS 65 -9.105 -18.044 13.224 915 HE3 LYS 65 3HE LYS 65 -9.941 -19.422 12.487 916 HZ1 LYS 65 3HZ LYS 65 -8.721 -17.172 11.032 917 HZ2 LYS 65 1HZ LYS 65 -9.541 -18.421 10.330 918 HZ3 LYS 65 2HZ LYS 65 -8.125 -18.707 11.124 919 HA PRO 66 HA PRO 66 -15.081 -11.124 13.128 920 HB2 PRO 66 2HB PRO 66 -14.519 -8.682 12.031 921 HB3 PRO 66 3HB PRO 66 -13.789 -9.235 13.566 922 HG2 PRO 66 2HG PRO 66 -12.574 -9.344 10.788 923 HG3 PRO 66 3HG PRO 66 -11.831 -8.721 12.295 924 HD2 PRO 66 2HD PRO 66 -11.392 -11.252 11.365 925 HD3 PRO 66 3HD PRO 66 -11.449 -10.886 13.110 926 H PHE 67 HN PHE 67 -13.546 -11.721 10.010 927 HA PHE 67 HA PHE 67 -15.787 -10.655 8.424 928 HD1 PHE 67 2HD PHE 67 -14.769 -9.306 6.056 929 HD2 PHE 67 1HD PHE 67 -11.657 -10.878 8.576 930 HE1 PHE 67 2HE PHE 67 -13.552 -7.147 5.905 931 HE2 PHE 67 1HE PHE 67 -10.405 -8.740 8.375 932 HZ PHE 67 HZ PHE 67 -11.366 -6.866 7.047 933 HB2 PHE 67 2HB PHE 67 -13.351 -12.336 7.693 934 HB3 PHE 67 3HB PHE 67 -14.481 -11.777 6.518 935 H GLN 68 HN GLN 68 -17.420 -11.973 9.715 936 HA GLN 68 HA GLN 68 -17.541 -14.809 9.120 937 HB2 GLN 68 2HB GLN 68 -18.339 -13.845 11.246 938 HB3 GLN 68 3HB GLN 68 -19.516 -12.863 10.385 939 HG2 GLN 68 2HG GLN 68 -20.769 -14.848 9.711 940 HG3 GLN 68 3HG GLN 68 -19.529 -15.894 10.423 941 HE21 GLN 68 1HE2 GLN 68 -21.529 -13.031 11.527 942 HE22 GLN 68 2HE2 GLN 68 -21.952 -13.845 13.034 943 H CYS 69 HN CYS 69 -18.513 -15.857 7.477 944 HA CYS 69 HA CYS 69 -19.655 -14.469 5.275 945 HB2 CYS 69 2HB CYS 69 -18.669 -16.714 5.023 946 HB3 CYS 69 3HB CYS 69 -19.930 -17.411 6.066 947 H LYS 70 HN LYS 70 -21.557 -13.526 5.042 948 HA LYS 70 HA LYS 70 -23.744 -13.689 6.804 949 HB2 LYS 70 2HB LYS 70 -25.001 -12.786 4.612 950 HB3 LYS 70 3HB LYS 70 -23.850 -11.820 5.505 951 HG2 LYS 70 2HG LYS 70 -23.503 -11.548 3.116 952 HG3 LYS 70 3HG LYS 70 -22.085 -12.225 3.884 953 HD2 LYS 70 2HD LYS 70 -23.057 -14.537 3.081 954 HD3 LYS 70 3HD LYS 70 -24.084 -13.572 2.039 955 HE2 LYS 70 2HE LYS 70 -22.209 -14.264 0.758 956 HE3 LYS 70 3HE LYS 70 -21.929 -12.549 1.103 957 HZ1 LYS 70 3HZ LYS 70 -19.959 -13.937 1.442 958 HZ2 LYS 70 1HZ LYS 70 -20.743 -14.825 2.591 959 HZ3 LYS 70 2HZ LYS 70 -20.422 -13.230 2.852 960 H THR 71 HN THR 71 -22.696 -16.219 4.827 961 HA THR 71 HA THR 71 -25.468 -17.257 4.335 962 HB THR 71 HB THR 71 -23.193 -18.768 3.164 963 HG1 THR 71 1HG THR 71 -22.278 -16.880 2.818 964 HG21 THR 71 3HG2 THR 71 -25.684 -17.539 1.945 965 HG22 THR 71 1HG2 THR 71 -25.559 -19.189 2.608 966 HG23 THR 71 2HG2 THR 71 -24.599 -18.725 1.188 967 H CYS 72 HN CYS 72 -22.197 -18.608 5.129 968 HA CYS 72 HA CYS 72 -23.590 -20.748 6.698 969 HB2 CYS 72 2HB CYS 72 -21.485 -22.041 6.236 970 HB3 CYS 72 3HB CYS 72 -22.358 -21.558 4.761 971 H GLN 73 HN GLN 73 -22.089 -17.889 7.318 972 HA GLN 73 HA GLN 73 -21.070 -16.966 9.154 973 HB2 GLN 73 2HB GLN 73 -21.890 -19.581 10.551 974 HB3 GLN 73 3HB GLN 73 -21.144 -18.209 11.331 975 HG2 GLN 73 2HG GLN 73 -23.019 -16.743 10.459 976 HG3 GLN 73 3HG GLN 73 -23.836 -18.224 9.944 977 HE21 GLN 73 1HE2 GLN 73 -22.192 -16.837 12.935 978 HE22 GLN 73 2HE2 GLN 73 -23.452 -17.550 13.979 979 H ARG 74 HN ARG 74 -19.630 -19.085 7.263 980 HA ARG 74 HA ARG 74 -17.318 -20.007 8.617 981 HE ARG 74 HE ARG 74 -14.641 -21.795 5.675 982 HB2 ARG 74 2HB ARG 74 -17.906 -19.147 5.783 983 HB3 ARG 74 3HB ARG 74 -16.238 -19.363 6.248 984 HG2 ARG 74 2HG ARG 74 -18.331 -21.529 6.620 985 HG3 ARG 74 3HG ARG 74 -17.274 -21.389 5.215 986 HD2 ARG 74 2HD ARG 74 -16.414 -21.915 8.092 987 HD3 ARG 74 3HD ARG 74 -16.417 -23.055 6.758 988 HH11 ARG 74 1HH1 ARG 74 -15.046 -20.904 9.071 989 HH12 ARG 74 2HH1 ARG 74 -13.636 -19.850 9.015 990 HH21 ARG 74 1HH2 ARG 74 -12.767 -20.655 5.817 991 HH22 ARG 74 2HH2 ARG 74 -12.287 -19.921 7.335 992 H LYS 75 HN LYS 75 -16.255 -18.778 10.058 993 HA LYS 75 HA LYS 75 -15.935 -15.930 9.621 994 HB2 LYS 75 2HB LYS 75 -15.399 -17.893 11.848 995 HB3 LYS 75 3HB LYS 75 -14.550 -16.348 11.890 996 HG2 LYS 75 2HG LYS 75 -16.513 -15.062 11.830 997 HG3 LYS 75 3HG LYS 75 -17.533 -16.434 11.420 998 HD2 LYS 75 2HD LYS 75 -16.054 -16.146 14.066 999 HD3 LYS 75 3HD LYS 75 -17.709 -15.598 13.799 1000 HE2 LYS 75 2HE LYS 75 -16.763 -18.483 13.526 1001 HE3 LYS 75 3HE LYS 75 -17.634 -17.800 14.906 1002 HZ1 LYS 75 3HZ LYS 75 -19.178 -18.882 13.490 1003 HZ2 LYS 75 1HZ LYS 75 -18.660 -18.075 12.154 1004 HZ3 LYS 75 2HZ LYS 75 -19.447 -17.259 13.337 1005 H PHE 76 HN PHE 76 -14.232 -14.825 8.946 1006 HA PHE 76 HA PHE 76 -11.618 -16.253 8.611 1007 HD1 PHE 76 1HD PHE 76 -11.055 -17.253 5.724 1008 HD2 PHE 76 2HD PHE 76 -14.966 -15.493 6.223 1009 HE1 PHE 76 1HE PHE 76 -12.057 -19.064 4.367 1010 HE2 PHE 76 2HE PHE 76 -15.967 -17.336 4.939 1011 HZ PHE 76 HZ PHE 76 -14.517 -19.173 4.058 1012 HB2 PHE 76 2HB PHE 76 -12.917 -14.231 6.717 1013 HB3 PHE 76 3HB PHE 76 -11.331 -14.936 6.513 1014 H SER 77 HN SER 77 -9.738 -14.770 8.502 1015 HA SER 77 HA SER 77 -10.167 -12.294 10.133 1016 HG SER 77 HG SER 77 -8.839 -13.489 12.128 1017 HB2 SER 77 2HB SER 77 -7.626 -13.887 9.567 1018 HB3 SER 77 3HB SER 77 -7.703 -12.415 10.541 1019 H ARG 78 HN ARG 78 -10.139 -13.097 6.966 1020 HA ARG 78 HA ARG 78 -8.775 -10.567 6.169 1021 HE ARG 78 HE ARG 78 -6.037 -12.715 3.236 1022 HB2 ARG 78 2HB ARG 78 -8.226 -13.377 5.223 1023 HB3 ARG 78 3HB ARG 78 -8.082 -12.056 4.059 1024 HG2 ARG 78 2HG ARG 78 -6.482 -10.893 5.431 1025 HG3 ARG 78 3HG ARG 78 -6.757 -11.967 6.800 1026 HD2 ARG 78 2HD ARG 78 -4.658 -12.489 5.869 1027 HD3 ARG 78 3HD ARG 78 -5.755 -13.845 5.615 1028 HH11 ARG 78 1HH2 ARG 78 -2.991 -13.016 4.992 1029 HH12 ARG 78 2HH2 ARG 78 -2.110 -13.216 3.473 1030 HH21 ARG 78 1HH1 ARG 78 -4.889 -13.016 1.469 1031 HH22 ARG 78 2HH1 ARG 78 -3.149 -13.282 1.509 1032 H SER 79 HN SER 79 -9.712 -9.452 4.533 1033 HA SER 79 HA SER 79 -12.501 -10.067 3.943 1034 HG SER 79 HG SER 79 -10.324 -6.803 2.873 1035 HB2 SER 79 2HB SER 79 -12.309 -7.977 2.531 1036 HB3 SER 79 3HB SER 79 -11.876 -7.749 4.234 1037 H ASP 80 HN ASP 80 -9.359 -10.196 2.234 1038 HA ASP 80 HA ASP 80 -10.421 -10.830 -0.352 1039 HB2 ASP 80 2HB ASP 80 -8.106 -11.600 -0.836 1040 HB3 ASP 80 3HB ASP 80 -8.208 -10.011 -0.054 1041 H HIS 81 HN HIS 81 -9.464 -12.874 2.430 1042 HA HIS 81 HA HIS 81 -9.935 -15.454 1.166 1043 HD1 HIS 81 1HD HIS 81 -7.475 -15.239 1.513 1044 HD2 HIS 81 2HD HIS 81 -8.192 -16.076 5.573 1045 HE1 HIS 81 1HE HIS 81 -5.297 -15.824 2.469 1046 HB2 HIS 81 2HB HIS 81 -10.062 -14.567 4.093 1047 HB3 HIS 81 3HB HIS 81 -10.300 -16.216 3.558 1048 H LEU 82 HN LEU 82 -12.018 -13.240 3.161 1049 HA LEU 82 HA LEU 82 -14.340 -14.914 3.102 1050 HG LEU 82 HG LEU 82 -16.434 -13.756 3.421 1051 HB2 LEU 82 2HB LEU 82 -14.059 -13.078 4.661 1052 HB3 LEU 82 3HB LEU 82 -14.094 -11.876 3.375 1053 HD11 LEU 82 1HD1 LEU 82 -17.561 -12.805 5.255 1054 HD12 LEU 82 2HD1 LEU 82 -16.294 -11.621 5.550 1055 HD13 LEU 82 3HD1 LEU 82 -16.003 -13.396 5.791 1056 HD21 LEU 82 3HD2 LEU 82 -16.272 -10.709 3.267 1057 HD22 LEU 82 1HD2 LEU 82 -17.729 -11.697 3.033 1058 HD23 LEU 82 2HD2 LEU 82 -16.408 -11.799 1.873 1059 H LYS 83 HN LYS 83 -13.356 -12.170 0.971 1060 HA LYS 83 HA LYS 83 -15.662 -12.259 -0.749 1061 HB2 LYS 83 2HB LYS 83 -13.984 -10.396 -0.562 1062 HB3 LYS 83 3HB LYS 83 -12.807 -11.381 -1.439 1063 HG2 LYS 83 2HG LYS 83 -14.252 -11.370 -3.433 1064 HG3 LYS 83 3HG LYS 83 -15.539 -10.547 -2.525 1065 HD2 LYS 83 2HD LYS 83 -13.992 -8.619 -2.140 1066 HD3 LYS 83 3HD LYS 83 -12.775 -9.399 -3.159 1067 HE2 LYS 83 2HE LYS 83 -15.586 -8.607 -4.056 1068 HE3 LYS 83 3HE LYS 83 -14.137 -7.626 -4.312 1069 HZ1 LYS 83 3HZ LYS 83 -14.648 -8.939 -6.239 1070 HZ2 LYS 83 1HZ LYS 83 -14.570 -10.337 -5.375 1071 HZ3 LYS 83 2HZ LYS 83 -13.208 -9.429 -5.598 1072 H THR 84 HN THR 84 -12.568 -14.032 -0.734 1073 HA THR 84 HA THR 84 -12.921 -15.324 -3.298 1074 HB THR 84 HB THR 84 -11.336 -15.963 -0.801 1075 HG1 THR 84 1HG THR 84 -10.532 -14.296 -1.705 1076 HG21 THR 84 3HG2 THR 84 -10.984 -17.453 -3.375 1077 HG22 THR 84 1HG2 THR 84 -11.556 -18.136 -1.825 1078 HG23 THR 84 2HG2 THR 84 -9.928 -17.466 -1.914 1079 H HIS 85 HN HIS 85 -13.495 -16.383 0.103 1080 HA HIS 85 HA HIS 85 -14.665 -18.907 -0.513 1081 HD1 HIS 85 1HD HIS 85 -15.998 -20.694 1.782 1082 HD2 HIS 85 2HD HIS 85 -17.121 -16.714 2.649 1083 HE1 HIS 85 1HE HIS 85 -18.454 -20.743 2.598 1084 HB2 HIS 85 2HB HIS 85 -14.000 -18.615 1.722 1085 HB3 HIS 85 3HB HIS 85 -14.715 -17.017 1.837 1086 H THR 86 HN THR 86 -16.004 -15.637 -0.325 1087 HA THR 86 HA THR 86 -18.754 -16.164 -0.282 1088 HB THR 86 HB THR 86 -17.163 -13.982 -1.659 1089 HG1 THR 86 1HG THR 86 -17.079 -14.067 0.566 1090 HG21 THR 86 3HG2 THR 86 -20.154 -13.978 -1.269 1091 HG22 THR 86 1HG2 THR 86 -19.246 -13.872 -2.813 1092 HG23 THR 86 2HG2 THR 86 -19.114 -12.567 -1.631 1093 H ARG 87 HN ARG 87 -16.455 -16.302 -3.044 1094 HA ARG 87 HA ARG 87 -18.430 -16.465 -5.120 1095 HE ARG 87 HE ARG 87 -13.435 -13.721 -5.710 1096 HB2 ARG 87 2HB ARG 87 -15.637 -17.592 -5.071 1097 HB3 ARG 87 3HB ARG 87 -16.618 -17.324 -6.510 1098 HG2 ARG 87 2HG ARG 87 -16.555 -14.912 -6.204 1099 HG3 ARG 87 3HG ARG 87 -15.783 -15.072 -4.635 1100 HD2 ARG 87 2HD ARG 87 -13.777 -16.023 -5.615 1101 HD3 ARG 87 3HD ARG 87 -14.505 -15.997 -7.223 1102 HH11 ARG 87 2HH2 ARG 87 -15.306 -14.694 -8.548 1103 HH12 ARG 87 1HH2 ARG 87 -15.085 -13.123 -9.311 1104 HH21 ARG 87 1HH1 ARG 87 -13.083 -11.840 -6.820 1105 HH22 ARG 87 2HH1 ARG 87 -13.840 -11.576 -8.376 1106 H THR 88 HN THR 88 -17.252 -18.808 -2.828 1107 HA THR 88 HA THR 88 -18.007 -21.266 -4.063 1108 HB THR 88 HB THR 88 -18.547 -20.599 -1.147 1109 HG1 THR 88 1HG THR 88 -16.638 -19.978 -1.248 1110 HG21 THR 88 3HG2 THR 88 -17.832 -22.936 -0.755 1111 HG22 THR 88 1HG2 THR 88 -17.734 -23.171 -2.515 1112 HG23 THR 88 2HG2 THR 88 -19.295 -22.815 -1.749 1113 H HIS 89 HN HIS 89 -19.961 -18.713 -2.508 1114 HA HIS 89 HA HIS 89 -22.455 -20.273 -2.950 1115 HD1 HIS 89 1HD HIS 89 -22.792 -21.182 -0.478 1116 HD2 HIS 89 2HD HIS 89 -20.931 -17.573 0.648 1117 HE1 HIS 89 1HE HIS 89 -21.819 -21.530 1.884 1118 HB2 HIS 89 2HB HIS 89 -22.065 -17.530 -1.681 1119 HB3 HIS 89 3HB HIS 89 -23.534 -18.500 -1.662 1120 H THR 90 HN THR 90 -20.767 -17.312 -4.033 1121 HA THR 90 HA THR 90 -23.073 -16.442 -5.594 1122 HB THR 90 HB THR 90 -21.817 -14.552 -6.187 1123 HG1 THR 90 1HG THR 90 -19.807 -14.174 -6.052 1124 HG21 THR 90 3HG2 THR 90 -21.209 -15.155 -3.300 1125 HG22 THR 90 1HG2 THR 90 -22.714 -14.515 -3.970 1126 HG23 THR 90 2HG2 THR 90 -21.229 -13.556 -4.080 1127 H GLY 91 HN GLY 91 -20.484 -18.597 -6.374 1128 HA2 GLY 91 2HA GLY 91 -20.249 -19.807 -8.342 1129 HA3 GLY 91 3HA GLY 91 -21.651 -18.954 -9.013 1130 H GLU 92 HN GLU 92 -19.511 -16.592 -7.951 1131 HA GLU 92 HA GLU 92 -18.846 -15.783 -10.634 1132 HB2 GLU 92 2HB GLU 92 -17.902 -14.830 -7.906 1133 HB3 GLU 92 3HB GLU 92 -17.457 -14.046 -9.434 1134 HG2 GLU 92 2HG GLU 92 -19.745 -13.454 -9.897 1135 HG3 GLU 92 3HG GLU 92 -20.335 -14.396 -8.521 1136 H LYS 93 HN LYS 93 -17.619 -17.352 -11.688 1137 HA LYS 93 HA LYS 93 -14.878 -17.835 -10.587 1138 HB2 LYS 93 2HB LYS 93 -16.665 -19.659 -12.240 1139 HB3 LYS 93 3HB LYS 93 -14.962 -19.998 -11.916 1140 HG2 LYS 93 2HG LYS 93 -15.314 -20.436 -9.652 1141 HG3 LYS 93 3HG LYS 93 -16.815 -19.512 -9.575 1142 HD2 LYS 93 2HD LYS 93 -17.332 -21.840 -9.379 1143 HD3 LYS 93 3HD LYS 93 -17.968 -21.241 -10.915 1144 HE2 LYS 93 2HE LYS 93 -16.017 -22.214 -12.104 1145 HE3 LYS 93 3HE LYS 93 -15.335 -22.759 -10.571 1146 HZ1 LYS 93 3HZ LYS 93 -16.503 -24.512 -11.685 1147 HZ2 LYS 93 1HZ LYS 93 -17.905 -23.646 -11.704 1148 HZ3 LYS 93 2HZ LYS 93 -17.270 -24.153 -10.272 1149 HA PRO 94 HA PRO 94 -14.663 -15.529 -14.554 1150 HB2 PRO 94 2HB PRO 94 -12.844 -13.610 -13.864 1151 HB3 PRO 94 3HB PRO 94 -14.537 -13.571 -13.286 1152 HG2 PRO 94 2HG PRO 94 -12.100 -14.640 -11.820 1153 HG3 PRO 94 3HG PRO 94 -13.327 -13.486 -11.214 1154 HD2 PRO 94 2HD PRO 94 -13.463 -16.155 -10.682 1155 HD3 PRO 94 3HD PRO 94 -14.938 -15.174 -10.963 1156 H PHE 95 HN PHE 95 -12.170 -17.204 -12.713 1157 HA PHE 95 HA PHE 95 -10.051 -16.720 -14.713 1158 HD1 PHE 95 2HD PHE 95 -7.847 -15.853 -13.350 1159 HD2 PHE 95 1HD PHE 95 -10.869 -17.190 -10.597 1160 HE1 PHE 95 2HE PHE 95 -7.421 -13.866 -11.922 1161 HE2 PHE 95 1HE PHE 95 -10.438 -15.205 -9.159 1162 HZ PHE 95 HZ PHE 95 -8.733 -13.539 -9.827 1163 HB2 PHE 95 2HB PHE 95 -10.131 -18.637 -12.339 1164 HB3 PHE 95 3HB PHE 95 -8.721 -18.221 -13.308 1165 H SER 96 HN SER 96 -11.251 -17.523 -16.592 1166 HA SER 96 HA SER 96 -11.792 -20.401 -16.809 1167 HG SER 96 HG SER 96 -11.359 -20.249 -19.869 1168 HB2 SER 96 2HB SER 96 -13.104 -18.769 -18.114 1169 HB3 SER 96 3HB SER 96 -11.634 -18.177 -18.889 1170 H CYS 97 HN CYS 97 -10.615 -21.947 -17.877 1171 HA CYS 97 HA CYS 97 -7.778 -21.504 -18.309 1172 HB2 CYS 97 2HB CYS 97 -8.894 -23.726 -17.705 1173 HB3 CYS 97 3HB CYS 97 -9.485 -23.782 -19.364 1174 H ARG 98 HN ARG 98 -6.716 -21.918 -20.407 1175 HA ARG 98 HA ARG 98 -8.255 -20.701 -22.677 1176 HE ARG 98 HE ARG 98 -5.174 -19.721 -19.066 1177 HB2 ARG 98 2HB ARG 98 -5.360 -20.124 -21.871 1178 HB3 ARG 98 3HB ARG 98 -6.159 -19.529 -23.309 1179 HG2 ARG 98 2HG ARG 98 -6.183 -17.700 -21.928 1180 HG3 ARG 98 3HG ARG 98 -7.824 -18.327 -21.819 1181 HD2 ARG 98 2HD ARG 98 -6.994 -17.560 -19.634 1182 HD3 ARG 98 3HD ARG 98 -7.341 -19.273 -19.621 1183 HH11 ARG 98 2HH1 ARG 98 -5.117 -16.450 -20.349 1184 HH12 ARG 98 1HH1 ARG 98 -3.465 -16.209 -19.807 1185 HH21 ARG 98 2HH2 ARG 98 -3.220 -19.371 -18.422 1186 HH22 ARG 98 1HH2 ARG 98 -2.383 -17.850 -18.740 1187 H TRP 99 HN TRP 99 -6.938 -23.495 -21.641 1188 HA TRP 99 HA TRP 99 -5.034 -24.195 -23.659 1189 HD1 TRP 99 1HD TRP 99 -4.839 -23.822 -20.470 1190 HE1 TRP 99 1HE TRP 99 -2.511 -24.345 -19.554 1191 HE3 TRP 99 3HE TRP 99 -3.968 -28.196 -22.971 1192 HZ2 TRP 99 2HZ TRP 99 -0.480 -26.363 -19.922 1193 HZ3 TRP 99 3HZ TRP 99 -1.815 -29.399 -22.673 1194 HH2 TRP 99 2HH TRP 99 -0.065 -28.491 -21.165 1195 HB2 TRP 99 2HB TRP 99 -6.731 -25.714 -21.669 1196 HB3 TRP 99 3HB TRP 99 -5.909 -26.602 -22.938 1197 HA PRO 100 HA PRO 100 -7.498 -24.786 -27.207 1198 HB2 PRO 100 2HB PRO 100 -6.023 -26.621 -28.665 1199 HB3 PRO 100 3HB PRO 100 -5.456 -24.977 -28.289 1200 HG2 PRO 100 2HG PRO 100 -4.829 -27.528 -26.766 1201 HG3 PRO 100 3HG PRO 100 -3.674 -26.316 -27.413 1202 HD2 PRO 100 2HD PRO 100 -4.481 -26.242 -24.831 1203 HD3 PRO 100 3HD PRO 100 -4.285 -24.723 -25.764 1204 H SER 101 HN SER 101 -8.091 -26.671 -24.814 1205 HA SER 101 HA SER 101 -10.086 -28.255 -26.190 1206 HG SER 101 HG SER 101 -8.206 -29.018 -27.341 1207 HB2 SER 101 2HB SER 101 -7.730 -29.695 -24.889 1208 HB3 SER 101 3HB SER 101 -9.280 -30.484 -25.252 1209 H CYS 102 HN CYS 102 -9.726 -26.176 -24.023 1210 HA CYS 102 HA CYS 102 -11.265 -27.593 -21.901 1211 HB2 CYS 102 2HB CYS 102 -8.895 -27.458 -21.177 1212 HB3 CYS 102 3HB CYS 102 -8.935 -25.693 -21.392 1213 H GLN 103 HN GLN 103 -12.609 -26.258 -20.642 1214 HA GLN 103 HA GLN 103 -12.754 -23.390 -21.218 1215 HB2 GLN 103 2HB GLN 103 -15.061 -25.287 -21.849 1216 HB3 GLN 103 3HB GLN 103 -15.342 -23.588 -21.492 1217 HG2 GLN 103 2HG GLN 103 -13.684 -24.576 -23.826 1218 HG3 GLN 103 3HG GLN 103 -15.336 -23.984 -23.876 1219 HE21 GLN 103 1HE2 GLN 103 -11.954 -23.005 -23.465 1220 HE22 GLN 103 2HE2 GLN 103 -12.316 -21.263 -23.625 1221 H LYS 104 HN LYS 104 -11.927 -25.062 -18.966 1222 HA LYS 104 HA LYS 104 -14.158 -25.100 -17.035 1223 HB2 LYS 104 2HB LYS 104 -11.178 -25.696 -16.762 1224 HB3 LYS 104 3HB LYS 104 -12.360 -25.902 -15.463 1225 HG2 LYS 104 2HG LYS 104 -13.604 -27.567 -16.808 1226 HG3 LYS 104 3HG LYS 104 -12.488 -27.343 -18.150 1227 HD2 LYS 104 2HD LYS 104 -10.663 -27.948 -16.270 1228 HD3 LYS 104 3HD LYS 104 -12.056 -28.713 -15.506 1229 HE2 LYS 104 2HE LYS 104 -11.080 -30.435 -16.811 1230 HE3 LYS 104 3HE LYS 104 -12.452 -29.874 -17.782 1231 HZ1 LYS 104 3HZ LYS 104 -10.538 -30.054 -19.174 1232 HZ2 LYS 104 1HZ LYS 104 -9.610 -29.139 -18.159 1233 HZ3 LYS 104 2HZ LYS 104 -10.817 -28.439 -18.969 1234 H LYS 105 HN LYS 105 -14.397 -23.776 -15.257 1235 HA LYS 105 HA LYS 105 -12.755 -21.273 -15.314 1236 HB2 LYS 105 2HB LYS 105 -15.724 -21.765 -14.947 1237 HB3 LYS 105 3HB LYS 105 -14.976 -20.378 -14.201 1238 HG2 LYS 105 2HG LYS 105 -16.021 -19.740 -16.270 1239 HG3 LYS 105 3HG LYS 105 -14.281 -19.469 -16.342 1240 HD2 LYS 105 2HD LYS 105 -13.962 -21.375 -17.775 1241 HD3 LYS 105 3HD LYS 105 -15.616 -21.954 -17.498 1242 HE2 LYS 105 2HE LYS 105 -16.555 -20.193 -18.798 1243 HE3 LYS 105 3HE LYS 105 -15.034 -19.277 -18.806 1244 HZ1 LYS 105 3HZ LYS 105 -15.297 -21.935 -20.026 1245 HZ2 LYS 105 1HZ LYS 105 -14.036 -20.883 -20.151 1246 HZ3 LYS 105 2HZ LYS 105 -15.472 -20.526 -20.882 1247 H PHE 106 HN PHE 106 -12.005 -20.437 -13.426 1248 HA PHE 106 HA PHE 106 -12.713 -21.897 -10.892 1249 HD1 PHE 106 1HD PHE 106 -10.908 -23.990 -10.083 1250 HD2 PHE 106 2HD PHE 106 -9.647 -22.011 -13.705 1251 HE1 PHE 106 1HE PHE 106 -10.618 -26.188 -11.192 1252 HE2 PHE 106 2HE PHE 106 -9.400 -24.201 -14.822 1253 HZ PHE 106 HZ PHE 106 -9.906 -26.291 -13.579 1254 HB2 PHE 106 2HB PHE 106 -9.992 -20.732 -11.660 1255 HB3 PHE 106 3HB PHE 106 -10.397 -21.534 -10.143 1256 H ALA 107 HN ALA 107 -12.392 -20.604 -8.901 1257 HA ALA 107 HA ALA 107 -13.257 -17.811 -9.411 1258 HB1 ALA 107 1HB ALA 107 -13.534 -19.752 -7.077 1259 HB2 ALA 107 2HB ALA 107 -13.830 -18.032 -6.874 1260 HB3 ALA 107 3HB ALA 107 -14.811 -18.946 -8.019 1261 H ARG 108 HN ARG 108 -10.401 -19.437 -8.856 1262 HA ARG 108 HA ARG 108 -9.220 -17.014 -7.601 1263 HE ARG 108 HE ARG 108 -7.273 -19.980 -4.836 1264 HB2 ARG 108 2HB ARG 108 -8.634 -19.900 -6.908 1265 HB3 ARG 108 3HB ARG 108 -7.604 -18.539 -6.445 1266 HG2 ARG 108 2HG ARG 108 -9.164 -17.673 -4.938 1267 HG3 ARG 108 3HG ARG 108 -10.533 -18.518 -5.671 1268 HD2 ARG 108 2HD ARG 108 -9.909 -19.496 -3.514 1269 HD3 ARG 108 3HD ARG 108 -9.812 -20.650 -4.842 1270 HH11 ARG 108 1HH2 ARG 108 -9.191 -20.282 -1.919 1271 HH12 ARG 108 2HH2 ARG 108 -7.838 -20.948 -1.018 1272 HH21 ARG 108 1HH1 ARG 108 -5.667 -20.704 -3.735 1273 HH22 ARG 108 2HH1 ARG 108 -5.827 -21.219 -2.046 1274 H SER 109 HN SER 109 -7.352 -16.312 -8.482 1275 HA SER 109 HA SER 109 -6.605 -17.089 -11.083 1276 HG SER 109 HG SER 109 -5.554 -14.531 -8.435 1277 HB2 SER 109 2HB SER 109 -4.445 -15.801 -10.464 1278 HB3 SER 109 3HB SER 109 -5.973 -14.925 -10.397 1279 H ASP 110 HN ASP 110 -5.189 -17.892 -7.930 1280 HA ASP 110 HA ASP 110 -3.058 -19.537 -8.957 1281 HB2 ASP 110 2HB ASP 110 -2.933 -20.451 -6.621 1282 HB3 ASP 110 3HB ASP 110 -2.807 -18.725 -6.770 1283 H GLU 111 HN GLU 111 -6.460 -20.324 -8.112 1284 HA GLU 111 HA GLU 111 -6.221 -23.187 -8.268 1285 HB2 GLU 111 2HB GLU 111 -8.558 -21.248 -8.609 1286 HB3 GLU 111 3HB GLU 111 -8.712 -22.937 -9.062 1287 HG2 GLU 111 2HG GLU 111 -8.033 -23.698 -6.856 1288 HG3 GLU 111 3HG GLU 111 -7.936 -22.015 -6.304 1289 H LEU 112 HN LEU 112 -6.833 -20.620 -10.721 1290 HA LEU 112 HA LEU 112 -7.024 -22.445 -12.960 1291 HG LEU 112 HG LEU 112 -5.413 -20.539 -14.952 1292 HB2 LEU 112 2HB LEU 112 -7.816 -20.168 -13.117 1293 HB3 LEU 112 3HB LEU 112 -6.207 -19.502 -12.832 1294 HD11 LEU 112 1HD1 LEU 112 -8.337 -21.254 -15.440 1295 HD12 LEU 112 2HD1 LEU 112 -7.052 -22.443 -15.083 1296 HD13 LEU 112 3HD1 LEU 112 -6.951 -21.469 -16.517 1297 HD21 LEU 112 3HD2 LEU 112 -6.515 -19.045 -16.481 1298 HD22 LEU 112 1HD2 LEU 112 -6.270 -18.215 -14.932 1299 HD23 LEU 112 2HD2 LEU 112 -7.882 -18.834 -15.382 1300 H VAL 113 HN VAL 113 -4.233 -20.521 -11.627 1301 HA VAL 113 HA VAL 113 -2.216 -21.469 -13.329 1302 HB VAL 113 HB VAL 113 -2.037 -20.914 -10.333 1303 HG11 VAL 113 1HG1 VAL 113 -0.042 -22.152 -10.939 1304 HG12 VAL 113 2HG1 VAL 113 0.217 -21.116 -12.360 1305 HG13 VAL 113 3HG1 VAL 113 0.379 -20.460 -10.715 1306 HG21 VAL 113 3HG2 VAL 113 -1.358 -18.690 -10.840 1307 HG22 VAL 113 1HG2 VAL 113 -1.150 -19.055 -12.563 1308 HG23 VAL 113 2HG2 VAL 113 -2.755 -18.963 -11.888 1309 H ARG 114 HN ARG 114 -3.584 -23.043 -10.444 1310 HA ARG 114 HA ARG 114 -1.762 -25.313 -10.428 1311 HE ARG 114 HE ARG 114 -2.206 -26.031 -6.770 1312 HB2 ARG 114 2HB ARG 114 -3.052 -24.705 -8.443 1313 HB3 ARG 114 3HB ARG 114 -4.581 -24.982 -9.285 1314 HG2 ARG 114 2HG ARG 114 -4.128 -27.354 -9.523 1315 HG3 ARG 114 3HG ARG 114 -2.463 -27.162 -8.952 1316 HD2 ARG 114 2HD ARG 114 -4.945 -26.607 -7.277 1317 HD3 ARG 114 3HD ARG 114 -4.048 -28.139 -7.281 1318 HH11 ARG 114 2HH1 ARG 114 -4.870 -27.673 -5.156 1319 HH12 ARG 114 1HH1 ARG 114 -4.226 -27.391 -3.570 1320 HH21 ARG 114 2HH2 ARG 114 -1.446 -25.618 -4.663 1321 HH22 ARG 114 1HH2 ARG 114 -2.460 -26.153 -3.314 1322 H HIS 115 HN HIS 115 -5.132 -24.828 -11.660 1323 HA HIS 115 HA HIS 115 -5.532 -27.320 -12.808 1324 HD1 HIS 115 1HD HIS 115 -7.682 -28.244 -14.073 1325 HD2 HIS 115 2HD HIS 115 -7.013 -24.793 -16.396 1326 HE1 HIS 115 1HE HIS 115 -8.420 -28.784 -16.468 1327 HB2 HIS 115 2HB HIS 115 -7.283 -25.648 -12.763 1328 HB3 HIS 115 3HB HIS 115 -6.396 -24.583 -13.846 1329 H HIS 116 HN HIS 116 -3.992 -24.469 -14.406 1330 HA HIS 116 HA HIS 116 -3.352 -25.734 -16.860 1331 HD1 HIS 116 1HD HIS 116 -4.912 -24.121 -17.750 1332 HD2 HIS 116 2HD HIS 116 -2.213 -21.109 -16.497 1333 HE1 HIS 116 1HE HIS 116 -5.769 -21.967 -18.644 1334 HB2 HIS 116 2HB HIS 116 -1.946 -23.546 -15.290 1335 HB3 HIS 116 3HB HIS 116 -1.446 -24.052 -16.895 1336 H ASN 117 HN ASN 117 -1.668 -25.801 -13.685 1337 HA ASN 117 HA ASN 117 0.767 -27.034 -14.710 1338 HB2 ASN 117 2HB ASN 117 0.321 -25.688 -12.491 1339 HB3 ASN 117 3HB ASN 117 -0.188 -27.236 -11.829 1340 HD21 ASN 117 1HD2 ASN 117 1.805 -28.956 -13.102 1341 HD22 ASN 117 2HD2 ASN 117 3.356 -28.405 -12.416 1342 H MET 118 HN MET 118 -2.424 -28.193 -13.993 1343 HA MET 118 HA MET 118 -1.441 -31.022 -13.850 1344 HB2 MET 118 2HB MET 118 -4.132 -29.800 -13.090 1345 HB3 MET 118 3HB MET 118 -3.728 -31.519 -12.985 1346 HG2 MET 118 2HG MET 118 -1.995 -31.058 -11.320 1347 HG3 MET 118 3HG MET 118 -2.264 -29.325 -11.472 1348 HE1 MET 118 3HE MET 118 -5.153 -32.285 -9.389 1349 HE2 MET 118 1HE MET 118 -4.935 -32.332 -11.150 1350 HE3 MET 118 2HE MET 118 -3.571 -32.713 -10.070 1351 H HIS 119 HN HIS 119 -2.344 -28.829 -16.147 1352 HA HIS 119 HA HIS 119 -4.522 -30.171 -17.452 1353 HD1 HIS 119 1HD HIS 119 -4.872 -30.055 -20.311 1354 HD2 HIS 119 2HD HIS 119 -5.664 -26.537 -18.167 1355 HE1 HIS 119 1HE HIS 119 -7.308 -29.332 -20.892 1356 HB2 HIS 119 2HB HIS 119 -3.496 -27.701 -17.608 1357 HB3 HIS 119 3HB HIS 119 -2.678 -28.387 -19.013 Start of MODEL 16 1 H5 DC 124 5H C 124 -3.992 -31.336 -5.023 2 H6 DC 124 6H C 124 -5.903 -31.029 -6.526 3 H5' DC 124 H5' C 124 -8.834 -32.404 -9.832 4 H5'' DC 124 H5" C 124 -7.465 -32.319 -8.691 5 H4' DC 124 H4' C 124 -10.399 -32.500 -7.825 6 H3' DC 124 H3' C 124 -9.190 -30.284 -9.034 7 H2' DC 124 H2' C 124 -7.442 -30.077 -7.485 8 H2'' DC 124 H2" C 124 -8.636 -29.042 -6.671 9 H1' DC 124 H1' C 124 -9.442 -30.824 -5.282 10 H41 DC 124 1H4 C 124 -4.517 -32.303 -1.509 11 H42 DC 124 2H4 C 124 -3.363 -32.033 -2.801 12 H8 DG 125 8H G 125 -9.180 -27.051 -5.703 13 H1 DG 125 1H G 125 -6.389 -29.024 -0.260 14 H5' DG 125 H5' G 125 -12.891 -29.672 -6.317 15 H5'' DG 125 H5" G 125 -14.019 -28.383 -6.806 16 H4' DG 125 H4' G 125 -13.789 -28.480 -4.358 17 H3' DG 125 H3' G 125 -13.255 -26.027 -5.780 18 H2' DG 125 H2' G 125 -11.069 -25.918 -5.155 19 H2'' DG 125 H2" G 125 -11.681 -25.327 -3.597 20 H1' DG 125 H1' G 125 -11.529 -27.505 -2.596 21 H21 DG 125 1H2 G 125 -7.885 -29.255 1.289 22 H22 DG 125 2H2 G 125 -9.590 -28.961 0.985 23 H5 DC 126 5H C 126 -8.033 -24.031 -4.323 24 H6 DC 126 6H C 126 -9.989 -23.499 -2.946 25 H5' DC 126 H5' C 126 -13.530 -26.164 -1.161 26 H5'' DC 126 H5" C 126 -14.562 -24.902 -0.466 27 H4' DC 126 H4' C 126 -12.611 -25.186 0.950 28 H3' DC 126 H3' C 126 -13.250 -22.687 -0.231 29 H2' DC 126 H2' C 126 -11.391 -22.746 -1.671 30 H2'' DC 126 H2" C 126 -10.622 -21.906 -0.287 31 H1' DC 126 H1' C 126 -10.016 -24.093 0.748 32 H41 DC 126 1H4 C 126 -4.996 -25.459 -2.815 33 H42 DC 126 2H4 C 126 -5.796 -24.943 -4.285 34 H8 DG 127 8H G 127 -9.667 -21.858 1.638 35 H1 DG 127 1H G 127 -3.412 -22.937 0.704 36 H5' DG 127 H5' G 127 -12.130 -23.636 3.939 37 H5'' DG 127 H5" G 127 -12.590 -22.615 5.313 38 H4' DG 127 H4' G 127 -10.483 -23.773 5.809 39 H3' DG 127 H3' G 127 -10.673 -20.916 5.755 40 H2' DG 127 H2' G 127 -9.144 -20.565 4.139 41 H2'' DG 127 H2" G 127 -7.911 -20.908 5.381 42 H1' DG 127 H1' G 127 -7.680 -23.155 4.694 43 H21 DG 127 1H2 G 127 -2.462 -23.380 2.607 44 H22 DG 127 2H2 G 127 -3.324 -23.242 4.129 45 H8 DG 128 8H G 128 -7.485 -18.738 4.245 46 H1 DG 128 1H G 128 -2.690 -19.780 0.059 47 H5' DG 128 H5' G 128 -6.811 -21.914 7.485 48 H5'' DG 128 H5" G 128 -6.692 -21.164 9.085 49 H4' DG 128 H4' G 128 -4.585 -20.775 8.081 50 H3' DG 128 H3' G 128 -6.268 -18.514 8.635 51 H2' DG 128 H2' G 128 -6.744 -18.130 6.359 52 H2'' DG 128 H2" G 128 -5.249 -17.152 6.480 53 H1' DG 128 H1' G 128 -3.881 -19.051 5.778 54 H21 DG 128 1H2 G 128 -0.818 -19.906 1.084 55 H22 DG 128 2H2 G 128 -0.716 -19.880 2.833 56 H8 DG 129 8H G 129 -3.451 -16.125 5.541 57 H1 DG 129 1H G 129 -0.968 -16.633 -0.350 58 H5' DG 129 H5' G 129 -1.632 -18.379 8.809 59 H5'' DG 129 H5" G 129 -0.960 -17.247 9.971 60 H4' DG 129 H4' G 129 0.606 -17.422 8.107 61 H3' DG 129 H3' G 129 -0.736 -14.919 8.654 62 H2' DG 129 H2' G 129 -1.866 -14.845 6.689 63 H2'' DG 129 H2" G 129 -0.372 -14.134 6.054 64 H1' DG 129 H1' G 129 0.432 -16.273 5.319 65 H21 DG 129 1H2 G 129 1.210 -16.562 -0.237 66 H22 DG 129 2H2 G 129 2.063 -16.469 1.294 67 H8 DG 130 8H G 130 0.532 -13.337 4.231 68 H1 DG 130 1H G 130 -0.674 -12.824 -2.029 69 H5' DG 130 H5' G 130 2.887 -15.539 5.461 70 H5'' DG 130 H5" G 130 3.914 -14.716 6.625 71 H4' DG 130 H4' G 130 5.032 -14.443 4.617 72 H3' DG 130 H3' G 130 4.170 -12.082 5.822 73 H2' DG 130 H2' G 130 2.347 -11.723 4.446 74 H2'' DG 130 H2" G 130 3.532 -10.944 3.404 75 H1' DG 130 H1' G 130 3.662 -12.788 1.934 76 H21 DG 130 1H2 G 130 1.143 -12.399 -3.149 77 H22 DG 130 2H2 G 130 2.682 -12.159 -2.333 78 H8 DG 131 8H G 131 2.606 -9.450 2.395 79 H1 DG 131 1H G 131 -1.875 -9.353 -2.180 80 H5' DG 131 H5' G 131 5.914 -11.713 1.653 81 H5'' DG 131 H5" G 131 7.358 -10.699 1.785 82 H4' DG 131 H4' G 131 6.609 -10.320 -0.396 83 H3' DG 131 H3' G 131 6.625 -8.171 1.392 84 H2' DG 131 H2' G 131 4.309 -8.130 1.703 85 H2'' DG 131 H2" G 131 4.395 -7.026 0.323 86 H1' DG 131 H1' G 131 3.859 -8.781 -1.251 87 H21 DG 131 1H2 G 131 -0.997 -9.136 -4.137 88 H22 DG 131 2H2 G 131 0.737 -8.949 -4.359 89 H5 DC 132 5H C 132 1.274 -6.477 1.631 90 H6 DC 132 6H C 132 2.773 -5.822 -0.182 91 H5' DC 132 H5' C 132 5.188 -7.630 -2.837 92 H5'' DC 132 H5" C 132 6.255 -6.386 -3.511 93 H4' DC 132 H4' C 132 4.209 -6.101 -4.621 94 H3' DC 132 H3' C 132 5.198 -4.061 -2.933 95 H2' DC 132 H2' C 132 3.518 -4.201 -1.392 96 H2'' DC 132 H2" C 132 2.674 -3.127 -2.522 97 H1' DC 132 H1' C 132 1.550 -4.988 -3.625 98 H41 DC 132 1H4 C 132 -2.350 -6.716 1.074 99 H42 DC 132 2H4 C 132 -1.021 -6.879 2.225 100 H8 DG 133 8H G 133 1.252 -1.792 -3.061 101 H1 DG 133 1H G 133 -4.913 -2.606 -1.555 102 H5' DG 133 H5' G 133 2.759 -3.261 -6.737 103 H5'' DG 133 H5" G 133 3.363 -1.776 -7.514 104 H4' DG 133 H4' G 133 0.995 -2.057 -8.049 105 H3' DG 133 H3' G 133 2.116 0.271 -6.841 106 H2' DG 133 H2' G 133 1.183 -0.071 -4.729 107 H2'' DG 133 H2" G 133 -0.206 0.765 -5.430 108 H1' DG 133 H1' G 133 -1.292 -1.315 -5.999 109 H21 DG 133 1H2 G 133 -6.187 -2.338 -3.314 110 H22 DG 133 2H2 G 133 -5.523 -1.907 -4.873 111 H5' DT 134 H5' T 134 -2.392 -0.086 -7.333 112 H5'' DT 134 H5" T 134 -2.858 1.090 -8.560 113 H4' DT 134 H4' T 134 -4.711 1.131 -7.193 114 H3' DT 134 H3' T 134 -2.961 3.415 -7.217 115 H2' DT 134 H2' T 134 -2.410 3.325 -5.005 116 H2'' DT 134 H2" T 134 -3.961 4.080 -4.792 117 H1' DT 134 H1' T 134 -5.036 2.047 -4.325 118 H3 DT 134 3H T 134 -4.173 0.513 -0.216 119 H71 DT 134 1H7 T 134 0.582 2.146 -2.342 120 H72 DT 134 2H7 T 134 0.373 1.874 -0.593 121 H73 DT 134 3H7 T 134 0.576 0.486 -1.693 122 H6 DT 134 6H T 134 -1.328 2.160 -3.748 123 H5 DC 135 5H C 135 -3.595 5.088 -2.774 124 H6 DC 135 6H C 135 -5.458 5.440 -4.331 125 H5' DC 135 H5' C 135 -7.461 3.514 -7.433 126 H5'' DC 135 H5" C 135 -8.372 4.791 -8.238 127 H4' DC 135 H4' C 135 -9.642 4.145 -6.329 128 H3' DC 135 H3' C 135 -8.718 6.787 -6.624 129 H2' DC 135 H2' C 135 -7.042 6.606 -4.987 130 H2'' DC 135 H2" C 135 -8.339 7.175 -3.928 131 H1' DC 135 H1' C 135 -9.026 4.909 -3.370 132 H41 DC 135 1H4 C 135 -4.160 3.400 0.464 133 H42 DC 135 2H4 C 135 -3.004 4.125 -0.616 134 H5' DT 136 H5' T 136 -10.966 5.275 -2.689 135 H5'' DT 136 H5" T 136 -12.456 6.148 -3.037 136 H4' DT 136 H4' T 136 -12.525 5.880 -0.672 137 H3' DT 136 H3' T 136 -12.328 8.497 -1.759 138 H2' DT 136 H2' T 136 -10.201 8.941 -1.264 139 H2'' DT 136 H2" T 136 -10.760 9.418 0.306 140 H1' DT 136 H1' T 136 -10.276 7.411 1.363 141 H3 DT 136 3H T 136 -5.878 6.373 1.786 142 H71 DT 136 1H7 T 136 -5.263 9.377 -1.926 143 H72 DT 136 2H7 T 136 -5.071 7.788 -2.716 144 H73 DT 136 3H7 T 136 -6.513 8.782 -3.044 145 H6 DT 136 6H T 136 -8.474 8.260 -1.759 146 H8 DG 137 8H G 137 -9.637 10.535 1.708 147 H1 DG 137 1H G 137 -3.811 9.328 4.009 148 H5' DG 137 H5' G 137 -12.241 7.452 2.516 149 H5'' DG 137 H5" G 137 -13.678 8.217 3.200 150 H4' DG 137 H4' G 137 -12.275 7.902 5.068 151 H3' DG 137 H3' G 137 -13.023 10.458 4.243 152 H2' DG 137 H2' G 137 -11.021 11.063 3.324 153 H2'' DG 137 H2" G 137 -10.679 11.626 4.949 154 H1' DG 137 H1' G 137 -9.415 9.655 5.501 155 H21 DG 137 1H2 G 137 -3.916 8.766 6.064 156 H22 DG 137 2H2 G 137 -5.446 8.676 6.922 157 H5 DC 138 5H C 138 -8.611 13.091 4.028 158 H6 DC 138 6H C 138 -9.202 12.328 6.275 159 H5' DC 138 H5' C 138 -10.333 9.290 7.548 160 H5'' DC 138 H5" C 138 -11.307 9.767 8.941 161 H4' DC 138 H4' C 138 -9.153 9.540 9.818 162 H3' DC 138 H3' C 138 -10.392 12.023 9.897 163 H2' DC 138 H2' C 138 -9.295 13.039 8.194 164 H2'' DC 138 H2" C 138 -8.134 13.456 9.422 165 H1' DC 138 H1' C 138 -6.632 11.706 8.903 166 H41 DC 138 1H4 C 138 -5.111 13.152 2.931 167 H42 DC 138 2H4 C 138 -6.797 13.251 2.466 168 H8 DG 139 8H G 139 -6.434 14.643 9.691 169 H1 DG 139 1H G 139 -2.169 15.792 5.041 170 H5' DG 139 H5' G 139 -6.201 11.080 11.110 171 H5'' DG 139 H5" G 139 -6.293 11.354 12.850 172 H4' DG 139 H4' G 139 -4.005 11.411 12.302 173 H3' DG 139 H3' G 139 -5.137 13.605 13.570 174 H2' DG 139 H2' G 139 -5.368 14.910 11.667 175 H2'' DG 139 H2" G 139 -3.754 15.452 12.108 176 H1' DG 139 H1' G 139 -2.693 13.995 10.556 177 H21 DG 139 1H2 G 139 -0.151 15.349 5.721 178 H22 DG 139 2H2 G 139 0.169 14.858 7.380 179 H5 DC 140 5H C 140 -4.192 17.547 10.486 180 H6 DC 140 6H C 140 -2.154 16.748 11.580 181 H5' DC 140 H5' C 140 -0.787 13.407 12.111 182 H5'' DC 140 H5" C 140 0.199 13.644 13.561 183 H4' DC 140 H4' C 140 1.570 14.178 11.681 184 H3' DC 140 H3' C 140 1.183 16.019 13.730 185 H2' DC 140 H2' C 140 -0.337 17.410 12.599 186 H2'' DC 140 H2" C 140 1.177 18.188 12.062 187 H1' DC 140 H1' C 140 1.222 17.001 9.999 188 H41 DC 140 1H4 C 140 -4.080 19.022 7.148 189 H42 DC 140 2H4 C 140 -5.071 18.494 8.492 190 H8 DG 141 8H G 141 -3.497 21.608 0.877 191 H1 DG 141 1H G 141 -1.655 18.741 6.314 192 H5' DG 141 H5' G 141 -0.801 24.588 -0.748 193 H5'' DG 141 H5" G 141 -0.996 23.886 -2.368 194 H4' DG 141 H4' G 141 0.852 22.865 -1.012 195 H3' DG 141 H3' G 141 -0.952 21.401 -2.559 196 H2' DG 141 H2' G 141 -2.229 20.620 -0.811 197 H2'' DG 141 H2" G 141 -1.035 19.313 -0.799 198 H1' DG 141 H1' G 141 0.212 20.328 0.983 199 H21 DG 141 1H2 G 141 0.475 18.260 6.271 200 H22 DG 141 2H2 G 141 1.443 18.504 4.823 201 H5 DC 142 5H C 142 -2.632 17.682 0.476 202 H6 DC 142 6H C 142 -0.276 17.257 0.023 203 H5' DC 142 H5' C 142 2.080 19.677 0.362 204 H5'' DC 142 H5" C 142 3.259 19.252 -0.867 205 H4' DC 142 H4' C 142 3.980 18.055 0.907 206 H3' DC 142 H3' C 142 3.115 16.603 -1.299 207 H2' DC 142 H2' C 142 1.103 15.904 -0.494 208 H2'' DC 142 H2" C 142 2.003 14.617 0.201 209 H1' DC 142 H1' C 142 1.990 15.533 2.400 210 H41 DC 142 1H4 C 142 -4.141 16.786 3.669 211 H42 DC 142 2H4 C 142 -4.349 17.554 2.112 212 H8 DG 143 8H G 143 1.547 13.059 1.303 213 H1 DG 143 1H G 143 -3.753 12.523 4.889 214 H5' DG 143 H5' G 143 4.172 15.336 3.284 215 H5'' DG 143 H5" G 143 5.705 14.536 2.872 216 H4' DG 143 H4' G 143 4.977 13.507 4.870 217 H3' DG 143 H3' G 143 5.372 11.883 2.639 218 H2' DG 143 H2' G 143 3.146 11.782 1.970 219 H2'' DG 143 H2" G 143 3.077 10.382 2.992 220 H1' DG 143 H1' G 143 2.112 11.570 4.836 221 H21 DG 143 1H2 G 143 -3.285 11.795 6.861 222 H22 DG 143 2H2 G 143 -1.636 11.429 7.345 223 H5 DC 144 5H C 144 0.758 9.424 1.975 224 H6 DC 144 6H C 144 1.756 8.673 4.081 225 H5' DC 144 H5' C 144 3.111 10.912 6.400 226 H5'' DC 144 H5" C 144 4.345 9.871 7.070 227 H4' DC 144 H4' C 144 2.471 9.501 8.376 228 H3' DC 144 H3' C 144 3.669 7.356 6.990 229 H2' DC 144 H2' C 144 2.073 7.050 5.407 230 H2'' DC 144 H2" C 144 1.235 6.140 6.638 231 H1' DC 144 H1' C 144 -0.286 7.851 7.110 232 H41 DC 144 1H4 C 144 -2.883 9.804 1.645 233 H42 DC 144 2H4 C 144 -1.312 10.049 0.909 234 H8 DA 145 8H A 145 -0.242 4.934 5.975 235 H2 DA 145 2H A 145 -6.320 6.134 4.409 236 H5' DA 145 H5' A 145 -0.082 7.315 9.688 237 H5'' DA 145 H5" A 145 0.064 6.024 10.905 238 H4' DA 145 H4' A 145 -2.300 6.299 10.356 239 H3' DA 145 H3' A 145 -0.956 3.792 10.145 240 H2' DA 145 H2' A 145 -0.920 3.818 7.788 241 H2'' DA 145 H2" A 145 -2.507 3.079 7.982 242 H1' DA 145 H1' A 145 -3.645 5.218 7.835 243 H61 DA 145 2H6 A 145 -1.950 5.984 1.568 244 H62 DA 145 1H6 A 145 -3.539 6.376 0.954 245 H8 DG 146 8H G 146 -3.819 1.689 7.275 246 H1 DG 146 1H G 146 -5.708 3.320 1.383 247 H5' DG 146 H5' G 146 -5.261 4.647 9.947 248 H5'' DG 146 H5" G 146 -6.457 4.411 11.189 249 H4' DG 146 H4' G 146 -7.829 3.888 9.557 250 H3' DG 146 H3' G 146 -6.776 1.364 10.341 251 H2' DG 146 H2' G 146 -5.598 0.962 8.401 252 H2'' DG 146 H2" G 146 -7.178 0.478 7.750 253 H1' DG 146 H1' G 146 -7.599 2.555 6.794 254 H21 DG 146 1H2 G 146 -7.822 3.659 1.372 255 H22 DG 146 2H2 G 146 -8.766 3.705 2.838 256 H8 DA 147 8H A 147 -6.912 -1.321 6.392 257 H2 DA 147 2H A 147 -6.466 0.330 0.229 258 H5' DA 147 H5' A 147 -10.148 1.799 7.496 259 H5'' DA 147 H5" A 147 -11.513 0.715 7.825 260 H4' DA 147 H4' A 147 -11.257 1.076 5.418 261 H3' DA 147 H3' A 147 -11.261 -1.534 6.583 262 H2' DA 147 H2' A 147 -9.081 -1.985 6.019 263 H2'' DA 147 H2" A 147 -9.755 -2.415 4.426 264 H1' DA 147 H1' A 147 -9.364 -0.190 3.550 265 H61 DA 147 2H6 A 147 -2.812 -0.599 3.818 266 H62 DA 147 1H6 A 147 -2.537 -0.262 2.111 267 H5 DC 148 5H C 148 -7.096 -3.584 3.283 268 H6 DC 148 6H C 148 -9.398 -3.400 2.425 269 H5' DC 148 H5' C 148 -12.306 -0.762 1.941 270 H5'' DC 148 H5" C 148 -13.773 -1.759 1.779 271 H4' DC 148 H4' C 148 -12.797 -1.648 -0.418 272 H3' DC 148 H3' C 148 -13.207 -4.120 0.861 273 H2' DC 148 H2' C 148 -10.941 -4.457 1.461 274 H2'' DC 148 H2" C 148 -10.880 -5.256 -0.106 275 H1' DC 148 H1' C 148 -10.150 -3.274 -1.251 276 H41 DC 148 1H4 C 148 -4.190 -3.153 1.041 277 H42 DC 148 2H4 C 148 -4.749 -3.482 2.672 278 H8 DG 149 8H G 149 -9.213 -6.810 -1.045 279 H1 DG 149 1H G 149 -2.835 -6.019 -1.182 280 H5' DG 149 H5' G 149 -10.910 -3.537 -3.224 281 H5'' DG 149 H5" G 149 -12.161 -4.310 -4.198 282 H4' DG 149 H4' G 149 -10.209 -4.551 -5.489 283 H3' DG 149 H3' G 149 -11.535 -6.831 -4.540 284 H2' DG 149 H2' G 149 -10.008 -7.356 -2.924 285 H2'' DG 149 H2" G 149 -9.220 -8.256 -4.185 286 H1' DG 149 H1' G 149 -7.584 -6.463 -4.556 287 H21 DG 149 1H2 G 149 -2.193 -5.647 -3.219 288 H22 DG 149 2H2 G 149 -3.335 -5.454 -4.534 289 H5 DC 150 5H C 150 -6.989 -9.566 -1.676 290 H6 DC 150 6H C 150 -7.151 -9.799 -4.086 291 H5' DC 150 H5' C 150 -8.228 -9.170 -5.705 292 H5'' DC 150 H5" C 150 -8.053 -7.472 -6.248 293 H4' DC 150 H4' C 150 -6.772 -8.232 -8.179 294 H3' DC 150 H3' C 150 -7.786 -10.744 -7.680 295 H2' DC 150 H2' C 150 -6.736 -11.162 -5.697 296 H2'' DC 150 H2" C 150 -5.404 -11.667 -6.701 297 H1' DC 150 H1' C 150 -4.148 -9.722 -6.336 298 H41 DC 150 1H4 C 150 -3.731 -9.360 0.009 299 H42 DC 150 2H4 C 150 -5.474 -9.505 0.212 300 H5 DC 151 5H C 151 -5.098 -13.062 -4.354 301 H6 DC 151 6H C 151 -3.908 -12.972 -6.477 302 H5' DC 151 H5' C 151 -3.415 -10.167 -9.039 303 H5'' DC 151 H5" C 151 -3.163 -11.160 -10.487 304 H4' DC 151 H4' C 151 -1.067 -10.942 -9.351 305 H3' DC 151 H3' C 151 -2.136 -13.442 -9.972 306 H2' DC 151 H2' C 151 -2.722 -14.014 -7.818 307 H2'' DC 151 H2" C 151 -1.076 -14.613 -7.733 308 H1' DC 151 H1' C 151 -0.230 -12.602 -6.714 309 H41 DC 151 1H4 C 151 -3.306 -12.827 -1.203 310 H42 DC 151 2H4 C 151 -4.853 -12.935 -2.011 311 H5 DC 152 5H C 152 -3.119 -15.899 -4.990 312 H6 DC 152 6H C 152 -0.931 -15.893 -6.074 313 H5' DC 152 H5' C 152 1.833 -13.220 -7.674 314 H5'' DC 152 H5" C 152 3.010 -14.178 -8.601 315 H4' DC 152 H4' C 152 3.521 -14.614 -6.374 316 H3' DC 152 H3' C 152 2.517 -16.749 -8.001 317 H2' DC 152 H2' C 152 0.710 -17.210 -6.637 318 H2'' DC 152 H2" C 152 1.911 -18.090 -5.662 319 H1' DC 152 H1' C 152 2.282 -16.225 -4.195 320 H41 DC 152 1H4 C 152 -3.408 -16.213 -1.357 321 H42 DC 152 2H4 C 152 -4.240 -16.049 -2.895 322 H5 DC 153 5H C 153 -1.346 -19.530 -4.665 323 H6 DC 153 6H C 153 1.082 -19.900 -4.478 324 H5' DC 153 H5' C 153 4.494 -17.584 -4.047 325 H5'' DC 153 H5" C 153 5.904 -18.611 -4.366 326 H4' DC 153 H4' C 153 5.199 -19.274 -2.247 327 H3' DC 153 H3' C 153 4.858 -21.205 -4.345 328 H2' DC 153 H2' C 153 2.594 -21.292 -4.146 329 H2'' DC 153 H2" C 153 2.924 -22.361 -2.783 330 H1' DC 153 H1' C 153 2.746 -20.588 -1.169 331 H41 DC 153 1H4 C 153 -3.443 -19.151 -1.636 332 H42 DC 153 2H4 C 153 -3.391 -19.081 -3.386 333 H5 DC 154 5H C 154 -0.114 -22.882 -3.067 334 H6 DC 154 6H C 154 1.709 -23.471 -1.541 335 H5' DC 154 H5' C 154 4.477 -21.764 0.069 336 H5'' DC 154 H5" C 154 5.707 -22.924 0.575 337 H4' DC 154 H4' C 154 4.047 -22.994 2.265 338 H3' DC 154 H3' C 154 4.498 -25.302 0.619 339 H2' DC 154 H2' C 154 2.406 -25.385 -0.325 340 H2'' DC 154 H2" C 154 1.910 -26.104 1.232 341 H1' DC 154 H1' C 154 1.140 -24.041 2.098 342 H41 DC 154 1H4 C 154 -3.583 -22.710 -1.855 343 H42 DC 154 2H4 C 154 -2.490 -22.528 -3.215 344 H8 DG 155 8H G 155 0.495 -27.732 0.975 345 H1 DG 155 1H G 155 -5.498 -25.821 -0.329 346 H5' DG 155 H5' G 155 2.322 -25.510 4.562 347 H5'' DG 155 H5" G 155 2.800 -26.845 5.640 348 H4' DG 155 H4' G 155 0.427 -26.503 5.933 349 H3' DG 155 H3' G 155 1.413 -28.988 4.975 350 H2' DG 155 H2' G 155 0.447 -28.893 2.903 351 H2'' DG 155 H2" G 155 -0.990 -29.496 3.784 352 H1' DG 155 H1' G 155 -1.892 -27.331 4.047 353 H21 DG 155 1H2 G 155 -6.697 -25.921 1.459 354 H22 DG 155 2H2 G 155 -6.010 -26.365 3.015 355 H5 DC 156 5H C 156 -1.610 -30.781 1.112 356 H6 DC 156 6H C 156 -2.479 -31.014 3.393 357 H5' DC 156 H5' C 156 -2.702 -28.732 6.936 358 H5'' DC 156 H5" C 156 -3.031 -30.011 8.118 359 H4' DC 156 H4' C 156 -5.098 -29.427 7.008 360 H3' DC 156 H3' C 156 -3.957 -32.054 7.002 361 H2' DC 156 H2' C 156 -3.625 -32.124 4.734 362 H2'' DC 156 H2" C 156 -5.354 -32.500 4.736 363 H1' DC 156 H1' C 156 -6.049 -30.283 4.280 364 H41 DC 156 1H4 C 156 -3.704 -29.303 -1.556 365 H42 DC 156 2H4 C 156 -2.093 -29.785 -1.071 366 H8 DG 157 8H G 157 -6.447 -34.701 4.762 367 H1 DG 157 1H G 157 -6.842 -32.227 -1.138 368 H5' DG 157 H5' G 157 -8.721 -31.497 7.403 369 H5'' DG 157 H5" G 157 -9.540 -32.732 8.398 370 H4' DG 157 H4' G 157 -10.753 -32.306 6.256 371 H3' DG 157 H3' G 157 -10.209 -34.903 7.099 372 H2' DG 157 H2' G 157 -8.397 -35.239 5.629 373 H2'' DG 157 H2" G 157 -9.724 -35.865 4.599 374 H1' DG 157 H1' G 157 -10.004 -33.753 3.506 375 H21 DG 157 1H2 G 157 -8.938 -31.834 -1.613 376 H22 DG 157 2H2 G 157 -10.204 -32.061 -0.422 377 HA ALA 1 HA ALA 1 -7.040 17.904 -14.723 378 H1 ALA 1 HN ALA 1 -9.259 17.292 -13.470 379 HB1 ALA 1 1HB ALA 1 -8.441 19.961 -12.953 380 HB2 ALA 1 2HB ALA 1 -7.421 20.324 -14.363 381 HB3 ALA 1 3HB ALA 1 -8.956 19.462 -14.581 382 H SER 2 HN SER 2 -7.012 17.367 -11.348 383 HA SER 2 HA SER 2 -4.923 19.027 -10.421 384 HG SER 2 HG SER 2 -6.865 17.240 -8.043 385 HB2 SER 2 2HB SER 2 -5.480 16.156 -9.571 386 HB3 SER 2 3HB SER 2 -4.663 17.420 -8.624 387 H GLU 3 HN GLU 3 -4.793 16.171 -12.476 388 HA GLU 3 HA GLU 3 -2.021 15.506 -12.051 389 HB2 GLU 3 2HB GLU 3 -3.825 15.017 -14.447 390 HB3 GLU 3 3HB GLU 3 -2.278 14.220 -14.180 391 HG2 GLU 3 2HG GLU 3 -4.650 13.962 -12.275 392 HG3 GLU 3 3HG GLU 3 -4.349 12.890 -13.631 393 H LYS 4 HN LYS 4 -3.444 18.250 -13.493 394 HA LYS 4 HA LYS 4 -1.066 18.721 -15.262 395 HB2 LYS 4 2HB LYS 4 -3.710 20.235 -15.141 396 HB3 LYS 4 3HB LYS 4 -2.431 20.474 -16.317 397 HG2 LYS 4 2HG LYS 4 -4.206 18.013 -16.025 398 HG3 LYS 4 3HG LYS 4 -4.264 19.217 -17.302 399 HD2 LYS 4 2HD LYS 4 -1.982 17.249 -16.809 400 HD3 LYS 4 3HD LYS 4 -3.205 17.152 -18.078 401 HE2 LYS 4 2HE LYS 4 -2.404 19.308 -19.024 402 HE3 LYS 4 3HE LYS 4 -1.152 19.386 -17.772 403 HZ1 LYS 4 3HZ LYS 4 -0.297 18.476 -19.814 404 HZ2 LYS 4 1HZ LYS 4 -1.409 17.263 -19.801 405 HZ3 LYS 4 2HZ LYS 4 -0.252 17.331 -18.631 406 H ARG 5 HN ARG 5 -1.595 19.084 -12.135 407 HA ARG 5 HA ARG 5 -0.731 21.956 -11.968 408 HE ARG 5 HE ARG 5 -2.317 22.240 -13.015 409 HB2 ARG 5 2HB ARG 5 -1.923 20.167 -9.810 410 HB3 ARG 5 3HB ARG 5 -1.565 21.864 -9.620 411 HG2 ARG 5 2HG ARG 5 -3.690 20.719 -11.488 412 HG3 ARG 5 3HG ARG 5 -3.958 21.394 -9.890 413 HD2 ARG 5 2HD ARG 5 -4.594 23.066 -11.422 414 HD3 ARG 5 3HD ARG 5 -3.058 23.604 -10.718 415 HH11 ARG 5 1HH2 ARG 5 -4.441 25.009 -12.580 416 HH12 ARG 5 2HH2 ARG 5 -4.067 25.605 -14.187 417 HH21 ARG 5 1HH1 ARG 5 -1.879 23.006 -14.887 418 HH22 ARG 5 2HH1 ARG 5 -2.632 24.481 -15.503 419 HA PRO 6 HA PRO 6 3.168 20.573 -10.360 420 HB2 PRO 6 2HB PRO 6 4.000 22.716 -8.899 421 HB3 PRO 6 3HB PRO 6 3.785 22.803 -10.674 422 HG2 PRO 6 2HG PRO 6 1.843 23.692 -8.515 423 HG3 PRO 6 3HG PRO 6 2.381 24.608 -9.959 424 HD2 PRO 6 2HD PRO 6 0.044 23.193 -9.887 425 HD3 PRO 6 3HD PRO 6 1.010 23.346 -11.386 426 H PHE 7 HN PHE 7 4.303 19.852 -8.465 427 HA PHE 7 HA PHE 7 2.888 20.013 -5.846 428 HD1 PHE 7 2HD PHE 7 1.717 18.073 -8.958 429 HD2 PHE 7 1HD PHE 7 0.959 17.260 -4.812 430 HE1 PHE 7 2HE PHE 7 -0.699 17.951 -9.430 431 HE2 PHE 7 1HE PHE 7 -1.478 17.149 -5.269 432 HZ PHE 7 HZ PHE 7 -2.319 17.560 -7.585 433 HB2 PHE 7 2HB PHE 7 3.531 17.391 -7.269 434 HB3 PHE 7 3HB PHE 7 3.169 17.502 -5.556 435 H MET 8 HN MET 8 4.357 19.734 -4.049 436 HA MET 8 HA MET 8 7.077 18.683 -4.776 437 HB2 MET 8 2HB MET 8 6.435 20.919 -2.812 438 HB3 MET 8 3HB MET 8 8.019 20.190 -3.070 439 HG2 MET 8 2HG MET 8 7.947 20.965 -5.435 440 HG3 MET 8 3HG MET 8 6.421 21.780 -5.106 441 HE1 MET 8 3HE MET 8 10.589 23.001 -3.452 442 HE2 MET 8 1HE MET 8 9.757 21.582 -2.798 443 HE3 MET 8 2HE MET 8 10.275 21.600 -4.498 444 H CYS 9 HN CYS 9 8.081 17.353 -3.386 445 HA CYS 9 HA CYS 9 6.521 15.904 -1.437 446 HB2 CYS 9 2HB CYS 9 8.282 14.708 -2.425 447 HB3 CYS 9 3HB CYS 9 9.430 16.020 -2.260 448 H ALA 10 HN ALA 10 7.047 15.786 0.885 449 HA ALA 10 HA ALA 10 8.206 18.273 2.035 450 HB1 ALA 10 1HB ALA 10 5.462 17.133 2.743 451 HB2 ALA 10 2HB ALA 10 6.292 18.422 3.643 452 HB3 ALA 10 3HB ALA 10 5.809 18.696 1.967 453 H TYR 11 HN TYR 11 8.919 15.297 1.717 454 HA TYR 11 HA TYR 11 9.094 14.472 4.571 455 HD1 TYR 11 1HD TYR 11 8.631 11.592 5.117 456 HD2 TYR 11 2HD TYR 11 12.231 12.394 2.893 457 HE1 TYR 11 1HE TYR 11 9.939 10.129 6.679 458 HE2 TYR 11 2HE TYR 11 13.519 10.941 4.433 459 HH TYR 11 HH TYR 11 13.240 9.256 6.066 460 HB2 TYR 11 2HB TYR 11 8.604 12.746 2.849 461 HB3 TYR 11 3HB TYR 11 10.122 13.143 2.044 462 HA PRO 12 HA PRO 12 12.925 16.806 4.755 463 HB2 PRO 12 2HB PRO 12 13.767 15.956 7.259 464 HB3 PRO 12 3HB PRO 12 12.464 17.142 6.990 465 HG2 PRO 12 2HG PRO 12 12.182 14.175 7.519 466 HG3 PRO 12 3HG PRO 12 11.303 15.534 8.295 467 HD2 PRO 12 2HD PRO 12 10.247 14.097 6.255 468 HD3 PRO 12 3HD PRO 12 9.951 15.865 6.382 469 H GLY 13 HN GLY 13 14.129 15.817 3.091 470 HA2 GLY 13 2HA GLY 13 16.345 14.289 3.365 471 HA3 GLY 13 3HA GLY 13 15.053 13.072 3.454 472 H CYS 14 HN CYS 14 13.302 14.838 1.683 473 HA CYS 14 HA CYS 14 14.738 14.574 -0.937 474 HB2 CYS 14 2HB CYS 14 13.229 12.706 -0.809 475 HB3 CYS 14 3HB CYS 14 11.970 13.731 -0.118 476 H ASN 15 HN ASN 15 11.381 15.619 -0.188 477 HA ASN 15 HA ASN 15 10.295 17.630 -0.446 478 HB2 ASN 15 2HB ASN 15 11.846 18.255 1.409 479 HB3 ASN 15 3HB ASN 15 13.010 18.849 0.235 480 HD21 ASN 15 1HD2 ASN 15 9.388 19.545 0.025 481 HD22 ASN 15 2HD2 ASN 15 9.756 21.243 0.363 482 H LYS 16 HN LYS 16 11.245 16.426 -2.871 483 HA LYS 16 HA LYS 16 12.208 18.716 -4.517 484 HB2 LYS 16 2HB LYS 16 11.929 15.724 -5.058 485 HB3 LYS 16 3HB LYS 16 12.417 16.894 -6.294 486 HG2 LYS 16 2HG LYS 16 14.313 17.624 -4.872 487 HG3 LYS 16 3HG LYS 16 13.907 16.393 -3.677 488 HD2 LYS 16 2HD LYS 16 14.564 15.771 -6.588 489 HD3 LYS 16 3HD LYS 16 15.784 15.836 -5.318 490 HE2 LYS 16 2HE LYS 16 13.380 13.963 -5.246 491 HE3 LYS 16 3HE LYS 16 14.980 13.527 -5.878 492 HZ1 LYS 16 3HZ LYS 16 14.255 14.245 -3.133 493 HZ2 LYS 16 1HZ LYS 16 15.839 14.172 -3.633 494 HZ3 LYS 16 2HZ LYS 16 14.865 12.831 -3.656 495 H ARG 17 HN ARG 17 11.251 18.870 -6.773 496 HA ARG 17 HA ARG 17 8.347 19.189 -6.337 497 HE ARG 17 HE ARG 17 7.213 23.344 -10.250 498 HB2 ARG 17 2HB ARG 17 9.825 21.119 -6.948 499 HB3 ARG 17 3HB ARG 17 10.179 20.348 -8.492 500 HG2 ARG 17 2HG ARG 17 7.794 20.557 -9.158 501 HG3 ARG 17 3HG ARG 17 7.413 21.264 -7.577 502 HD2 ARG 17 2HD ARG 17 9.126 23.075 -8.057 503 HD3 ARG 17 3HD ARG 17 9.267 22.421 -9.689 504 HH11 ARG 17 2HH1 ARG 17 7.521 23.634 -6.738 505 HH12 ARG 17 1HH1 ARG 17 6.253 24.832 -6.661 506 HH21 ARG 17 2HH2 ARG 17 5.636 24.888 -10.044 507 HH22 ARG 17 1HH2 ARG 17 5.208 25.487 -8.459 508 H TYR 18 HN TYR 18 6.895 17.948 -7.251 509 HA TYR 18 HA TYR 18 7.565 16.318 -9.626 510 HD1 TYR 18 1HD TYR 18 6.876 13.356 -9.187 511 HD2 TYR 18 2HD TYR 18 7.099 16.017 -5.787 512 HE1 TYR 18 1HE TYR 18 8.829 12.109 -8.323 513 HE2 TYR 18 2HE TYR 18 8.963 14.682 -4.877 514 HH TYR 18 HH TYR 18 10.376 12.939 -5.253 515 HB2 TYR 18 2HB TYR 18 5.350 16.274 -7.543 516 HB3 TYR 18 3HB TYR 18 5.316 15.243 -8.959 517 H PHE 19 HN PHE 19 5.750 16.029 -11.222 518 HA PHE 19 HA PHE 19 4.118 18.512 -11.591 519 HD1 PHE 19 2HD PHE 19 7.891 17.434 -12.786 520 HD2 PHE 19 1HD PHE 19 4.636 16.018 -15.236 521 HE1 PHE 19 2HE PHE 19 9.409 15.790 -13.855 522 HE2 PHE 19 1HE PHE 19 6.155 14.368 -16.294 523 HZ PHE 19 HZ PHE 19 8.548 14.260 -15.619 524 HB2 PHE 19 2HB PHE 19 4.533 18.235 -14.080 525 HB3 PHE 19 3HB PHE 19 5.878 18.775 -13.127 526 H LYS 20 HN LYS 20 3.032 16.446 -10.296 527 HA LYS 20 HA LYS 20 0.749 15.777 -11.711 528 HB2 LYS 20 2HB LYS 20 2.874 13.949 -12.518 529 HB3 LYS 20 3HB LYS 20 1.661 13.075 -11.556 530 HG2 LYS 20 2HG LYS 20 -0.124 13.956 -13.014 531 HG3 LYS 20 3HG LYS 20 1.090 14.784 -13.995 532 HD2 LYS 20 2HD LYS 20 2.147 12.598 -14.526 533 HD3 LYS 20 3HD LYS 20 0.873 11.774 -13.591 534 HE2 LYS 20 2HE LYS 20 -0.849 12.755 -15.074 535 HE3 LYS 20 3HE LYS 20 0.408 13.602 -15.988 536 HZ1 LYS 20 3HZ LYS 20 1.322 11.463 -16.595 537 HZ2 LYS 20 1HZ LYS 20 -0.253 11.559 -17.066 538 HZ3 LYS 20 2HZ LYS 20 0.156 10.673 -15.739 539 H LEU 21 HN LEU 21 -0.806 14.778 -10.381 540 HA LEU 21 HA LEU 21 -0.186 14.771 -7.537 541 HG LEU 21 HG LEU 21 -2.134 14.633 -6.112 542 HB2 LEU 21 2HB LEU 21 -2.395 15.402 -8.594 543 HB3 LEU 21 3HB LEU 21 -2.691 13.722 -8.968 544 HD11 LEU 21 1HD1 LEU 21 -3.999 15.984 -6.937 545 HD12 LEU 21 2HD1 LEU 21 -4.585 14.777 -5.793 546 HD13 LEU 21 3HD1 LEU 21 -4.825 14.522 -7.536 547 HD21 LEU 21 3HD2 LEU 21 -3.615 12.230 -7.286 548 HD22 LEU 21 1HD2 LEU 21 -3.619 12.666 -5.564 549 HD23 LEU 21 2HD2 LEU 21 -2.114 12.201 -6.329 550 H SER 22 HN SER 22 -1.238 12.249 -9.886 551 HA SER 22 HA SER 22 -0.899 10.079 -8.057 552 HG SER 22 HG SER 22 -2.979 10.474 -10.764 553 HB2 SER 22 2HB SER 22 -0.961 10.104 -11.105 554 HB3 SER 22 3HB SER 22 -1.103 8.656 -10.086 555 H HIS 23 HN HIS 23 1.408 11.710 -10.142 556 HA HIS 23 HA HIS 23 3.231 9.379 -10.215 557 HD1 HIS 23 1HD HIS 23 5.993 11.527 -12.970 558 HD2 HIS 23 2HD HIS 23 4.013 13.789 -10.048 559 HE1 HIS 23 1HE HIS 23 7.148 13.797 -12.883 560 HB2 HIS 23 2HB HIS 23 4.162 10.323 -11.898 561 HB3 HIS 23 3HB HIS 23 2.879 11.418 -12.020 562 H LEU 24 HN LEU 24 2.702 12.497 -8.546 563 HA LEU 24 HA LEU 24 5.054 12.227 -6.862 564 HG LEU 24 HG LEU 24 4.188 15.422 -5.349 565 HB2 LEU 24 2HB LEU 24 3.986 14.373 -7.283 566 HB3 LEU 24 3HB LEU 24 2.489 13.830 -6.602 567 HD11 LEU 24 1HD1 LEU 24 1.944 14.875 -4.564 568 HD12 LEU 24 2HD1 LEU 24 3.106 14.850 -3.226 569 HD13 LEU 24 3HD1 LEU 24 2.522 13.325 -3.917 570 HD21 LEU 24 3HD2 LEU 24 5.897 13.395 -5.207 571 HD22 LEU 24 1HD2 LEU 24 4.914 12.998 -3.778 572 HD23 LEU 24 2HD2 LEU 24 5.695 14.566 -3.891 573 H GLN 25 HN GLN 25 1.627 11.143 -6.728 574 HA GLN 25 HA GLN 25 1.618 10.151 -4.050 575 HB2 GLN 25 2HB GLN 25 -0.365 10.320 -5.705 576 HB3 GLN 25 3HB GLN 25 0.211 8.798 -6.386 577 HG2 GLN 25 2HG GLN 25 0.146 8.019 -3.830 578 HG3 GLN 25 3HG GLN 25 -0.995 9.349 -3.686 579 HE21 GLN 25 1HE2 GLN 25 -2.663 9.158 -5.953 580 HE22 GLN 25 2HE2 GLN 25 -3.289 7.502 -6.003 581 H MET 26 HN MET 26 2.701 8.629 -7.145 582 HA MET 26 HA MET 26 3.519 6.114 -6.048 583 HB2 MET 26 2HB MET 26 4.821 7.667 -8.340 584 HB3 MET 26 3HB MET 26 5.011 5.968 -7.974 585 HG2 MET 26 2HG MET 26 2.656 7.357 -9.206 586 HG3 MET 26 3HG MET 26 3.631 6.063 -9.815 587 HE1 MET 26 3HE MET 26 0.589 6.863 -7.226 588 HE2 MET 26 1HE MET 26 0.267 6.852 -8.980 589 HE3 MET 26 2HE MET 26 -0.402 5.589 -7.938 590 H HIS 27 HN HIS 27 5.385 9.182 -6.580 591 HA HIS 27 HA HIS 27 7.822 8.341 -5.360 592 HD1 HIS 27 1HD HIS 27 10.154 9.988 -4.839 593 HD2 HIS 27 2HD HIS 27 7.019 12.451 -3.501 594 HE1 HIS 27 1HE HIS 27 11.063 11.393 -2.892 595 HB2 HIS 27 2HB HIS 27 7.851 10.392 -6.563 596 HB3 HIS 27 3HB HIS 27 6.492 11.063 -5.658 597 H SER 28 HN SER 28 4.754 9.173 -3.894 598 HA SER 28 HA SER 28 5.787 10.122 -1.323 599 HG SER 28 HG SER 28 3.800 10.945 -3.261 600 HB2 SER 28 2HB SER 28 3.018 9.017 -1.977 601 HB3 SER 28 3HB SER 28 3.489 9.978 -0.583 602 H ARG 29 HN ARG 29 4.866 7.033 -2.852 603 HA ARG 29 HA ARG 29 4.620 5.431 -0.493 604 HE ARG 29 HE ARG 29 2.112 3.351 -5.650 605 HB2 ARG 29 2HB ARG 29 5.704 4.576 -3.219 606 HB3 ARG 29 3HB ARG 29 5.062 3.537 -1.949 607 HG2 ARG 29 2HG ARG 29 2.866 4.835 -2.147 608 HG3 ARG 29 3HG ARG 29 3.533 5.553 -3.623 609 HD2 ARG 29 2HD ARG 29 3.965 3.104 -4.369 610 HD3 ARG 29 3HD ARG 29 2.834 2.652 -3.093 611 HH11 ARG 29 1HH2 ARG 29 1.102 4.963 -2.615 612 HH12 ARG 29 2HH2 ARG 29 -0.354 5.511 -3.455 613 HH21 ARG 29 1HH1 ARG 29 0.233 4.062 -6.409 614 HH22 ARG 29 2HH1 ARG 29 -0.791 5.098 -5.383 615 H LYS 30 HN LYS 30 7.484 6.545 -2.340 616 HA LYS 30 HA LYS 30 9.412 4.745 -1.201 617 HB2 LYS 30 2HB LYS 30 9.822 6.182 -3.190 618 HB3 LYS 30 3HB LYS 30 9.747 7.612 -2.166 619 HG2 LYS 30 2HG LYS 30 11.999 7.158 -2.706 620 HG3 LYS 30 3HG LYS 30 11.793 6.961 -0.984 621 HD2 LYS 30 2HD LYS 30 11.752 4.585 -2.898 622 HD3 LYS 30 3HD LYS 30 13.266 5.294 -2.359 623 HE2 LYS 30 2HE LYS 30 11.183 4.057 -0.516 624 HE3 LYS 30 3HE LYS 30 12.684 3.298 -1.060 625 HZ1 LYS 30 3HZ LYS 30 13.012 4.225 1.078 626 HZ2 LYS 30 1HZ LYS 30 12.409 5.679 0.636 627 HZ3 LYS 30 2HZ LYS 30 13.861 5.168 0.025 628 H HIS 31 HN HIS 31 7.883 7.702 0.026 629 HA HIS 31 HA HIS 31 9.824 7.889 2.232 630 HD1 HIS 31 1HD HIS 31 11.281 9.456 2.133 631 HD2 HIS 31 2HD HIS 31 8.487 11.572 -0.211 632 HE1 HIS 31 1HE HIS 31 12.618 11.029 0.635 633 HB2 HIS 31 2HB HIS 31 7.472 9.599 1.361 634 HB3 HIS 31 3HB HIS 31 8.336 9.859 2.886 635 H THR 32 HN THR 32 6.748 6.349 1.638 636 HA THR 32 HA THR 32 5.821 6.315 4.418 637 HB THR 32 HB THR 32 4.373 4.523 3.730 638 HG1 THR 32 1HG THR 32 5.894 4.376 1.324 639 HG21 THR 32 3HG2 THR 32 3.077 5.478 1.900 640 HG22 THR 32 1HG2 THR 32 4.403 6.588 1.507 641 HG23 THR 32 2HG2 THR 32 3.571 6.712 3.068 642 H GLY 33 HN GLY 33 8.016 4.443 2.324 643 HA2 GLY 33 2HA GLY 33 8.403 2.268 4.196 644 HA3 GLY 33 3HA GLY 33 9.406 2.648 2.783 645 H GLU 34 HN GLU 34 9.426 5.533 4.309 646 HA GLU 34 HA GLU 34 12.041 5.134 5.543 647 HB2 GLU 34 2HB GLU 34 10.146 7.538 5.613 648 HB3 GLU 34 3HB GLU 34 11.754 7.483 6.257 649 HG2 GLU 34 2HG GLU 34 11.317 6.791 3.338 650 HG3 GLU 34 3HG GLU 34 11.437 8.466 3.849 651 H LYS 35 HN LYS 35 8.743 4.785 6.598 652 HA LYS 35 HA LYS 35 9.715 4.402 9.406 653 HB2 LYS 35 2HB LYS 35 8.534 6.612 9.067 654 HB3 LYS 35 3HB LYS 35 7.077 5.726 8.636 655 HG2 LYS 35 2HG LYS 35 7.127 4.666 10.950 656 HG3 LYS 35 3HG LYS 35 8.599 5.577 11.292 657 HD2 LYS 35 2HD LYS 35 6.720 6.730 12.291 658 HD3 LYS 35 3HD LYS 35 7.341 7.713 10.952 659 HE2 LYS 35 2HE LYS 35 5.529 6.781 9.483 660 HE3 LYS 35 3HE LYS 35 4.918 5.859 10.862 661 HZ1 LYS 35 3HZ LYS 35 3.724 7.897 10.528 662 HZ2 LYS 35 1HZ LYS 35 5.095 8.797 10.719 663 HZ3 LYS 35 2HZ LYS 35 4.492 7.928 11.986 664 HA PRO 36 HA PRO 36 7.211 0.731 8.076 665 HB2 PRO 36 2HB PRO 36 9.075 -1.236 8.305 666 HB3 PRO 36 3HB PRO 36 9.122 -0.074 6.946 667 HG2 PRO 36 2HG PRO 36 10.696 0.050 9.547 668 HG3 PRO 36 3HG PRO 36 11.318 0.199 7.874 669 HD2 PRO 36 2HD PRO 36 10.681 2.366 9.483 670 HD3 PRO 36 3HD PRO 36 10.572 2.404 7.697 671 H TYR 37 HN TYR 37 6.996 -1.506 9.363 672 HA TYR 37 HA TYR 37 7.269 -0.976 12.323 673 HD1 TYR 37 1HD TYR 37 5.189 0.604 13.294 674 HD2 TYR 37 2HD TYR 37 4.229 -0.746 9.307 675 HE1 TYR 37 1HE TYR 37 4.977 2.961 12.544 676 HE2 TYR 37 2HE TYR 37 3.997 1.632 8.574 677 HH TYR 37 HH TYR 37 5.497 3.557 9.427 678 HB2 TYR 37 2HB TYR 37 4.850 -2.339 11.036 679 HB3 TYR 37 3HB TYR 37 5.083 -1.775 12.715 680 H GLN 38 HN GLN 38 6.819 -3.054 13.618 681 HA GLN 38 HA GLN 38 7.655 -5.526 12.197 682 HB2 GLN 38 2HB GLN 38 8.942 -4.421 14.730 683 HB3 GLN 38 3HB GLN 38 9.036 -6.110 14.281 684 HG2 GLN 38 2HG GLN 38 9.851 -4.556 11.977 685 HG3 GLN 38 3HG GLN 38 10.670 -3.911 13.389 686 HE21 GLN 38 1HE2 GLN 38 9.774 -7.326 12.390 687 HE22 GLN 38 2HE2 GLN 38 11.436 -7.888 12.532 688 H CYS 39 HN CYS 39 7.004 -7.462 13.324 689 HA CYS 39 HA CYS 39 4.423 -7.265 14.573 690 HB2 CYS 39 2HB CYS 39 5.289 -9.304 13.350 691 HB3 CYS 39 3HB CYS 39 6.331 -9.627 14.767 692 H ASP 40 HN ASP 40 3.801 -7.008 16.641 693 HA ASP 40 HA ASP 40 5.910 -6.543 18.667 694 HB2 ASP 40 2HB ASP 40 4.056 -5.573 19.996 695 HB3 ASP 40 3HB ASP 40 4.181 -4.844 18.402 696 H PHE 41 HN PHE 41 4.463 -9.278 17.597 697 HA PHE 41 HA PHE 41 3.357 -10.451 19.986 698 HD1 PHE 41 1HD PHE 41 1.727 -12.317 19.929 699 HD2 PHE 41 2HD PHE 41 5.036 -14.007 17.745 700 HE1 PHE 41 1HE PHE 41 1.140 -14.578 20.765 701 HE2 PHE 41 2HE PHE 41 4.440 -16.253 18.559 702 HZ PHE 41 HZ PHE 41 2.503 -16.548 20.091 703 HB2 PHE 41 2HB PHE 41 2.911 -11.268 17.706 704 HB3 PHE 41 3HB PHE 41 4.592 -11.726 17.521 705 H LYS 42 HN LYS 42 4.264 -12.147 21.313 706 HA LYS 42 HA LYS 42 6.778 -11.449 22.421 707 HB2 LYS 42 2HB LYS 42 4.889 -12.619 23.598 708 HB3 LYS 42 3HB LYS 42 5.277 -14.088 22.701 709 HG2 LYS 42 2HG LYS 42 7.591 -14.039 23.770 710 HG3 LYS 42 3HG LYS 42 7.080 -12.612 24.676 711 HD2 LYS 42 2HD LYS 42 6.873 -14.487 26.129 712 HD3 LYS 42 3HD LYS 42 5.220 -14.036 25.677 713 HE2 LYS 42 2HE LYS 42 5.209 -15.849 23.965 714 HE3 LYS 42 3HE LYS 42 6.877 -16.252 24.370 715 HZ1 LYS 42 3HZ LYS 42 4.581 -16.437 26.215 716 HZ2 LYS 42 1HZ LYS 42 6.140 -16.817 26.590 717 HZ3 LYS 42 2HZ LYS 42 5.324 -17.703 25.467 718 H ASP 43 HN ASP 43 5.913 -13.945 20.021 719 HA ASP 43 HA ASP 43 8.810 -14.701 19.841 720 HB2 ASP 43 2HB ASP 43 6.457 -16.593 19.399 721 HB3 ASP 43 3HB ASP 43 8.166 -17.002 19.530 722 H CYS 44 HN CYS 44 8.082 -12.680 18.212 723 HA CYS 44 HA CYS 44 8.044 -14.013 15.555 724 HB2 CYS 44 2HB CYS 44 5.745 -13.116 16.036 725 HB3 CYS 44 3HB CYS 44 6.432 -11.492 16.192 726 H GLU 45 HN GLU 45 8.603 -12.257 13.818 727 HA GLU 45 HA GLU 45 10.401 -10.135 14.698 728 HB2 GLU 45 2HB GLU 45 12.456 -11.077 13.623 729 HB3 GLU 45 3HB GLU 45 11.930 -11.956 15.029 730 HG2 GLU 45 2HG GLU 45 12.568 -13.657 13.648 731 HG3 GLU 45 3HG GLU 45 10.835 -13.666 13.411 732 H ARG 46 HN ARG 46 7.982 -10.706 12.922 733 HA ARG 46 HA ARG 46 8.971 -10.383 10.166 734 HE ARG 46 HE ARG 46 6.856 -13.036 11.990 735 HB2 ARG 46 2HB ARG 46 6.331 -10.872 11.507 736 HB3 ARG 46 3HB ARG 46 6.268 -9.889 10.068 737 HG2 ARG 46 2HG ARG 46 5.899 -12.281 9.602 738 HG3 ARG 46 3HG ARG 46 7.202 -11.544 8.674 739 HD2 ARG 46 2HD ARG 46 7.817 -13.790 9.357 740 HD3 ARG 46 3HD ARG 46 8.883 -12.602 10.114 741 HH11 ARG 46 1HH2 ARG 46 9.552 -14.866 10.754 742 HH12 ARG 46 2HH2 ARG 46 9.391 -16.094 12.003 743 HH21 ARG 46 1HH1 ARG 46 6.929 -14.314 13.614 744 HH22 ARG 46 2HH1 ARG 46 7.949 -15.754 13.689 745 H ARG 47 HN ARG 47 8.133 -8.580 8.825 746 HA ARG 47 HA ARG 47 7.759 -6.059 10.334 747 HE ARG 47 HE ARG 47 12.142 -8.511 7.156 748 HB2 ARG 47 2HB ARG 47 9.467 -5.016 8.698 749 HB3 ARG 47 3HB ARG 47 10.076 -5.882 10.083 750 HG2 ARG 47 2HG ARG 47 9.821 -7.391 7.477 751 HG3 ARG 47 3HG ARG 47 11.122 -6.213 7.672 752 HD2 ARG 47 2HD ARG 47 11.983 -7.336 9.643 753 HD3 ARG 47 3HD ARG 47 10.640 -8.479 9.646 754 HH11 ARG 47 1HH1 ARG 47 11.983 -9.940 10.415 755 HH12 ARG 47 2HH1 ARG 47 13.030 -11.246 9.978 756 HH21 ARG 47 1HH2 ARG 47 13.412 -10.292 6.666 757 HH22 ARG 47 2HH2 ARG 47 13.770 -11.451 7.932 758 H PHE 48 HN PHE 48 6.764 -4.404 9.182 759 HA PHE 48 HA PHE 48 5.723 -5.123 6.475 760 HD1 PHE 48 1HD PHE 48 3.372 -6.884 6.372 761 HD2 PHE 48 2HD PHE 48 4.539 -5.920 10.416 762 HE1 PHE 48 1HE PHE 48 3.311 -9.280 6.970 763 HE2 PHE 48 2HE PHE 48 4.498 -8.328 11.002 764 HZ PHE 48 HZ PHE 48 3.963 -10.013 9.244 765 HB2 PHE 48 2HB PHE 48 3.998 -4.141 8.796 766 HB3 PHE 48 3HB PHE 48 3.458 -4.526 7.166 767 H SER 49 HN SER 49 5.516 -3.403 5.113 768 HA SER 49 HA SER 49 6.681 -0.880 5.995 769 HG SER 49 HG SER 49 7.595 -2.014 2.740 770 HB2 SER 49 2HB SER 49 5.378 -1.567 3.319 771 HB3 SER 49 3HB SER 49 6.502 -0.233 3.653 772 H ARG 50 HN ARG 50 3.567 -2.113 6.273 773 HA ARG 50 HA ARG 50 2.456 0.642 6.488 774 HE ARG 50 HE ARG 50 -0.711 -1.959 3.168 775 HB2 ARG 50 2HB ARG 50 0.977 -1.732 5.266 776 HB3 ARG 50 3HB ARG 50 0.330 -0.122 5.613 777 HG2 ARG 50 2HG ARG 50 1.994 0.831 3.985 778 HG3 ARG 50 3HG ARG 50 2.381 -0.822 3.484 779 HD2 ARG 50 2HD ARG 50 -0.429 0.378 3.441 780 HD3 ARG 50 3HD ARG 50 0.655 0.438 2.069 781 HH11 ARG 50 1HH2 ARG 50 1.319 -0.661 0.620 782 HH12 ARG 50 2HH2 ARG 50 0.837 -1.963 -0.469 783 HH21 ARG 50 1HH1 ARG 50 -1.175 -3.581 1.683 784 HH22 ARG 50 2HH1 ARG 50 -0.440 -3.501 0.117 785 H SER 51 HN SER 51 1.316 1.001 8.310 786 HA SER 51 HA SER 51 1.436 -0.752 10.504 787 HG SER 51 HG SER 51 1.984 1.679 10.945 788 HB2 SER 51 2HB SER 51 -0.699 1.365 10.052 789 HB3 SER 51 3HB SER 51 -0.071 0.780 11.602 790 H ASP 52 HN ASP 52 -1.304 -0.168 8.213 791 HA ASP 52 HA ASP 52 -3.142 -1.932 9.316 792 HB2 ASP 52 2HB ASP 52 -4.288 -1.863 7.307 793 HB3 ASP 52 3HB ASP 52 -3.404 -0.347 7.319 794 H GLN 53 HN GLN 53 -0.352 -2.729 7.219 795 HA GLN 53 HA GLN 53 -1.179 -5.480 6.786 796 HB2 GLN 53 2HB GLN 53 1.446 -3.995 6.365 797 HB3 GLN 53 3HB GLN 53 1.250 -5.718 6.030 798 HG2 GLN 53 2HG GLN 53 -0.372 -3.479 4.751 799 HG3 GLN 53 3HG GLN 53 0.958 -4.356 4.000 800 HE21 GLN 53 1HE2 GLN 53 -2.471 -4.320 4.482 801 HE22 GLN 53 2HE2 GLN 53 -2.733 -5.931 3.792 802 H LEU 54 HN LEU 54 0.886 -3.742 9.123 803 HA LEU 54 HA LEU 54 1.794 -6.098 10.546 804 HG LEU 54 HG LEU 54 1.126 -4.314 13.420 805 HB2 LEU 54 2HB LEU 54 2.917 -4.044 10.968 806 HB3 LEU 54 3HB LEU 54 1.438 -3.172 11.285 807 HD11 LEU 54 1HD1 LEU 54 2.915 -5.733 14.349 808 HD12 LEU 54 2HD1 LEU 54 3.767 -5.724 12.789 809 HD13 LEU 54 3HD1 LEU 54 2.192 -6.517 12.946 810 HD21 LEU 54 3HD2 LEU 54 4.008 -3.449 13.289 811 HD22 LEU 54 1HD2 LEU 54 2.866 -3.245 14.612 812 HD23 LEU 54 2HD2 LEU 54 2.664 -2.264 13.145 813 H LYS 55 HN LYS 55 -1.010 -3.834 11.107 814 HA LYS 55 HA LYS 55 -2.229 -5.236 13.234 815 HB2 LYS 55 2HB LYS 55 -3.421 -3.591 10.961 816 HB3 LYS 55 3HB LYS 55 -4.398 -4.254 12.263 817 HG2 LYS 55 2HG LYS 55 -3.124 -2.999 13.939 818 HG3 LYS 55 3HG LYS 55 -2.089 -2.309 12.675 819 HD2 LYS 55 2HD LYS 55 -4.040 -1.216 11.629 820 HD3 LYS 55 3HD LYS 55 -5.124 -1.990 12.802 821 HE2 LYS 55 2HE LYS 55 -3.899 -0.804 14.646 822 HE3 LYS 55 3HE LYS 55 -2.958 0.061 13.416 823 HZ1 LYS 55 3HZ LYS 55 -5.898 0.150 13.689 824 HZ2 LYS 55 1HZ LYS 55 -5.010 0.980 12.575 825 HZ3 LYS 55 2HZ LYS 55 -4.855 1.331 14.169 826 H ARG 56 HN ARG 56 -2.653 -5.706 9.691 827 HA ARG 56 HA ARG 56 -4.543 -7.844 9.785 828 HE ARG 56 HE ARG 56 -4.749 -9.285 4.544 829 HB2 ARG 56 2HB ARG 56 -3.938 -6.590 7.765 830 HB3 ARG 56 3HB ARG 56 -2.308 -7.225 7.824 831 HG2 ARG 56 2HG ARG 56 -3.208 -9.512 7.289 832 HG3 ARG 56 3HG ARG 56 -4.824 -8.769 7.114 833 HD2 ARG 56 2HD ARG 56 -3.820 -7.128 5.484 834 HD3 ARG 56 3HD ARG 56 -2.276 -7.968 5.626 835 HH11 ARG 56 1HH1 ARG 56 -1.309 -8.468 4.001 836 HH12 ARG 56 2HH1 ARG 56 -1.292 -9.422 2.540 837 HH21 ARG 56 1HH2 ARG 56 -4.620 -10.242 2.524 838 HH22 ARG 56 2HH2 ARG 56 -3.049 -10.262 1.732 839 H HIS 57 HN HIS 57 -0.944 -7.880 9.708 840 HA HIS 57 HA HIS 57 -0.612 -10.691 9.768 841 HD1 HIS 57 1HD HIS 57 1.689 -12.067 9.741 842 HD2 HIS 57 2HD HIS 57 2.685 -9.260 12.706 843 HE1 HIS 57 1HE HIS 57 3.219 -13.276 11.434 844 HB2 HIS 57 2HB HIS 57 1.233 -9.255 9.246 845 HB3 HIS 57 3HB HIS 57 1.128 -8.396 10.780 846 H GLN 58 HN GLN 58 -0.860 -8.316 12.449 847 HA GLN 58 HA GLN 58 -0.421 -10.017 14.633 848 HB2 GLN 58 2HB GLN 58 -1.904 -7.446 14.200 849 HB3 GLN 58 3HB GLN 58 -2.285 -8.335 15.675 850 HG2 GLN 58 2HG GLN 58 0.571 -7.686 14.786 851 HG3 GLN 58 3HG GLN 58 -0.375 -6.683 15.888 852 HE21 GLN 58 1HE2 GLN 58 2.100 -9.171 16.020 853 HE22 GLN 58 2HE2 GLN 58 1.526 -9.685 17.590 854 H ARG 59 HN ARG 59 -3.312 -9.801 12.530 855 HA ARG 59 HA ARG 59 -5.253 -10.965 14.275 856 HE ARG 59 HE ARG 59 -8.650 -8.017 11.985 857 HB2 ARG 59 2HB ARG 59 -4.978 -11.413 11.280 858 HB3 ARG 59 3HB ARG 59 -6.400 -11.685 12.243 859 HG2 ARG 59 2HG ARG 59 -5.204 -8.931 11.773 860 HG3 ARG 59 3HG ARG 59 -6.515 -9.652 10.844 861 HD2 ARG 59 2HD ARG 59 -7.803 -9.892 12.988 862 HD3 ARG 59 3HD ARG 59 -6.552 -8.941 13.802 863 HH11 ARG 59 1HH1 ARG 59 -5.451 -7.015 13.141 864 HH12 ARG 59 2HH1 ARG 59 -5.962 -5.346 13.227 865 HH21 ARG 59 1HH2 ARG 59 -9.093 -5.856 11.934 866 HH22 ARG 59 2HH2 ARG 59 -7.867 -4.702 12.407 867 H ARG 60 HN ARG 60 -2.607 -12.435 12.392 868 HA ARG 60 HA ARG 60 -3.376 -15.205 12.634 869 HE ARG 60 HE ARG 60 1.053 -17.923 12.215 870 HB2 ARG 60 2HB ARG 60 -1.617 -14.491 11.095 871 HB3 ARG 60 3HB ARG 60 -0.649 -13.857 12.434 872 HG2 ARG 60 2HG ARG 60 -0.320 -16.122 13.345 873 HG3 ARG 60 3HG ARG 60 -1.280 -16.788 12.016 874 HD2 ARG 60 2HD ARG 60 0.425 -15.674 10.442 875 HD3 ARG 60 3HD ARG 60 1.360 -15.249 11.874 876 HH11 ARG 60 1HH2 ARG 60 2.212 -16.173 9.342 877 HH12 ARG 60 2HH2 ARG 60 3.374 -17.434 9.001 878 HH21 ARG 60 1HH1 ARG 60 2.472 -19.484 11.598 879 HH22 ARG 60 2HH1 ARG 60 3.480 -19.254 10.188 880 H HIS 61 HN HIS 61 -1.543 -12.988 14.788 881 HA HIS 61 HA HIS 61 -0.860 -15.199 16.626 882 HD1 HIS 61 1HD HIS 61 1.582 -15.637 16.508 883 HD2 HIS 61 2HD HIS 61 1.872 -11.609 15.316 884 HE1 HIS 61 1HE HIS 61 3.804 -15.386 15.249 885 HB2 HIS 61 2HB HIS 61 -0.290 -12.205 16.655 886 HB3 HIS 61 3HB HIS 61 0.233 -13.313 17.914 887 H THR 62 HN THR 62 -3.530 -13.163 16.175 888 HA THR 62 HA THR 62 -4.214 -13.179 19.095 889 HB THR 62 HB THR 62 -5.608 -11.152 18.533 890 HG1 THR 62 1HG THR 62 -4.078 -11.110 16.169 891 HG21 THR 62 3HG2 THR 62 -3.755 -9.554 18.199 892 HG22 THR 62 1HG2 THR 62 -2.647 -10.882 17.806 893 HG23 THR 62 2HG2 THR 62 -3.355 -10.771 19.423 894 H GLY 63 HN GLY 63 -4.994 -14.761 16.260 895 HA2 GLY 63 2HA GLY 63 -6.806 -16.033 15.606 896 HA3 GLY 63 3HA GLY 63 -7.348 -15.917 17.291 897 H VAL 64 HN VAL 64 -7.112 -12.788 15.992 898 HA VAL 64 HA VAL 64 -9.943 -12.391 16.216 899 HB VAL 64 HB VAL 64 -7.702 -10.619 15.147 900 HG11 VAL 64 1HG1 VAL 64 -9.797 -9.727 14.204 901 HG12 VAL 64 2HG1 VAL 64 -10.602 -9.866 15.781 902 HG13 VAL 64 3HG1 VAL 64 -9.280 -8.705 15.532 903 HG21 VAL 64 3HG2 VAL 64 -7.906 -9.494 17.309 904 HG22 VAL 64 1HG2 VAL 64 -9.260 -10.552 17.774 905 HG23 VAL 64 2HG2 VAL 64 -7.634 -11.214 17.582 906 H LYS 65 HN LYS 65 -11.474 -12.924 14.806 907 HA LYS 65 HA LYS 65 -10.893 -12.693 11.872 908 HB2 LYS 65 2HB LYS 65 -12.667 -14.689 13.329 909 HB3 LYS 65 3HB LYS 65 -12.605 -14.507 11.573 910 HG2 LYS 65 2HG LYS 65 -10.394 -15.342 11.434 911 HG3 LYS 65 3HG LYS 65 -10.118 -15.157 13.173 912 HD2 LYS 65 2HD LYS 65 -11.902 -16.928 13.559 913 HD3 LYS 65 3HD LYS 65 -11.955 -17.158 11.804 914 HE2 LYS 65 2HE LYS 65 -10.482 -18.837 12.674 915 HE3 LYS 65 3HE LYS 65 -9.469 -17.630 11.864 916 HZ1 LYS 65 3HZ LYS 65 -9.946 -17.842 14.770 917 HZ2 LYS 65 1HZ LYS 65 -9.079 -16.648 14.063 918 HZ3 LYS 65 2HZ LYS 65 -8.544 -18.209 13.984 919 HA PRO 66 HA PRO 66 -14.273 -9.851 13.030 920 HB2 PRO 66 2HB PRO 66 -13.452 -7.607 11.716 921 HB3 PRO 66 3HB PRO 66 -12.648 -8.191 13.202 922 HG2 PRO 66 2HG PRO 66 -11.767 -8.546 10.339 923 HG3 PRO 66 3HG PRO 66 -10.776 -8.120 11.766 924 HD2 PRO 66 2HD PRO 66 -11.113 -10.660 10.680 925 HD3 PRO 66 3HD PRO 66 -10.562 -10.367 12.356 926 H PHE 67 HN PHE 67 -13.282 -11.126 9.947 927 HA PHE 67 HA PHE 67 -15.661 -9.932 8.560 928 HD1 PHE 67 2HD PHE 67 -14.687 -8.391 6.415 929 HD2 PHE 67 1HD PHE 67 -11.463 -10.663 8.128 930 HE1 PHE 67 2HE PHE 67 -13.207 -6.403 6.266 931 HE2 PHE 67 1HE PHE 67 -9.964 -8.678 7.947 932 HZ PHE 67 HZ PHE 67 -10.846 -6.546 7.023 933 HB2 PHE 67 2HB PHE 67 -13.501 -11.785 7.438 934 HB3 PHE 67 3HB PHE 67 -14.699 -10.878 6.530 935 H GLN 68 HN GLN 68 -17.533 -11.084 8.312 936 HA GLN 68 HA GLN 68 -17.435 -14.017 8.938 937 HB2 GLN 68 2HB GLN 68 -18.375 -12.678 10.837 938 HB3 GLN 68 3HB GLN 68 -19.647 -12.076 9.767 939 HG2 GLN 68 2HG GLN 68 -20.488 -14.390 9.458 940 HG3 GLN 68 3HG GLN 68 -19.178 -15.019 10.456 941 HE21 GLN 68 1HE2 GLN 68 -22.521 -14.476 10.661 942 HE22 GLN 68 2HE2 GLN 68 -22.458 -14.007 12.360 943 H CYS 69 HN CYS 69 -18.596 -15.361 7.608 944 HA CYS 69 HA CYS 69 -19.578 -14.397 5.088 945 HB2 CYS 69 2HB CYS 69 -18.823 -16.748 5.456 946 HB3 CYS 69 3HB CYS 69 -20.223 -17.011 6.516 947 H LYS 70 HN LYS 70 -21.742 -14.352 4.278 948 HA LYS 70 HA LYS 70 -23.695 -13.345 6.294 949 HB2 LYS 70 2HB LYS 70 -23.771 -13.313 3.237 950 HB3 LYS 70 3HB LYS 70 -24.990 -12.641 4.298 951 HG2 LYS 70 2HG LYS 70 -23.727 -10.833 3.478 952 HG3 LYS 70 3HG LYS 70 -23.378 -10.997 5.192 953 HD2 LYS 70 2HD LYS 70 -21.410 -10.376 3.808 954 HD3 LYS 70 3HD LYS 70 -21.153 -11.844 4.729 955 HE2 LYS 70 2HE LYS 70 -21.721 -13.177 2.639 956 HE3 LYS 70 3HE LYS 70 -21.827 -11.647 1.753 957 HZ1 LYS 70 3HZ LYS 70 -19.640 -12.709 1.570 958 HZ2 LYS 70 1HZ LYS 70 -19.443 -12.618 3.194 959 HZ3 LYS 70 2HZ LYS 70 -19.533 -11.238 2.301 960 H THR 71 HN THR 71 -22.766 -16.236 4.908 961 HA THR 71 HA THR 71 -25.567 -17.268 4.650 962 HB THR 71 HB THR 71 -23.490 -18.924 3.354 963 HG1 THR 71 1HG THR 71 -22.402 -17.030 3.054 964 HG21 THR 71 3HG2 THR 71 -24.888 -18.687 1.410 965 HG22 THR 71 1HG2 THR 71 -25.831 -17.406 2.201 966 HG23 THR 71 2HG2 THR 71 -25.880 -19.072 2.832 967 H CYS 72 HN CYS 72 -22.367 -18.917 4.958 968 HA CYS 72 HA CYS 72 -23.559 -20.836 6.854 969 HB2 CYS 72 2HB CYS 72 -21.377 -21.968 6.647 970 HB3 CYS 72 3HB CYS 72 -22.053 -21.603 5.040 971 H GLN 73 HN GLN 73 -22.274 -17.777 7.185 972 HA GLN 73 HA GLN 73 -21.359 -16.570 8.911 973 HB2 GLN 73 2HB GLN 73 -22.129 -18.836 10.799 974 HB3 GLN 73 3HB GLN 73 -22.015 -17.118 11.128 975 HG2 GLN 73 2HG GLN 73 -24.170 -18.559 9.540 976 HG3 GLN 73 3HG GLN 73 -24.333 -17.716 11.072 977 HE21 GLN 73 1HE2 GLN 73 -25.108 -17.399 7.835 978 HE22 GLN 73 2HE2 GLN 73 -25.090 -15.628 7.809 979 H ARG 74 HN ARG 74 -19.562 -18.311 7.435 980 HA ARG 74 HA ARG 74 -17.623 -19.425 9.355 981 HE ARG 74 HE ARG 74 -14.778 -20.312 7.995 982 HB2 ARG 74 2HB ARG 74 -17.768 -19.043 6.361 983 HB3 ARG 74 3HB ARG 74 -16.198 -19.177 7.096 984 HG2 ARG 74 2HG ARG 74 -18.370 -21.269 7.467 985 HG3 ARG 74 3HG ARG 74 -17.122 -21.333 6.222 986 HD2 ARG 74 2HD ARG 74 -16.693 -21.426 9.234 987 HD3 ARG 74 3HD ARG 74 -16.526 -22.753 8.093 988 HH11 ARG 74 1HH2 ARG 74 -14.935 -23.829 7.946 989 HH12 ARG 74 2HH2 ARG 74 -13.194 -23.974 7.829 990 HH21 ARG 74 1HH1 ARG 74 -12.596 -20.583 7.871 991 HH22 ARG 74 2HH1 ARG 74 -11.926 -22.194 7.766 992 H LYS 75 HN LYS 75 -16.061 -18.290 10.336 993 HA LYS 75 HA LYS 75 -15.898 -15.400 9.704 994 HB2 LYS 75 2HB LYS 75 -14.941 -17.053 12.095 995 HB3 LYS 75 3HB LYS 75 -14.682 -15.305 11.912 996 HG2 LYS 75 2HG LYS 75 -17.075 -14.883 11.783 997 HG3 LYS 75 3HG LYS 75 -17.425 -16.617 11.882 998 HD2 LYS 75 2HD LYS 75 -16.442 -16.698 14.154 999 HD3 LYS 75 3HD LYS 75 -16.056 -14.969 14.047 1000 HE2 LYS 75 2HE LYS 75 -18.116 -15.247 15.318 1001 HE3 LYS 75 3HE LYS 75 -18.460 -14.439 13.784 1002 HZ1 LYS 75 3HZ LYS 75 -19.176 -16.581 12.909 1003 HZ2 LYS 75 1HZ LYS 75 -20.071 -16.120 14.208 1004 HZ3 LYS 75 2HZ LYS 75 -18.921 -17.294 14.372 1005 H PHE 76 HN PHE 76 -14.080 -14.364 9.092 1006 HA PHE 76 HA PHE 76 -11.561 -15.933 8.782 1007 HD1 PHE 76 1HD PHE 76 -11.321 -17.546 6.318 1008 HD2 PHE 76 2HD PHE 76 -14.898 -15.136 6.138 1009 HE1 PHE 76 1HE PHE 76 -12.545 -19.418 5.235 1010 HE2 PHE 76 2HE PHE 76 -16.114 -17.012 5.086 1011 HZ PHE 76 HZ PHE 76 -14.937 -19.160 4.626 1012 HB2 PHE 76 2HB PHE 76 -12.753 -14.111 6.650 1013 HB3 PHE 76 3HB PHE 76 -11.258 -15.014 6.526 1014 H SER 77 HN SER 77 -9.642 -14.590 8.599 1015 HA SER 77 HA SER 77 -9.932 -12.050 10.093 1016 HG SER 77 HG SER 77 -8.526 -13.201 11.975 1017 HB2 SER 77 2HB SER 77 -7.498 -13.737 9.378 1018 HB3 SER 77 3HB SER 77 -7.443 -12.247 10.327 1019 H ARG 78 HN ARG 78 -9.860 -12.934 6.866 1020 HA ARG 78 HA ARG 78 -8.580 -10.346 6.074 1021 HE ARG 78 HE ARG 78 -6.056 -13.459 3.324 1022 HB2 ARG 78 2HB ARG 78 -8.140 -13.118 4.902 1023 HB3 ARG 78 3HB ARG 78 -7.744 -11.631 4.028 1024 HG2 ARG 78 2HG ARG 78 -6.030 -11.010 5.486 1025 HG3 ARG 78 3HG ARG 78 -6.631 -12.003 6.813 1026 HD2 ARG 78 2HD ARG 78 -4.610 -12.970 5.922 1027 HD3 ARG 78 3HD ARG 78 -5.984 -14.047 5.703 1028 HH11 ARG 78 1HH2 ARG 78 -3.050 -12.448 4.867 1029 HH12 ARG 78 2HH2 ARG 78 -2.158 -12.816 3.389 1030 HH21 ARG 78 1HH1 ARG 78 -4.827 -14.037 1.683 1031 HH22 ARG 78 2HH1 ARG 78 -3.175 -13.477 1.532 1032 H SER 79 HN SER 79 -9.738 -9.141 4.709 1033 HA SER 79 HA SER 79 -12.434 -9.820 4.048 1034 HG SER 79 HG SER 79 -10.284 -6.558 2.915 1035 HB2 SER 79 2HB SER 79 -12.279 -7.741 2.597 1036 HB3 SER 79 3HB SER 79 -11.812 -7.506 4.288 1037 H ASP 80 HN ASP 80 -9.365 -10.055 2.228 1038 HA ASP 80 HA ASP 80 -10.526 -10.500 -0.343 1039 HB2 ASP 80 2HB ASP 80 -8.243 -11.502 -0.852 1040 HB3 ASP 80 3HB ASP 80 -8.342 -9.850 -0.225 1041 H HIS 81 HN HIS 81 -9.151 -12.953 2.006 1042 HA HIS 81 HA HIS 81 -10.155 -15.214 0.764 1043 HD1 HIS 81 1HD HIS 81 -7.827 -16.064 4.717 1044 HD2 HIS 81 2HD HIS 81 -7.780 -15.027 0.639 1045 HE1 HIS 81 1HE HIS 81 -5.539 -16.367 4.000 1046 HB2 HIS 81 2HB HIS 81 -9.935 -14.666 3.752 1047 HB3 HIS 81 3HB HIS 81 -10.165 -16.258 3.033 1048 H LEU 82 HN LEU 82 -11.915 -13.053 3.063 1049 HA LEU 82 HA LEU 82 -14.265 -14.680 3.235 1050 HG LEU 82 HG LEU 82 -16.284 -13.490 3.589 1051 HB2 LEU 82 2HB LEU 82 -13.839 -12.825 4.763 1052 HB3 LEU 82 3HB LEU 82 -13.949 -11.643 3.461 1053 HD11 LEU 82 1HD1 LEU 82 -16.518 -11.469 5.726 1054 HD12 LEU 82 2HD1 LEU 82 -15.633 -12.997 6.094 1055 HD13 LEU 82 3HD1 LEU 82 -17.274 -13.024 5.465 1056 HD21 LEU 82 3HD2 LEU 82 -17.556 -11.351 3.427 1057 HD22 LEU 82 1HD2 LEU 82 -16.368 -11.524 2.132 1058 HD23 LEU 82 2HD2 LEU 82 -16.035 -10.455 3.511 1059 H LYS 83 HN LYS 83 -13.408 -11.958 1.016 1060 HA LYS 83 HA LYS 83 -15.805 -12.073 -0.578 1061 HB2 LYS 83 2HB LYS 83 -14.115 -10.223 -0.545 1062 HB3 LYS 83 3HB LYS 83 -12.976 -11.251 -1.416 1063 HG2 LYS 83 2HG LYS 83 -14.480 -11.313 -3.365 1064 HG3 LYS 83 3HG LYS 83 -15.719 -10.414 -2.465 1065 HD2 LYS 83 2HD LYS 83 -14.154 -8.500 -2.227 1066 HD3 LYS 83 3HD LYS 83 -12.929 -9.366 -3.163 1067 HE2 LYS 83 2HE LYS 83 -15.702 -8.612 -4.191 1068 HE3 LYS 83 3HE LYS 83 -14.244 -7.645 -4.450 1069 HZ1 LYS 83 3HZ LYS 83 -14.682 -9.067 -6.321 1070 HZ2 LYS 83 1HZ LYS 83 -14.642 -10.413 -5.377 1071 HZ3 LYS 83 2HZ LYS 83 -13.271 -9.524 -5.599 1072 H THR 84 HN THR 84 -12.734 -13.894 -0.677 1073 HA THR 84 HA THR 84 -13.213 -15.199 -3.204 1074 HB THR 84 HB THR 84 -11.515 -15.954 -0.810 1075 HG1 THR 84 1HG THR 84 -10.861 -14.099 -1.696 1076 HG21 THR 84 3HG2 THR 84 -10.159 -17.362 -2.173 1077 HG22 THR 84 1HG2 THR 84 -11.279 -17.185 -3.556 1078 HG23 THR 84 2HG2 THR 84 -11.782 -18.032 -2.069 1079 H HIS 85 HN HIS 85 -13.658 -16.256 0.199 1080 HA HIS 85 HA HIS 85 -14.896 -18.755 -0.374 1081 HD1 HIS 85 1HD HIS 85 -15.941 -20.609 1.780 1082 HD2 HIS 85 2HD HIS 85 -17.324 -16.802 2.971 1083 HE1 HIS 85 1HE HIS 85 -18.373 -20.901 2.627 1084 HB2 HIS 85 2HB HIS 85 -14.107 -18.395 1.844 1085 HB3 HIS 85 3HB HIS 85 -14.944 -16.848 1.988 1086 H THR 86 HN THR 86 -16.157 -15.442 -0.040 1087 HA THR 86 HA THR 86 -18.920 -15.921 -0.026 1088 HB THR 86 HB THR 86 -17.372 -13.662 -1.369 1089 HG1 THR 86 1HG THR 86 -17.082 -13.851 0.854 1090 HG21 THR 86 3HG2 THR 86 -20.307 -13.711 -0.635 1091 HG22 THR 86 1HG2 THR 86 -19.618 -13.555 -2.275 1092 HG23 THR 86 2HG2 THR 86 -19.336 -12.281 -1.088 1093 H ARG 87 HN ARG 87 -16.621 -15.976 -2.805 1094 HA ARG 87 HA ARG 87 -18.641 -15.931 -4.863 1095 HE ARG 87 HE ARG 87 -13.487 -16.136 -6.687 1096 HB2 ARG 87 2HB ARG 87 -15.772 -17.002 -4.843 1097 HB3 ARG 87 3HB ARG 87 -16.814 -17.013 -6.252 1098 HG2 ARG 87 2HG ARG 87 -17.164 -14.524 -5.964 1099 HG3 ARG 87 3HG ARG 87 -15.908 -14.539 -4.735 1100 HD2 ARG 87 2HD ARG 87 -15.516 -15.474 -7.610 1101 HD3 ARG 87 3HD ARG 87 -15.203 -13.829 -7.069 1102 HH11 ARG 87 1HH2 ARG 87 -14.229 -13.058 -5.146 1103 HH12 ARG 87 2HH2 ARG 87 -12.584 -12.909 -4.542 1104 HH21 ARG 87 1HH1 ARG 87 -11.575 -15.924 -5.860 1105 HH22 ARG 87 2HH1 ARG 87 -11.163 -14.608 -4.752 1106 H THR 88 HN THR 88 -17.193 -18.608 -2.926 1107 HA THR 88 HA THR 88 -18.319 -20.821 -4.106 1108 HB THR 88 HB THR 88 -18.638 -20.446 -1.116 1109 HG1 THR 88 1HG THR 88 -16.793 -19.665 -1.277 1110 HG21 THR 88 3HG2 THR 88 -17.820 -22.738 -0.966 1111 HG22 THR 88 1HG2 THR 88 -17.670 -22.812 -2.734 1112 HG23 THR 88 2HG2 THR 88 -19.273 -22.640 -1.982 1113 H HIS 89 HN HIS 89 -20.057 -18.477 -1.999 1114 HA HIS 89 HA HIS 89 -22.584 -20.008 -2.240 1115 HD1 HIS 89 1HD HIS 89 -23.172 -20.988 -0.067 1116 HD2 HIS 89 2HD HIS 89 -20.812 -17.857 1.474 1117 HE1 HIS 89 1HE HIS 89 -22.303 -21.759 2.225 1118 HB2 HIS 89 2HB HIS 89 -21.867 -17.382 -0.866 1119 HB3 HIS 89 3HB HIS 89 -23.486 -18.083 -0.874 1120 H THR 90 HN THR 90 -20.891 -17.489 -3.891 1121 HA THR 90 HA THR 90 -23.336 -16.303 -5.069 1122 HB THR 90 HB THR 90 -20.460 -15.670 -5.807 1123 HG1 THR 90 1HG THR 90 -20.749 -15.503 -3.488 1124 HG21 THR 90 3HG2 THR 90 -22.100 -14.496 -7.210 1125 HG22 THR 90 1HG2 THR 90 -21.314 -13.365 -6.108 1126 HG23 THR 90 2HG2 THR 90 -22.959 -13.936 -5.756 1127 H GLY 91 HN GLY 91 -21.531 -19.065 -5.647 1128 HA2 GLY 91 2HA GLY 91 -21.256 -20.460 -7.473 1129 HA3 GLY 91 3HA GLY 91 -22.636 -19.613 -8.196 1130 H GLU 92 HN GLU 92 -19.732 -17.809 -7.343 1131 HA GLU 92 HA GLU 92 -19.429 -17.128 -10.211 1132 HB2 GLU 92 2HB GLU 92 -19.655 -15.425 -8.256 1133 HB3 GLU 92 3HB GLU 92 -17.986 -15.844 -7.871 1134 HG2 GLU 92 2HG GLU 92 -17.518 -15.298 -10.400 1135 HG3 GLU 92 3HG GLU 92 -19.101 -14.531 -10.373 1136 H LYS 93 HN LYS 93 -17.669 -17.603 -11.437 1137 HA LYS 93 HA LYS 93 -15.162 -18.463 -10.151 1138 HB2 LYS 93 2HB LYS 93 -16.666 -20.228 -12.146 1139 HB3 LYS 93 3HB LYS 93 -14.983 -20.452 -11.670 1140 HG2 LYS 93 2HG LYS 93 -15.756 -20.710 -9.285 1141 HG3 LYS 93 3HG LYS 93 -17.428 -20.687 -9.877 1142 HD2 LYS 93 2HD LYS 93 -16.927 -22.687 -11.279 1143 HD3 LYS 93 3HD LYS 93 -15.271 -22.698 -10.625 1144 HE2 LYS 93 2HE LYS 93 -16.194 -22.909 -8.323 1145 HE3 LYS 93 3HE LYS 93 -17.830 -22.982 -9.000 1146 HZ1 LYS 93 3HZ LYS 93 -15.660 -24.890 -9.583 1147 HZ2 LYS 93 1HZ LYS 93 -17.190 -24.969 -10.182 1148 HZ3 LYS 93 2HZ LYS 93 -16.929 -25.171 -8.568 1149 HA PRO 94 HA PRO 94 -14.957 -15.664 -13.795 1150 HB2 PRO 94 2HB PRO 94 -13.148 -13.834 -12.819 1151 HB3 PRO 94 3HB PRO 94 -14.870 -13.858 -12.344 1152 HG2 PRO 94 2HG PRO 94 -12.518 -15.042 -10.853 1153 HG3 PRO 94 3HG PRO 94 -13.825 -13.998 -10.209 1154 HD2 PRO 94 2HD PRO 94 -13.874 -16.704 -9.993 1155 HD3 PRO 94 3HD PRO 94 -15.376 -15.773 -10.236 1156 H PHE 95 HN PHE 95 -12.347 -17.370 -12.095 1157 HA PHE 95 HA PHE 95 -10.305 -16.668 -14.107 1158 HD1 PHE 95 2HD PHE 95 -8.160 -15.752 -12.730 1159 HD2 PHE 95 1HD PHE 95 -11.006 -17.488 -10.015 1160 HE1 PHE 95 2HE PHE 95 -7.828 -13.847 -11.174 1161 HE2 PHE 95 1HE PHE 95 -10.635 -15.594 -8.425 1162 HZ PHE 95 HZ PHE 95 -9.052 -13.785 -9.006 1163 HB2 PHE 95 2HB PHE 95 -10.241 -18.745 -11.872 1164 HB3 PHE 95 3HB PHE 95 -8.874 -18.183 -12.830 1165 H SER 96 HN SER 96 -11.476 -17.397 -16.017 1166 HA SER 96 HA SER 96 -11.902 -20.299 -16.360 1167 HG SER 96 HG SER 96 -13.524 -17.785 -16.596 1168 HB2 SER 96 2HB SER 96 -12.082 -18.050 -18.405 1169 HB3 SER 96 3HB SER 96 -12.729 -19.691 -18.568 1170 H CYS 97 HN CYS 97 -10.634 -21.704 -17.508 1171 HA CYS 97 HA CYS 97 -7.902 -20.991 -18.066 1172 HB2 CYS 97 2HB CYS 97 -8.874 -23.319 -17.487 1173 HB3 CYS 97 3HB CYS 97 -9.382 -23.389 -19.170 1174 H ARG 98 HN ARG 98 -6.839 -21.311 -20.145 1175 HA ARG 98 HA ARG 98 -8.530 -20.403 -22.424 1176 HE ARG 98 HE ARG 98 -7.125 -20.922 -25.347 1177 HB2 ARG 98 2HB ARG 98 -7.037 -18.612 -21.749 1178 HB3 ARG 98 3HB ARG 98 -5.634 -19.652 -21.752 1179 HG2 ARG 98 2HG ARG 98 -5.843 -18.057 -23.677 1180 HG3 ARG 98 3HG ARG 98 -5.584 -19.721 -24.166 1181 HD2 ARG 98 2HD ARG 98 -8.384 -18.555 -24.039 1182 HD3 ARG 98 3HD ARG 98 -7.331 -18.261 -25.432 1183 HH11 ARG 98 1HH2 ARG 98 -10.148 -19.145 -24.985 1184 HH12 ARG 98 2HH2 ARG 98 -11.070 -20.542 -25.497 1185 HH21 ARG 98 1HH1 ARG 98 -8.277 -22.520 -25.946 1186 HH22 ARG 98 2HH1 ARG 98 -10.036 -22.409 -26.136 1187 H TRP 99 HN TRP 99 -5.115 -21.402 -22.357 1188 HA TRP 99 HA TRP 99 -4.012 -23.156 -23.361 1189 HD1 TRP 99 1HD TRP 99 -4.752 -22.957 -20.197 1190 HE1 TRP 99 1HE TRP 99 -2.558 -23.502 -19.010 1191 HE3 TRP 99 3HE TRP 99 -3.392 -27.136 -22.853 1192 HZ2 TRP 99 2HZ TRP 99 -0.366 -25.340 -19.342 1193 HZ3 TRP 99 3HZ TRP 99 -1.194 -28.187 -22.463 1194 HH2 TRP 99 2HH TRP 99 0.342 -27.290 -20.732 1195 HB2 TRP 99 2HB TRP 99 -6.344 -24.323 -21.851 1196 HB3 TRP 99 3HB TRP 99 -5.589 -25.433 -22.941 1197 HA PRO 100 HA PRO 100 -4.951 -24.113 -27.543 1198 HB2 PRO 100 2HB PRO 100 -5.291 -27.062 -26.883 1199 HB3 PRO 100 3HB PRO 100 -4.360 -26.313 -28.220 1200 HG2 PRO 100 2HG PRO 100 -3.038 -27.156 -26.037 1201 HG3 PRO 100 3HG PRO 100 -2.672 -25.520 -26.681 1202 HD2 PRO 100 2HD PRO 100 -4.496 -26.297 -24.418 1203 HD3 PRO 100 3HD PRO 100 -3.237 -25.002 -24.428 1204 H SER 101 HN SER 101 -7.137 -25.827 -25.280 1205 HA SER 101 HA SER 101 -9.479 -24.704 -26.528 1206 HG SER 101 HG SER 101 -9.366 -28.072 -25.840 1207 HB2 SER 101 2HB SER 101 -10.541 -26.763 -27.313 1208 HB3 SER 101 3HB SER 101 -9.017 -26.545 -28.182 1209 H CYS 102 HN CYS 102 -9.330 -24.077 -24.154 1210 HA CYS 102 HA CYS 102 -10.915 -26.059 -22.586 1211 HB2 CYS 102 2HB CYS 102 -8.495 -26.149 -21.854 1212 HB3 CYS 102 3HB CYS 102 -8.612 -24.430 -21.417 1213 H GLN 103 HN GLN 103 -12.060 -25.091 -20.767 1214 HA GLN 103 HA GLN 103 -12.294 -22.182 -20.644 1215 HB2 GLN 103 2HB GLN 103 -14.601 -23.927 -21.611 1216 HB3 GLN 103 3HB GLN 103 -14.895 -22.387 -20.822 1217 HG2 GLN 103 2HG GLN 103 -13.397 -22.698 -23.436 1218 HG3 GLN 103 3HG GLN 103 -15.051 -22.162 -23.213 1219 HE21 GLN 103 1HE2 GLN 103 -11.644 -21.243 -22.625 1220 HE22 GLN 103 2HE2 GLN 103 -12.037 -19.529 -22.361 1221 H LYS 104 HN LYS 104 -11.534 -24.663 -18.979 1222 HA LYS 104 HA LYS 104 -13.593 -25.116 -16.990 1223 HB2 LYS 104 2HB LYS 104 -10.634 -25.709 -17.232 1224 HB3 LYS 104 3HB LYS 104 -11.326 -25.654 -15.629 1225 HG2 LYS 104 2HG LYS 104 -11.584 -27.875 -16.080 1226 HG3 LYS 104 3HG LYS 104 -13.171 -27.232 -16.452 1227 HD2 LYS 104 2HD LYS 104 -12.779 -28.692 -18.230 1228 HD3 LYS 104 3HD LYS 104 -12.306 -27.137 -18.933 1229 HE2 LYS 104 2HE LYS 104 -9.920 -27.664 -18.225 1230 HE3 LYS 104 3HE LYS 104 -10.482 -29.283 -17.741 1231 HZ1 LYS 104 3HZ LYS 104 -10.487 -28.059 -20.399 1232 HZ2 LYS 104 1HZ LYS 104 -11.229 -29.516 -20.094 1233 HZ3 LYS 104 2HZ LYS 104 -9.586 -29.341 -19.925 1234 H LYS 105 HN LYS 105 -14.218 -23.920 -15.304 1235 HA LYS 105 HA LYS 105 -12.805 -21.330 -14.947 1236 HB2 LYS 105 2HB LYS 105 -15.675 -22.051 -14.178 1237 HB3 LYS 105 3HB LYS 105 -14.923 -20.451 -14.257 1238 HG2 LYS 105 2HG LYS 105 -14.447 -21.032 -16.742 1239 HG3 LYS 105 3HG LYS 105 -15.677 -22.293 -16.530 1240 HD2 LYS 105 2HD LYS 105 -17.310 -20.519 -15.843 1241 HD3 LYS 105 3HD LYS 105 -16.077 -19.294 -16.175 1242 HE2 LYS 105 2HE LYS 105 -17.348 -21.227 -18.164 1243 HE3 LYS 105 3HE LYS 105 -17.551 -19.468 -18.098 1244 HZ1 LYS 105 3HZ LYS 105 -15.993 -19.989 -19.798 1245 HZ2 LYS 105 1HZ LYS 105 -15.105 -20.952 -18.792 1246 HZ3 LYS 105 2HZ LYS 105 -15.133 -19.328 -18.543 1247 H PHE 106 HN PHE 106 -12.149 -20.562 -13.020 1248 HA PHE 106 HA PHE 106 -12.714 -22.223 -10.588 1249 HD1 PHE 106 1HD PHE 106 -10.815 -24.270 -9.934 1250 HD2 PHE 106 2HD PHE 106 -9.727 -22.047 -13.465 1251 HE1 PHE 106 1HE PHE 106 -10.484 -26.393 -11.178 1252 HE2 PHE 106 2HE PHE 106 -9.421 -24.158 -14.710 1253 HZ PHE 106 HZ PHE 106 -9.841 -26.336 -13.577 1254 HB2 PHE 106 2HB PHE 106 -10.062 -20.900 -11.337 1255 HB3 PHE 106 3HB PHE 106 -10.399 -21.792 -9.859 1256 H ALA 107 HN ALA 107 -12.426 -21.040 -8.539 1257 HA ALA 107 HA ALA 107 -13.397 -18.247 -8.870 1258 HB1 ALA 107 1HB ALA 107 -13.449 -20.119 -6.450 1259 HB2 ALA 107 2HB ALA 107 -14.168 -18.496 -6.522 1260 HB3 ALA 107 3HB ALA 107 -14.815 -19.785 -7.534 1261 H ARG 108 HN ARG 108 -10.481 -19.811 -8.425 1262 HA ARG 108 HA ARG 108 -9.350 -17.405 -7.063 1263 HE ARG 108 HE ARG 108 -7.574 -21.135 -4.499 1264 HB2 ARG 108 2HB ARG 108 -8.696 -20.310 -6.525 1265 HB3 ARG 108 3HB ARG 108 -7.670 -18.987 -5.983 1266 HG2 ARG 108 2HG ARG 108 -9.208 -18.236 -4.404 1267 HG3 ARG 108 3HG ARG 108 -10.602 -18.964 -5.205 1268 HD2 ARG 108 2HD ARG 108 -10.034 -20.119 -3.106 1269 HD3 ARG 108 3HD ARG 108 -10.010 -21.169 -4.513 1270 HH11 ARG 108 2HH1 ARG 108 -8.896 -19.730 -1.496 1271 HH12 ARG 108 1HH1 ARG 108 -7.267 -19.674 -0.840 1272 HH21 ARG 108 1HH2 ARG 108 -5.688 -20.908 -3.569 1273 HH22 ARG 108 2HH2 ARG 108 -5.582 -20.370 -1.877 1274 H SER 109 HN SER 109 -7.494 -16.620 -7.941 1275 HA SER 109 HA SER 109 -6.823 -17.297 -10.612 1276 HG SER 109 HG SER 109 -5.906 -14.496 -8.171 1277 HB2 SER 109 2HB SER 109 -4.644 -15.935 -9.909 1278 HB3 SER 109 3HB SER 109 -6.192 -15.139 -10.094 1279 H ASP 110 HN ASP 110 -5.412 -18.305 -7.480 1280 HA ASP 110 HA ASP 110 -3.110 -19.633 -8.662 1281 HB2 ASP 110 2HB ASP 110 -2.908 -20.691 -6.413 1282 HB3 ASP 110 3HB ASP 110 -2.894 -18.940 -6.431 1283 H GLU 111 HN GLU 111 -6.474 -20.585 -7.856 1284 HA GLU 111 HA GLU 111 -6.156 -23.432 -8.197 1285 HB2 GLU 111 2HB GLU 111 -8.507 -21.536 -8.460 1286 HB3 GLU 111 3HB GLU 111 -8.640 -23.206 -8.953 1287 HG2 GLU 111 2HG GLU 111 -8.127 -24.010 -6.748 1288 HG3 GLU 111 3HG GLU 111 -7.869 -22.368 -6.155 1289 H LEU 112 HN LEU 112 -6.908 -20.728 -10.457 1290 HA LEU 112 HA LEU 112 -7.077 -22.400 -12.797 1291 HG LEU 112 HG LEU 112 -5.616 -20.274 -14.680 1292 HB2 LEU 112 2HB LEU 112 -7.994 -20.168 -12.772 1293 HB3 LEU 112 3HB LEU 112 -6.407 -19.441 -12.476 1294 HD11 LEU 112 1HD1 LEU 112 -7.167 -22.267 -14.885 1295 HD12 LEU 112 2HD1 LEU 112 -7.105 -21.238 -16.270 1296 HD13 LEU 112 3HD1 LEU 112 -8.505 -21.124 -15.190 1297 HD21 LEU 112 3HD2 LEU 112 -6.610 -18.016 -14.509 1298 HD22 LEU 112 1HD2 LEU 112 -8.190 -18.704 -14.971 1299 HD23 LEU 112 2HD2 LEU 112 -6.833 -18.766 -16.101 1300 H VAL 113 HN VAL 113 -4.339 -20.650 -11.219 1301 HA VAL 113 HA VAL 113 -2.320 -21.237 -13.166 1302 HB VAL 113 HB VAL 113 -2.142 -20.928 -10.135 1303 HG11 VAL 113 1HG1 VAL 113 0.124 -21.047 -12.148 1304 HG12 VAL 113 2HG1 VAL 113 0.281 -20.479 -10.471 1305 HG13 VAL 113 3HG1 VAL 113 -0.161 -22.156 -10.786 1306 HG21 VAL 113 3HG2 VAL 113 -1.439 -18.696 -10.473 1307 HG22 VAL 113 1HG2 VAL 113 -1.181 -18.950 -12.210 1308 HG23 VAL 113 2HG2 VAL 113 -2.811 -18.875 -11.582 1309 H ARG 114 HN ARG 114 -3.385 -23.061 -10.249 1310 HA ARG 114 HA ARG 114 -1.667 -25.283 -10.599 1311 HE ARG 114 HE ARG 114 -2.095 -26.147 -6.797 1312 HB2 ARG 114 2HB ARG 114 -2.984 -24.807 -8.558 1313 HB3 ARG 114 3HB ARG 114 -4.480 -25.224 -9.396 1314 HG2 ARG 114 2HG ARG 114 -3.723 -27.538 -9.702 1315 HG3 ARG 114 3HG ARG 114 -2.141 -27.155 -9.009 1316 HD2 ARG 114 2HD ARG 114 -4.777 -26.874 -7.505 1317 HD3 ARG 114 3HD ARG 114 -3.754 -28.321 -7.459 1318 HH11 ARG 114 1HH1 ARG 114 -4.888 -27.748 -5.349 1319 HH12 ARG 114 2HH1 ARG 114 -4.342 -27.460 -3.728 1320 HH21 ARG 114 1HH2 ARG 114 -1.492 -25.701 -4.671 1321 HH22 ARG 114 2HH2 ARG 114 -2.580 -26.193 -3.372 1322 H HIS 115 HN HIS 115 -5.114 -24.890 -11.683 1323 HA HIS 115 HA HIS 115 -5.405 -27.250 -13.073 1324 HD1 HIS 115 1HD HIS 115 -7.819 -28.077 -14.221 1325 HD2 HIS 115 2HD HIS 115 -6.910 -24.645 -16.478 1326 HE1 HIS 115 1HE HIS 115 -8.633 -28.517 -16.604 1327 HB2 HIS 115 2HB HIS 115 -7.211 -25.636 -12.839 1328 HB3 HIS 115 3HB HIS 115 -6.394 -24.479 -13.887 1329 H HIS 116 HN HIS 116 -3.997 -24.210 -14.412 1330 HA HIS 116 HA HIS 116 -3.375 -25.214 -16.986 1331 HD1 HIS 116 1HD HIS 116 -5.032 -23.426 -17.725 1332 HD2 HIS 116 2HD HIS 116 -2.279 -20.614 -16.134 1333 HE1 HIS 116 1HE HIS 116 -5.826 -21.178 -18.391 1334 HB2 HIS 116 2HB HIS 116 -1.969 -23.146 -15.251 1335 HB3 HIS 116 3HB HIS 116 -1.526 -23.480 -16.907 1336 H ASN 117 HN ASN 117 -1.587 -25.518 -13.860 1337 HA ASN 117 HA ASN 117 0.817 -26.643 -15.100 1338 HB2 ASN 117 2HB ASN 117 1.710 -26.470 -13.052 1339 HB3 ASN 117 3HB ASN 117 0.326 -25.494 -12.667 1340 HD21 ASN 117 1HD2 ASN 117 0.986 -29.115 -12.671 1341 HD22 ASN 117 2HD2 ASN 117 0.466 -29.230 -10.970 1342 H MET 118 HN MET 118 -2.319 -27.864 -14.307 1343 HA MET 118 HA MET 118 -1.332 -30.690 -14.325 1344 HB2 MET 118 2HB MET 118 -2.880 -29.712 -12.491 1345 HB3 MET 118 3HB MET 118 -4.157 -29.742 -13.705 1346 HG2 MET 118 2HG MET 118 -3.843 -32.206 -13.923 1347 HG3 MET 118 3HG MET 118 -2.552 -32.145 -12.725 1348 HE1 MET 118 3HE MET 118 -2.888 -31.834 -10.170 1349 HE2 MET 118 1HE MET 118 -3.633 -30.233 -10.400 1350 HE3 MET 118 2HE MET 118 -4.437 -31.452 -9.388 1351 H HIS 119 HN HIS 119 -2.263 -28.372 -16.505 1352 HA HIS 119 HA HIS 119 -4.410 -29.653 -17.894 1353 HD1 HIS 119 1HD HIS 119 -4.684 -29.242 -20.873 1354 HD2 HIS 119 2HD HIS 119 -5.592 -26.093 -18.251 1355 HE1 HIS 119 1HE HIS 119 -7.112 -28.454 -21.425 1356 HB2 HIS 119 2HB HIS 119 -3.371 -27.178 -17.915 1357 HB3 HIS 119 3HB HIS 119 -2.562 -27.799 -19.351 Start of MODEL 17 1 H5 DC 124 5H C 124 -3.945 -31.433 -5.035 2 H6 DC 124 6H C 124 -5.863 -31.145 -6.530 3 H5' DC 124 H5' C 124 -9.075 -32.546 -9.823 4 H5'' DC 124 H5" C 124 -7.580 -32.338 -8.887 5 H4' DC 124 H4' C 124 -10.395 -32.398 -7.725 6 H3' DC 124 H3' C 124 -9.078 -30.237 -8.981 7 H2' DC 124 H2' C 124 -7.356 -30.051 -7.426 8 H2'' DC 124 H2" C 124 -8.550 -29.026 -6.595 9 H1' DC 124 H1' C 124 -9.376 -30.833 -5.253 10 H41 DC 124 1H4 C 124 -4.453 -32.258 -1.497 11 H42 DC 124 2H4 C 124 -3.300 -31.940 -2.778 12 H8 DG 125 8H G 125 -9.182 -26.972 -5.670 13 H1 DG 125 1H G 125 -6.425 -29.004 -0.214 14 H5' DG 125 H5' G 125 -12.921 -29.622 -6.428 15 H5'' DG 125 H5" G 125 -13.996 -28.276 -6.856 16 H4' DG 125 H4' G 125 -13.829 -28.570 -4.392 17 H3' DG 125 H3' G 125 -13.421 -26.098 -5.685 18 H2' DG 125 H2' G 125 -11.142 -26.020 -5.307 19 H2'' DG 125 H2" G 125 -11.652 -25.279 -3.766 20 H1' DG 125 H1' G 125 -11.554 -27.392 -2.599 21 H21 DG 125 1H2 G 125 -7.930 -29.341 1.307 22 H22 DG 125 2H2 G 125 -9.640 -29.092 0.989 23 H5 DC 126 5H C 126 -8.058 -24.010 -4.332 24 H6 DC 126 6H C 126 -10.028 -23.535 -2.947 25 H5' DC 126 H5' C 126 -13.584 -26.165 -1.203 26 H5'' DC 126 H5" C 126 -14.639 -24.890 -0.571 27 H4' DC 126 H4' C 126 -12.775 -25.155 0.939 28 H3' DC 126 H3' C 126 -13.318 -22.643 -0.231 29 H2' DC 126 H2' C 126 -11.440 -22.748 -1.677 30 H2'' DC 126 H2" C 126 -10.689 -21.913 -0.280 31 H1' DC 126 H1' C 126 -10.083 -24.106 0.754 32 H41 DC 126 1H4 C 126 -5.050 -25.544 -2.863 33 H42 DC 126 2H4 C 126 -5.872 -25.072 -4.333 34 H8 DG 127 8H G 127 -9.670 -21.808 1.611 35 H1 DG 127 1H G 127 -3.413 -22.887 0.664 36 H5' DG 127 H5' G 127 -12.161 -23.633 3.936 37 H5'' DG 127 H5" G 127 -12.583 -22.558 5.277 38 H4' DG 127 H4' G 127 -10.530 -23.733 5.817 39 H3' DG 127 H3' G 127 -10.692 -20.921 5.747 40 H2' DG 127 H2' G 127 -9.213 -20.534 4.055 41 H2'' DG 127 H2" G 127 -7.958 -20.790 5.315 42 H1' DG 127 H1' G 127 -7.630 -23.021 4.702 43 H21 DG 127 1H2 G 127 -2.438 -23.303 2.544 44 H22 DG 127 2H2 G 127 -3.294 -23.193 4.071 45 H8 DG 128 8H G 128 -7.443 -18.711 4.185 46 H1 DG 128 1H G 128 -2.606 -19.701 0.049 47 H5' DG 128 H5' G 128 -6.750 -21.907 7.697 48 H5'' DG 128 H5" G 128 -6.591 -20.992 9.210 49 H4' DG 128 H4' G 128 -4.562 -20.661 8.045 50 H3' DG 128 H3' G 128 -6.239 -18.446 8.579 51 H2' DG 128 H2' G 128 -6.742 -18.099 6.288 52 H2'' DG 128 H2" G 128 -5.263 -17.088 6.424 53 H1' DG 128 H1' G 128 -3.857 -18.965 5.746 54 H21 DG 128 1H2 G 128 -0.749 -19.960 1.131 55 H22 DG 128 2H2 G 128 -0.704 -20.010 2.883 56 H8 DG 129 8H G 129 -3.407 -16.271 5.591 57 H1 DG 129 1H G 129 -1.041 -16.534 -0.363 58 H5' DG 129 H5' G 129 -1.564 -18.402 8.641 59 H5'' DG 129 H5" G 129 -0.937 -17.404 9.945 60 H4' DG 129 H4' G 129 0.664 -17.241 8.166 61 H3' DG 129 H3' G 129 -0.765 -14.811 8.724 62 H2' DG 129 H2' G 129 -1.898 -14.867 6.727 63 H2'' DG 129 H2" G 129 -0.454 -14.053 6.114 64 H1' DG 129 H1' G 129 0.489 -16.163 5.308 65 H21 DG 129 1H2 G 129 1.119 -16.448 -0.317 66 H22 DG 129 2H2 G 129 2.013 -16.378 1.194 67 H8 DG 130 8H G 130 0.533 -13.395 4.231 68 H1 DG 130 1H G 130 -0.555 -12.891 -2.061 69 H5' DG 130 H5' G 130 2.986 -15.545 5.511 70 H5'' DG 130 H5" G 130 4.033 -14.646 6.615 71 H4' DG 130 H4' G 130 5.098 -14.444 4.551 72 H3' DG 130 H3' G 130 4.163 -12.162 5.850 73 H2' DG 130 H2' G 130 2.309 -11.762 4.528 74 H2'' DG 130 H2" G 130 3.478 -10.921 3.512 75 H1' DG 130 H1' G 130 3.649 -12.697 1.982 76 H21 DG 130 1H2 G 130 1.268 -12.377 -3.114 77 H22 DG 130 2H2 G 130 2.777 -12.084 -2.263 78 H8 DG 131 8H G 131 2.599 -9.530 2.372 79 H1 DG 131 1H G 131 -1.898 -9.393 -2.173 80 H5' DG 131 H5' G 131 5.979 -11.789 1.664 81 H5'' DG 131 H5" G 131 7.391 -10.722 1.793 82 H4' DG 131 H4' G 131 6.581 -10.397 -0.406 83 H3' DG 131 H3' G 131 6.602 -8.237 1.415 84 H2' DG 131 H2' G 131 4.310 -8.156 1.672 85 H2'' DG 131 H2" G 131 4.423 -7.101 0.255 86 H1' DG 131 H1' G 131 3.880 -8.890 -1.255 87 H21 DG 131 1H2 G 131 -1.040 -8.976 -4.110 88 H22 DG 131 2H2 G 131 0.684 -8.699 -4.316 89 H5 DC 132 5H C 132 1.268 -6.496 1.620 90 H6 DC 132 6H C 132 2.807 -5.811 -0.171 91 H5' DC 132 H5' C 132 5.116 -7.596 -2.819 92 H5'' DC 132 H5" C 132 6.249 -6.445 -3.556 93 H4' DC 132 H4' C 132 4.266 -6.008 -4.679 94 H3' DC 132 H3' C 132 5.285 -4.007 -2.945 95 H2' DC 132 H2' C 132 3.620 -4.268 -1.367 96 H2'' DC 132 H2" C 132 2.777 -3.125 -2.406 97 H1' DC 132 H1' C 132 1.614 -4.884 -3.593 98 H41 DC 132 1H4 C 132 -2.344 -6.684 1.042 99 H42 DC 132 2H4 C 132 -1.027 -6.896 2.174 100 H8 DG 133 8H G 133 1.225 -2.061 -3.216 101 H1 DG 133 1H G 133 -4.962 -2.738 -1.579 102 H5' DG 133 H5' G 133 2.588 -3.319 -6.564 103 H5'' DG 133 H5" G 133 3.298 -1.943 -7.435 104 H4' DG 133 H4' G 133 0.998 -2.043 -7.972 105 H3' DG 133 H3' G 133 2.084 0.270 -6.896 106 H2' DG 133 H2' G 133 1.222 -0.166 -4.741 107 H2'' DG 133 H2" G 133 -0.064 0.849 -5.352 108 H1' DG 133 H1' G 133 -1.448 -1.133 -5.936 109 H21 DG 133 1H2 G 133 -6.239 -2.320 -3.308 110 H22 DG 133 2H2 G 133 -5.592 -1.740 -4.825 111 H5' DT 134 H5' T 134 -2.306 -0.141 -7.371 112 H5'' DT 134 H5" T 134 -2.801 1.124 -8.467 113 H4' DT 134 H4' T 134 -4.635 0.881 -7.114 114 H3' DT 134 H3' T 134 -3.171 3.152 -7.253 115 H2' DT 134 H2' T 134 -2.258 3.104 -5.199 116 H2'' DT 134 H2" T 134 -3.719 4.074 -4.867 117 H1' DT 134 H1' T 134 -5.031 2.081 -4.296 118 H3 DT 134 3H T 134 -4.151 0.460 -0.110 119 H71 DT 134 1H7 T 134 0.564 2.153 -2.222 120 H72 DT 134 2H7 T 134 0.394 1.575 -0.549 121 H73 DT 134 3H7 T 134 0.600 0.410 -1.876 122 H6 DT 134 6H T 134 -1.368 1.773 -3.857 123 H5 DC 135 5H C 135 -3.626 4.619 -2.730 124 H6 DC 135 6H C 135 -5.419 5.202 -4.273 125 H5' DC 135 H5' C 135 -7.649 3.635 -7.631 126 H5'' DC 135 H5" C 135 -8.394 5.146 -8.191 127 H4' DC 135 H4' C 135 -9.705 4.174 -6.207 128 H3' DC 135 H3' C 135 -8.638 6.826 -6.495 129 H2' DC 135 H2' C 135 -7.031 6.616 -4.858 130 H2'' DC 135 H2" C 135 -8.328 7.170 -3.810 131 H1' DC 135 H1' C 135 -9.032 4.868 -3.370 132 H41 DC 135 1H4 C 135 -4.310 3.380 0.611 133 H42 DC 135 2H4 C 135 -3.115 3.900 -0.538 134 H5' DT 136 H5' T 136 -11.212 5.373 -2.610 135 H5'' DT 136 H5" T 136 -12.521 6.517 -2.868 136 H4' DT 136 H4' T 136 -12.402 6.046 -0.565 137 H3' DT 136 H3' T 136 -12.324 8.591 -1.736 138 H2' DT 136 H2' T 136 -10.117 8.959 -1.379 139 H2'' DT 136 H2" T 136 -10.623 9.572 0.158 140 H1' DT 136 H1' T 136 -10.164 7.543 1.345 141 H3 DT 136 3H T 136 -5.863 6.527 1.812 142 H71 DT 136 1H7 T 136 -4.750 8.151 -2.453 143 H72 DT 136 2H7 T 136 -6.313 8.559 -3.195 144 H73 DT 136 3H7 T 136 -5.562 9.676 -2.029 145 H6 DT 136 6H T 136 -8.394 8.181 -1.906 146 H8 DG 137 8H G 137 -9.667 10.328 1.756 147 H1 DG 137 1H G 137 -3.732 9.424 3.934 148 H5' DG 137 H5' G 137 -12.070 7.545 2.404 149 H5'' DG 137 H5" G 137 -13.568 8.233 3.020 150 H4' DG 137 H4' G 137 -12.386 7.929 4.959 151 H3' DG 137 H3' G 137 -12.932 10.541 4.169 152 H2' DG 137 H2' G 137 -10.850 11.065 3.342 153 H2'' DG 137 H2" G 137 -10.575 11.562 4.987 154 H1' DG 137 H1' G 137 -9.352 9.583 5.527 155 H21 DG 137 1H2 G 137 -3.781 8.861 6.049 156 H22 DG 137 2H2 G 137 -5.290 8.787 6.946 157 H5 DC 138 5H C 138 -8.585 12.954 4.020 158 H6 DC 138 6H C 138 -9.156 12.176 6.266 159 H5' DC 138 H5' C 138 -10.262 9.323 7.523 160 H5'' DC 138 H5" C 138 -11.246 9.719 8.935 161 H4' DC 138 H4' C 138 -9.109 9.535 9.827 162 H3' DC 138 H3' C 138 -10.347 12.025 9.940 163 H2' DC 138 H2' C 138 -9.220 13.053 8.221 164 H2'' DC 138 H2" C 138 -8.064 13.467 9.462 165 H1' DC 138 H1' C 138 -6.592 11.695 8.930 166 H41 DC 138 1H4 C 138 -5.077 13.337 3.004 167 H42 DC 138 2H4 C 138 -6.762 13.407 2.528 168 H8 DG 139 8H G 139 -6.391 14.625 9.636 169 H1 DG 139 1H G 139 -2.102 15.927 5.063 170 H5' DG 139 H5' G 139 -6.112 11.065 11.190 171 H5'' DG 139 H5" G 139 -6.212 11.408 12.921 172 H4' DG 139 H4' G 139 -3.924 11.483 12.415 173 H3' DG 139 H3' G 139 -5.168 13.708 13.506 174 H2' DG 139 H2' G 139 -5.375 14.931 11.564 175 H2'' DG 139 H2" G 139 -3.779 15.526 12.001 176 H1' DG 139 H1' G 139 -2.657 14.058 10.552 177 H21 DG 139 1H2 G 139 -0.117 15.346 5.684 178 H22 DG 139 2H2 G 139 0.198 14.709 7.291 179 H5 DC 140 5H C 140 -4.109 17.688 10.550 180 H6 DC 140 6H C 140 -2.079 16.860 11.628 181 H5' DC 140 H5' C 140 -0.834 13.470 12.063 182 H5'' DC 140 H5" C 140 0.097 13.741 13.541 183 H4' DC 140 H4' C 140 1.524 14.160 11.683 184 H3' DC 140 H3' C 140 1.248 16.004 13.703 185 H2' DC 140 H2' C 140 -0.257 17.430 12.610 186 H2'' DC 140 H2" C 140 1.260 18.182 12.055 187 H1' DC 140 H1' C 140 1.272 17.025 9.997 188 H41 DC 140 1H4 C 140 -4.018 18.945 7.118 189 H42 DC 140 2H4 C 140 -5.004 18.481 8.489 190 H8 DG 141 8H G 141 -3.442 21.511 0.798 191 H1 DG 141 1H G 141 -1.586 18.792 6.315 192 H5' DG 141 H5' G 141 -0.773 24.573 -0.749 193 H5'' DG 141 H5" G 141 -1.004 23.840 -2.342 194 H4' DG 141 H4' G 141 0.879 22.900 -0.997 195 H3' DG 141 H3' G 141 -0.839 21.423 -2.599 196 H2' DG 141 H2' G 141 -2.159 20.603 -0.865 197 H2'' DG 141 H2" G 141 -0.961 19.302 -0.849 198 H1' DG 141 H1' G 141 0.271 20.308 0.939 199 H21 DG 141 1H2 G 141 0.516 18.265 6.254 200 H22 DG 141 2H2 G 141 1.479 18.474 4.799 201 H5 DC 142 5H C 142 -2.619 17.710 0.364 202 H6 DC 142 6H C 142 -0.254 17.285 -0.046 203 H5' DC 142 H5' C 142 2.151 19.640 0.446 204 H5'' DC 142 H5" C 142 3.342 19.220 -0.782 205 H4' DC 142 H4' C 142 3.996 17.951 1.002 206 H3' DC 142 H3' C 142 3.149 16.581 -1.254 207 H2' DC 142 H2' C 142 1.124 15.891 -0.513 208 H2'' DC 142 H2" C 142 1.984 14.575 0.194 209 H1' DC 142 H1' C 142 1.926 15.502 2.386 210 H41 DC 142 1H4 C 142 -4.143 16.885 3.595 211 H42 DC 142 2H4 C 142 -4.331 17.677 2.043 212 H8 DG 143 8H G 143 1.589 13.008 1.297 213 H1 DG 143 1H G 143 -3.686 12.520 4.895 214 H5' DG 143 H5' G 143 4.012 15.313 3.305 215 H5'' DG 143 H5" G 143 5.569 14.599 2.866 216 H4' DG 143 H4' G 143 4.973 13.500 4.850 217 H3' DG 143 H3' G 143 5.303 11.934 2.584 218 H2' DG 143 H2' G 143 3.078 11.681 1.963 219 H2'' DG 143 H2" G 143 3.087 10.319 3.047 220 H1' DG 143 H1' G 143 2.064 11.509 4.806 221 H21 DG 143 1H2 G 143 -3.195 11.737 6.868 222 H22 DG 143 2H2 G 143 -1.545 11.325 7.309 223 H5 DC 144 5H C 144 0.795 9.462 1.959 224 H6 DC 144 6H C 144 1.799 8.738 4.056 225 H5' DC 144 H5' C 144 3.089 10.964 6.372 226 H5'' DC 144 H5" C 144 4.349 9.993 7.081 227 H4' DC 144 H4' C 144 2.544 9.454 8.355 228 H3' DC 144 H3' C 144 3.677 7.391 6.912 229 H2' DC 144 H2' C 144 2.097 7.121 5.303 230 H2'' DC 144 H2" C 144 1.238 6.190 6.502 231 H1' DC 144 H1' C 144 -0.230 7.853 7.055 232 H41 DC 144 1H4 C 144 -2.828 9.911 1.678 233 H42 DC 144 2H4 C 144 -1.262 10.147 0.932 234 H8 DA 145 8H A 145 -0.232 4.915 5.970 235 H2 DA 145 2H A 145 -6.249 6.205 4.270 236 H5' DA 145 H5' A 145 0.025 7.216 9.598 237 H5'' DA 145 H5" A 145 0.161 5.913 10.787 238 H4' DA 145 H4' A 145 -2.199 6.308 10.362 239 H3' DA 145 H3' A 145 -1.004 3.775 10.110 240 H2' DA 145 H2' A 145 -0.905 3.845 7.754 241 H2'' DA 145 H2" A 145 -2.475 3.066 7.928 242 H1' DA 145 H1' A 145 -3.686 5.169 7.734 243 H61 DA 145 2H6 A 145 -1.855 5.803 1.519 244 H62 DA 145 1H6 A 145 -3.408 6.289 0.869 245 H8 DG 146 8H G 146 -3.874 1.624 7.206 246 H1 DG 146 1H G 146 -5.849 3.314 1.330 247 H5' DG 146 H5' G 146 -5.303 4.702 9.782 248 H5'' DG 146 H5" G 146 -6.494 4.548 11.062 249 H4' DG 146 H4' G 146 -7.897 3.932 9.425 250 H3' DG 146 H3' G 146 -6.825 1.455 10.437 251 H2' DG 146 H2' G 146 -5.585 1.017 8.500 252 H2'' DG 146 H2" G 146 -7.137 0.419 7.895 253 H1' DG 146 H1' G 146 -7.671 2.504 6.823 254 H21 DG 146 1H2 G 146 -7.958 3.762 1.354 255 H22 DG 146 2H2 G 146 -8.887 3.773 2.830 256 H8 DA 147 8H A 147 -6.870 -1.127 6.435 257 H2 DA 147 2H A 147 -6.455 0.344 0.212 258 H5' DA 147 H5' A 147 -10.115 1.864 7.442 259 H5'' DA 147 H5" A 147 -11.520 0.819 7.715 260 H4' DA 147 H4' A 147 -11.199 1.162 5.328 261 H3' DA 147 H3' A 147 -11.283 -1.405 6.570 262 H2' DA 147 H2' A 147 -9.081 -1.968 6.065 263 H2'' DA 147 H2" A 147 -9.780 -2.446 4.484 264 H1' DA 147 H1' A 147 -9.334 -0.267 3.527 265 H61 DA 147 2H6 A 147 -2.776 -0.678 3.796 266 H62 DA 147 1H6 A 147 -2.478 -0.291 2.115 267 H5 DC 148 5H C 148 -7.021 -3.474 3.239 268 H6 DC 148 6H C 148 -9.310 -3.350 2.399 269 H5' DC 148 H5' C 148 -12.279 -0.726 1.928 270 H5'' DC 148 H5" C 148 -13.731 -1.731 1.751 271 H4' DC 148 H4' C 148 -12.676 -1.639 -0.398 272 H3' DC 148 H3' C 148 -13.120 -4.116 0.896 273 H2' DC 148 H2' C 148 -10.877 -4.439 1.441 274 H2'' DC 148 H2" C 148 -10.838 -5.235 -0.135 275 H1' DC 148 H1' C 148 -10.113 -3.197 -1.260 276 H41 DC 148 1H4 C 148 -4.171 -3.161 0.975 277 H42 DC 148 2H4 C 148 -4.722 -3.487 2.620 278 H8 DG 149 8H G 149 -9.203 -6.757 -0.939 279 H1 DG 149 1H G 149 -2.836 -5.860 -1.148 280 H5' DG 149 H5' G 149 -10.817 -3.519 -3.068 281 H5'' DG 149 H5" G 149 -12.067 -4.172 -4.118 282 H4' DG 149 H4' G 149 -10.119 -4.450 -5.373 283 H3' DG 149 H3' G 149 -11.529 -6.725 -4.542 284 H2' DG 149 H2' G 149 -10.054 -7.361 -2.884 285 H2'' DG 149 H2" G 149 -9.260 -8.235 -4.183 286 H1' DG 149 H1' G 149 -7.641 -6.451 -4.508 287 H21 DG 149 1H2 G 149 -2.207 -5.587 -3.196 288 H22 DG 149 2H2 G 149 -3.350 -5.640 -4.526 289 H5 DC 150 5H C 150 -6.957 -9.723 -1.650 290 H6 DC 150 6H C 150 -7.142 -9.845 -4.068 291 H5' DC 150 H5' C 150 -8.167 -9.071 -5.710 292 H5'' DC 150 H5" C 150 -7.987 -7.398 -6.306 293 H4' DC 150 H4' C 150 -6.698 -8.229 -8.225 294 H3' DC 150 H3' C 150 -7.745 -10.721 -7.701 295 H2' DC 150 H2' C 150 -6.796 -11.109 -5.649 296 H2'' DC 150 H2" C 150 -5.477 -11.704 -6.609 297 H1' DC 150 H1' C 150 -4.140 -9.775 -6.308 298 H41 DC 150 1H4 C 150 -3.727 -9.260 -0.008 299 H42 DC 150 2H4 C 150 -5.465 -9.469 0.207 300 H5 DC 151 5H C 151 -5.102 -12.813 -4.425 301 H6 DC 151 6H C 151 -3.874 -12.790 -6.537 302 H5' DC 151 H5' C 151 -3.456 -10.205 -8.922 303 H5'' DC 151 H5" C 151 -3.207 -11.014 -10.478 304 H4' DC 151 H4' C 151 -1.084 -10.955 -9.476 305 H3' DC 151 H3' C 151 -2.144 -13.498 -9.989 306 H2' DC 151 H2' C 151 -2.699 -13.969 -7.781 307 H2'' DC 151 H2" C 151 -1.059 -14.567 -7.710 308 H1' DC 151 H1' C 151 -0.190 -12.535 -6.715 309 H41 DC 151 1H4 C 151 -3.339 -12.925 -1.239 310 H42 DC 151 2H4 C 151 -4.884 -12.804 -2.057 311 H5 DC 152 5H C 152 -3.086 -15.814 -5.017 312 H6 DC 152 6H C 152 -0.889 -15.953 -6.103 313 H5' DC 152 H5' C 152 1.589 -13.304 -7.478 314 H5'' DC 152 H5" C 152 2.890 -13.986 -8.460 315 H4' DC 152 H4' C 152 3.573 -14.624 -6.369 316 H3' DC 152 H3' C 152 2.599 -16.720 -7.983 317 H2' DC 152 H2' C 152 0.730 -17.179 -6.720 318 H2'' DC 152 H2" C 152 1.852 -18.187 -5.784 319 H1' DC 152 H1' C 152 2.284 -16.462 -4.176 320 H41 DC 152 1H4 C 152 -3.412 -16.215 -1.373 321 H42 DC 152 2H4 C 152 -4.234 -16.011 -2.911 322 H5 DC 153 5H C 153 -1.325 -19.602 -4.673 323 H6 DC 153 6H C 153 1.095 -19.912 -4.443 324 H5' DC 153 H5' C 153 4.537 -17.593 -4.051 325 H5'' DC 153 H5" C 153 5.878 -18.690 -4.436 326 H4' DC 153 H4' C 153 5.220 -19.290 -2.295 327 H3' DC 153 H3' C 153 4.818 -21.225 -4.369 328 H2' DC 153 H2' C 153 2.550 -21.325 -4.121 329 H2'' DC 153 H2" C 153 2.921 -22.383 -2.770 330 H1' DC 153 H1' C 153 2.721 -20.608 -1.134 331 H41 DC 153 1H4 C 153 -3.485 -19.244 -1.705 332 H42 DC 153 2H4 C 153 -3.428 -19.516 -3.439 333 H5 DC 154 5H C 154 -0.106 -22.838 -3.104 334 H6 DC 154 6H C 154 1.714 -23.452 -1.587 335 H5' DC 154 H5' C 154 4.697 -21.753 0.098 336 H5'' DC 154 H5" C 154 5.810 -23.068 0.528 337 H4' DC 154 H4' C 154 4.101 -22.999 2.211 338 H3' DC 154 H3' C 154 4.530 -25.312 0.581 339 H2' DC 154 H2' C 154 2.440 -25.344 -0.375 340 H2'' DC 154 H2" C 154 1.952 -26.058 1.188 341 H1' DC 154 H1' C 154 1.194 -24.001 2.058 342 H41 DC 154 1H4 C 154 -3.587 -22.690 -1.893 343 H42 DC 154 2H4 C 154 -2.496 -22.458 -3.246 344 H8 DG 155 8H G 155 0.575 -27.565 0.970 345 H1 DG 155 1H G 155 -5.495 -25.850 -0.273 346 H5' DG 155 H5' G 155 2.393 -25.587 4.573 347 H5'' DG 155 H5" G 155 2.783 -26.995 5.576 348 H4' DG 155 H4' G 155 0.435 -26.423 5.859 349 H3' DG 155 H3' G 155 1.423 -28.943 4.960 350 H2' DG 155 H2' G 155 0.405 -28.927 2.924 351 H2'' DG 155 H2" G 155 -1.039 -29.425 3.859 352 H1' DG 155 H1' G 155 -1.842 -27.225 4.038 353 H21 DG 155 1H2 G 155 -6.676 -25.869 1.557 354 H22 DG 155 2H2 G 155 -5.959 -26.265 3.114 355 H5 DC 156 5H C 156 -1.571 -30.539 1.180 356 H6 DC 156 6H C 156 -2.465 -30.934 3.427 357 H5' DC 156 H5' C 156 -2.718 -28.640 7.018 358 H5'' DC 156 H5" C 156 -2.996 -29.973 8.163 359 H4' DC 156 H4' C 156 -5.095 -29.381 7.013 360 H3' DC 156 H3' C 156 -3.990 -32.015 7.039 361 H2' DC 156 H2' C 156 -3.634 -32.134 4.761 362 H2'' DC 156 H2" C 156 -5.375 -32.505 4.754 363 H1' DC 156 H1' C 156 -6.035 -30.259 4.321 364 H41 DC 156 1H4 C 156 -3.746 -29.297 -1.506 365 H42 DC 156 2H4 C 156 -2.109 -29.656 -1.001 366 H8 DG 157 8H G 157 -6.386 -34.750 4.714 367 H1 DG 157 1H G 157 -6.896 -32.306 -1.202 368 H5' DG 157 H5' G 157 -8.709 -31.505 7.281 369 H5'' DG 157 H5" G 157 -9.518 -32.694 8.321 370 H4' DG 157 H4' G 157 -10.811 -32.315 6.264 371 H3' DG 157 H3' G 157 -10.185 -34.871 7.124 372 H2' DG 157 H2' G 157 -8.313 -35.189 5.704 373 H2'' DG 157 H2" G 157 -9.601 -35.879 4.659 374 H1' DG 157 H1' G 157 -9.967 -33.803 3.549 375 H21 DG 157 1H2 G 157 -8.997 -31.891 -1.635 376 H22 DG 157 2H2 G 157 -10.239 -32.075 -0.412 377 HA ALA 1 HA ALA 1 20.216 23.788 0.518 378 H1 ALA 1 HN ALA 1 22.912 23.754 0.335 379 HB1 ALA 1 1HB ALA 1 21.718 25.327 1.753 380 HB2 ALA 1 2HB ALA 1 21.951 26.291 0.274 381 HB3 ALA 1 3HB ALA 1 20.351 26.203 1.041 382 H SER 2 HN SER 2 21.728 23.999 -2.448 383 HA SER 2 HA SER 2 20.217 25.964 -3.861 384 HG SER 2 HG SER 2 23.181 24.839 -5.413 385 HB2 SER 2 2HB SER 2 21.481 23.375 -4.873 386 HB3 SER 2 3HB SER 2 20.938 24.729 -5.886 387 H GLU 3 HN GLU 3 18.025 25.991 -3.751 388 HA GLU 3 HA GLU 3 16.404 23.609 -3.629 389 HB2 GLU 3 2HB GLU 3 14.550 25.063 -3.687 390 HB3 GLU 3 3HB GLU 3 15.777 25.901 -2.767 391 HG2 GLU 3 2HG GLU 3 14.948 26.476 -5.649 392 HG3 GLU 3 3HG GLU 3 14.482 27.392 -4.227 393 H LYS 4 HN LYS 4 18.009 25.108 -6.273 394 HA LYS 4 HA LYS 4 16.104 24.405 -8.371 395 HB2 LYS 4 2HB LYS 4 19.088 25.050 -8.536 396 HB3 LYS 4 3HB LYS 4 17.971 24.964 -9.898 397 HG2 LYS 4 2HG LYS 4 17.961 27.015 -7.649 398 HG3 LYS 4 3HG LYS 4 18.429 27.265 -9.329 399 HD2 LYS 4 2HD LYS 4 16.061 26.708 -10.023 400 HD3 LYS 4 3HD LYS 4 15.625 26.658 -8.299 401 HE2 LYS 4 2HE LYS 4 16.448 28.996 -8.045 402 HE3 LYS 4 3HE LYS 4 16.797 29.049 -9.781 403 HZ1 LYS 4 3HZ LYS 4 14.660 30.011 -9.272 404 HZ2 LYS 4 1HZ LYS 4 14.146 28.614 -8.570 405 HZ3 LYS 4 2HZ LYS 4 14.453 28.656 -10.188 406 H ARG 5 HN ARG 5 15.848 22.156 -7.349 407 HA ARG 5 HA ARG 5 17.644 20.258 -8.792 408 HE ARG 5 HE ARG 5 16.068 17.875 -5.398 409 HB2 ARG 5 2HB ARG 5 17.801 18.860 -6.710 410 HB3 ARG 5 3HB ARG 5 18.650 20.387 -6.582 411 HG2 ARG 5 2HG ARG 5 17.145 21.283 -5.043 412 HG3 ARG 5 3HG ARG 5 15.802 20.270 -5.548 413 HD2 ARG 5 2HD ARG 5 18.241 19.204 -4.088 414 HD3 ARG 5 3HD ARG 5 16.718 19.683 -3.310 415 HH11 ARG 5 1HH2 ARG 5 17.605 17.655 -2.239 416 HH12 ARG 5 2HH2 ARG 5 17.188 15.957 -2.098 417 HH21 ARG 5 1HH1 ARG 5 15.686 15.875 -5.218 418 HH22 ARG 5 2HH1 ARG 5 16.120 14.919 -3.773 419 HA PRO 6 HA PRO 6 13.800 18.067 -9.403 420 HB2 PRO 6 2HB PRO 6 14.658 15.476 -9.706 421 HB3 PRO 6 3HB PRO 6 14.991 16.751 -10.912 422 HG2 PRO 6 2HG PRO 6 16.820 15.752 -8.705 423 HG3 PRO 6 3HG PRO 6 17.206 15.990 -10.442 424 HD2 PRO 6 2HD PRO 6 17.817 17.849 -8.560 425 HD3 PRO 6 3HD PRO 6 17.294 18.329 -10.200 426 H PHE 7 HN PHE 7 12.320 16.563 -8.380 427 HA PHE 7 HA PHE 7 12.762 16.324 -5.454 428 HD1 PHE 7 1HD PHE 7 10.476 17.841 -4.335 429 HD2 PHE 7 2HD PHE 7 9.896 17.284 -8.568 430 HE1 PHE 7 1HE PHE 7 9.516 20.118 -4.511 431 HE2 PHE 7 2HE PHE 7 8.926 19.564 -8.737 432 HZ PHE 7 HZ PHE 7 8.739 20.987 -6.705 433 HB2 PHE 7 2HB PHE 7 10.391 15.432 -7.165 434 HB3 PHE 7 3HB PHE 7 10.443 15.557 -5.413 435 H MET 8 HN MET 8 14.108 14.588 -4.877 436 HA MET 8 HA MET 8 13.778 12.069 -6.448 437 HB2 MET 8 2HB MET 8 16.101 13.136 -6.308 438 HB3 MET 8 3HB MET 8 16.074 12.744 -4.597 439 HG2 MET 8 2HG MET 8 15.808 10.319 -5.195 440 HG3 MET 8 3HG MET 8 15.915 10.772 -6.893 441 HE1 MET 8 3HE MET 8 17.808 11.379 -3.460 442 HE2 MET 8 1HE MET 8 17.689 9.646 -3.825 443 HE3 MET 8 2HE MET 8 19.278 10.440 -3.819 444 H CYS 9 HN CYS 9 13.160 10.257 -5.469 445 HA CYS 9 HA CYS 9 11.812 10.347 -2.951 446 HB2 CYS 9 2HB CYS 9 11.199 8.661 -4.510 447 HB3 CYS 9 3HB CYS 9 12.851 8.122 -4.738 448 H ALA 10 HN ALA 10 12.384 9.253 -0.950 449 HA ALA 10 HA ALA 10 15.328 9.331 -0.411 450 HB1 ALA 10 1HB ALA 10 13.002 9.932 1.474 451 HB2 ALA 10 2HB ALA 10 14.730 9.997 1.889 452 HB3 ALA 10 3HB ALA 10 14.061 11.138 0.706 453 H TYR 11 HN TYR 11 12.559 7.297 -0.577 454 HA TYR 11 HA TYR 11 13.131 5.512 1.617 455 HD1 TYR 11 2HD TYR 11 12.288 2.688 -1.130 456 HD2 TYR 11 1HD TYR 11 10.283 4.213 2.364 457 HE1 TYR 11 2HE TYR 11 11.811 0.369 -0.378 458 HE2 TYR 11 1HE TYR 11 9.848 1.875 3.131 459 HH TYR 11 HH TYR 11 9.988 -0.500 2.497 460 HB2 TYR 11 2HB TYR 11 10.919 5.697 0.497 461 HB3 TYR 11 3HB TYR 11 11.616 5.039 -0.973 462 HA PRO 12 HA PRO 12 16.749 3.643 -0.373 463 HB2 PRO 12 2HB PRO 12 17.298 1.793 1.614 464 HB3 PRO 12 3HB PRO 12 17.704 3.526 1.726 465 HG2 PRO 12 2HG PRO 12 15.308 2.101 2.901 466 HG3 PRO 12 3HG PRO 12 16.398 3.282 3.692 467 HD2 PRO 12 2HD PRO 12 13.992 3.972 2.640 468 HD3 PRO 12 3HD PRO 12 15.394 5.093 2.575 469 H GLY 13 HN GLY 13 16.016 2.527 -2.162 470 HA2 GLY 13 2HA GLY 13 15.542 -0.053 -2.592 471 HA3 GLY 13 3HA GLY 13 14.033 0.390 -1.763 472 H CYS 14 HN CYS 14 14.234 3.204 -2.822 473 HA CYS 14 HA CYS 14 13.776 2.764 -5.745 474 HB2 CYS 14 2HB CYS 14 11.624 3.137 -4.792 475 HB3 CYS 14 3HB CYS 14 12.258 4.425 -3.745 476 H ASN 15 HN ASN 15 13.702 5.780 -3.796 477 HA ASN 15 HA ASN 15 14.990 7.686 -3.862 478 HB2 ASN 15 2HB ASN 15 17.050 5.488 -4.030 479 HB3 ASN 15 3HB ASN 15 17.612 7.087 -4.436 480 HD21 ASN 15 1HD2 ASN 15 15.431 5.782 -1.801 481 HD22 ASN 15 2HD2 ASN 15 16.356 6.695 -0.598 482 H LYS 16 HN LYS 16 13.558 6.984 -6.307 483 HA LYS 16 HA LYS 16 15.378 7.766 -8.514 484 HB2 LYS 16 2HB LYS 16 12.705 6.499 -8.272 485 HB3 LYS 16 3HB LYS 16 12.742 7.739 -9.495 486 HG2 LYS 16 2HG LYS 16 13.291 5.689 -10.567 487 HG3 LYS 16 3HG LYS 16 14.727 6.707 -10.545 488 HD2 LYS 16 2HD LYS 16 15.422 4.476 -10.075 489 HD3 LYS 16 3HD LYS 16 15.567 5.367 -8.555 490 HE2 LYS 16 2HE LYS 16 13.437 4.410 -7.769 491 HE3 LYS 16 3HE LYS 16 13.196 3.602 -9.327 492 HZ1 LYS 16 3HZ LYS 16 15.249 2.368 -8.890 493 HZ2 LYS 16 1HZ LYS 16 14.120 2.107 -7.710 494 HZ3 LYS 16 2HZ LYS 16 15.379 3.120 -7.419 495 H ARG 17 HN ARG 17 14.714 9.495 -10.028 496 HA ARG 17 HA ARG 17 14.100 11.889 -8.397 497 HE ARG 17 HE ARG 17 18.812 12.229 -8.241 498 HB2 ARG 17 2HB ARG 17 15.448 11.491 -11.112 499 HB3 ARG 17 3HB ARG 17 15.075 13.084 -10.431 500 HG2 ARG 17 2HG ARG 17 16.409 12.594 -8.442 501 HG3 ARG 17 3HG ARG 17 16.813 10.981 -9.063 502 HD2 ARG 17 2HD ARG 17 18.045 11.971 -10.921 503 HD3 ARG 17 3HD ARG 17 17.542 13.603 -10.419 504 HH11 ARG 17 1HH1 ARG 17 19.735 13.834 -11.232 505 HH12 ARG 17 2HH1 ARG 17 21.300 14.289 -10.590 506 HH21 ARG 17 2HH2 ARG 17 20.780 12.834 -7.506 507 HH22 ARG 17 1HH2 ARG 17 21.874 13.728 -8.539 508 H TYR 18 HN TYR 18 12.522 13.308 -8.806 509 HA TYR 18 HA TYR 18 10.645 12.746 -11.065 510 HD1 TYR 18 2HD TYR 18 11.088 11.313 -7.455 511 HD2 TYR 18 1HD TYR 18 7.733 11.606 -10.159 512 HE1 TYR 18 2HE TYR 18 10.680 8.883 -7.231 513 HE2 TYR 18 1HE TYR 18 7.408 9.163 -10.011 514 HH TYR 18 HH TYR 18 9.461 7.117 -7.965 515 HB2 TYR 18 2HB TYR 18 10.061 13.561 -8.188 516 HB3 TYR 18 3HB TYR 18 8.890 13.590 -9.447 517 H PHE 19 HN PHE 19 9.278 14.652 -11.634 518 HA PHE 19 HA PHE 19 10.939 17.150 -11.449 519 HD1 PHE 19 1HD PHE 19 12.593 17.564 -13.689 520 HD2 PHE 19 2HD PHE 19 10.174 14.029 -14.202 521 HE1 PHE 19 1HE PHE 19 14.573 16.326 -14.537 522 HE2 PHE 19 2HE PHE 19 12.157 12.795 -15.034 523 HZ PHE 19 HZ PHE 19 14.356 13.942 -15.209 524 HB2 PHE 19 2HB PHE 19 9.126 16.168 -13.699 525 HB3 PHE 19 3HB PHE 19 10.068 17.657 -13.706 526 H LYS 20 HN LYS 20 7.980 15.783 -10.511 527 HA LYS 20 HA LYS 20 6.780 18.509 -10.200 528 HB2 LYS 20 2HB LYS 20 5.202 15.973 -10.549 529 HB3 LYS 20 3HB LYS 20 4.561 17.582 -10.503 530 HG2 LYS 20 2HG LYS 20 6.289 16.460 -12.762 531 HG3 LYS 20 3HG LYS 20 4.533 16.597 -12.778 532 HD2 LYS 20 2HD LYS 20 4.651 19.039 -12.621 533 HD3 LYS 20 3HD LYS 20 6.418 18.978 -12.495 534 HE2 LYS 20 2HE LYS 20 6.542 17.898 -14.727 535 HE3 LYS 20 3HE LYS 20 4.779 18.010 -14.872 536 HZ1 LYS 20 3HZ LYS 20 6.622 20.292 -14.572 537 HZ2 LYS 20 1HZ LYS 20 4.986 20.400 -14.717 538 HZ3 LYS 20 2HZ LYS 20 5.888 19.834 -15.975 539 H LEU 21 HN LEU 21 6.095 19.002 -8.202 540 HA LEU 21 HA LEU 21 6.882 17.396 -5.944 541 HG LEU 21 HG LEU 21 7.291 19.203 -4.171 542 HB2 LEU 21 2HB LEU 21 6.304 19.997 -6.200 543 HB3 LEU 21 3HB LEU 21 4.693 19.474 -5.736 544 HD11 LEU 21 1HD1 LEU 21 4.705 20.678 -3.562 545 HD12 LEU 21 2HD1 LEU 21 6.209 21.411 -4.160 546 HD13 LEU 21 3HD1 LEU 21 6.171 20.659 -2.559 547 HD21 LEU 21 3HD2 LEU 21 4.617 17.990 -3.434 548 HD22 LEU 21 1HD2 LEU 21 5.915 18.316 -2.270 549 HD23 LEU 21 2HD2 LEU 21 6.187 17.181 -3.587 550 H SER 22 HN SER 22 3.711 18.020 -7.532 551 HA SER 22 HA SER 22 2.153 16.364 -5.785 552 HG SER 22 HG SER 22 1.040 17.987 -9.334 553 HB2 SER 22 2HB SER 22 0.451 16.538 -7.657 554 HB3 SER 22 3HB SER 22 1.064 18.078 -7.023 555 H HIS 23 HN HIS 23 4.052 15.607 -8.654 556 HA HIS 23 HA HIS 23 2.583 13.066 -9.125 557 HD1 HIS 23 1HD HIS 23 4.904 12.692 -13.083 558 HD2 HIS 23 2HD HIS 23 6.861 14.278 -9.749 559 HE1 HIS 23 1HE HIS 23 7.366 12.911 -13.719 560 HB2 HIS 23 2HB HIS 23 3.444 12.975 -11.094 561 HB3 HIS 23 3HB HIS 23 3.650 14.649 -10.982 562 H LEU 24 HN LEU 24 5.767 14.282 -7.998 563 HA LEU 24 HA LEU 24 6.718 11.770 -7.085 564 HG LEU 24 HG LEU 24 9.600 13.439 -5.747 565 HB2 LEU 24 2HB LEU 24 8.061 13.807 -7.308 566 HB3 LEU 24 3HB LEU 24 7.203 14.571 -6.018 567 HD11 LEU 24 1HD1 LEU 24 9.273 13.416 -3.330 568 HD12 LEU 24 2HD1 LEU 24 7.511 13.423 -3.542 569 HD13 LEU 24 3HD1 LEU 24 8.478 14.820 -4.063 570 HD21 LEU 24 3HD2 LEU 24 9.776 11.338 -4.903 571 HD22 LEU 24 1HD2 LEU 24 8.517 11.065 -6.112 572 HD23 LEU 24 2HD2 LEU 24 8.096 11.245 -4.394 573 H GLN 25 HN GLN 25 4.582 14.197 -5.525 574 HA GLN 25 HA GLN 25 4.381 13.004 -2.972 575 HB2 GLN 25 2HB GLN 25 3.432 15.119 -3.231 576 HB3 GLN 25 3HB GLN 25 2.551 14.695 -4.662 577 HG2 GLN 25 2HG GLN 25 1.792 13.659 -1.930 578 HG3 GLN 25 3HG GLN 25 1.207 15.176 -2.616 579 HE21 GLN 25 1HE2 GLN 25 0.774 13.974 -5.473 580 HE22 GLN 25 2HE2 GLN 25 -0.655 13.004 -5.112 581 H MET 26 HN MET 26 2.568 12.344 -6.005 582 HA MET 26 HA MET 26 0.887 10.297 -4.938 583 HB2 MET 26 2HB MET 26 0.705 11.472 -7.215 584 HB3 MET 26 3HB MET 26 1.996 10.404 -7.781 585 HG2 MET 26 2HG MET 26 -0.115 9.428 -8.390 586 HG3 MET 26 3HG MET 26 0.599 8.436 -7.118 587 HE1 MET 26 3HE MET 26 -2.996 7.842 -6.028 588 HE2 MET 26 1HE MET 26 -1.354 7.177 -6.165 589 HE3 MET 26 2HE MET 26 -2.223 7.710 -7.625 590 H HIS 27 HN HIS 27 4.151 10.176 -6.488 591 HA HIS 27 HA HIS 27 4.482 7.369 -6.465 592 HD1 HIS 27 1HD HIS 27 6.958 5.895 -7.003 593 HD2 HIS 27 2HD HIS 27 8.440 9.126 -4.751 594 HE1 HIS 27 1HE HIS 27 9.035 5.057 -5.731 595 HB2 HIS 27 2HB HIS 27 6.112 8.598 -7.658 596 HB3 HIS 27 3HB HIS 27 6.443 9.693 -6.327 597 H SER 28 HN SER 28 4.992 9.762 -3.837 598 HA SER 28 HA SER 28 6.385 8.107 -2.029 599 HG SER 28 HG SER 28 3.559 10.591 -1.871 600 HB2 SER 28 2HB SER 28 5.837 9.692 -0.373 601 HB3 SER 28 3HB SER 28 5.850 10.636 -1.870 602 H ARG 29 HN ARG 29 2.899 8.258 -2.790 603 HA ARG 29 HA ARG 29 1.886 6.834 -0.523 604 HE ARG 29 HE ARG 29 -0.911 10.885 -2.725 605 HB2 ARG 29 2HB ARG 29 0.854 6.832 -3.406 606 HB3 ARG 29 3HB ARG 29 -0.025 6.293 -1.977 607 HG2 ARG 29 2HG ARG 29 0.210 8.562 -0.960 608 HG3 ARG 29 3HG ARG 29 0.992 9.134 -2.440 609 HD2 ARG 29 2HD ARG 29 -1.046 8.628 -3.727 610 HD3 ARG 29 3HD ARG 29 -1.845 8.050 -2.258 611 HH11 ARG 29 1HH2 ARG 29 -3.209 8.772 -0.983 612 HH12 ARG 29 2HH2 ARG 29 -3.848 10.134 -0.137 613 HH21 ARG 29 2HH1 ARG 29 -1.778 12.457 -1.650 614 HH22 ARG 29 1HH1 ARG 29 -3.079 12.187 -0.476 615 H LYS 30 HN LYS 30 3.445 5.731 -3.549 616 HA LYS 30 HA LYS 30 2.680 2.973 -3.387 617 HB2 LYS 30 2HB LYS 30 3.977 2.711 -5.210 618 HB3 LYS 30 3HB LYS 30 3.930 4.443 -5.249 619 HG2 LYS 30 2HG LYS 30 6.096 4.021 -5.746 620 HG3 LYS 30 3HG LYS 30 6.268 4.324 -4.024 621 HD2 LYS 30 2HD LYS 30 6.569 1.957 -3.572 622 HD3 LYS 30 3HD LYS 30 6.000 1.513 -5.194 623 HE2 LYS 30 2HE LYS 30 7.947 2.607 -6.210 624 HE3 LYS 30 3HE LYS 30 8.500 3.156 -4.623 625 HZ1 LYS 30 3HZ LYS 30 8.782 0.863 -3.981 626 HZ2 LYS 30 1HZ LYS 30 9.634 1.157 -5.360 627 HZ3 LYS 30 2HZ LYS 30 8.209 0.326 -5.421 628 H HIS 31 HN HIS 31 5.240 4.830 -1.713 629 HA HIS 31 HA HIS 31 6.711 2.418 -0.942 630 HD1 HIS 31 1HD HIS 31 8.925 2.069 -1.285 631 HD2 HIS 31 2HD HIS 31 8.660 6.186 -2.276 632 HE1 HIS 31 1HE HIS 31 10.598 2.482 -3.068 633 HB2 HIS 31 2HB HIS 31 6.980 5.373 -0.330 634 HB3 HIS 31 3HB HIS 31 7.851 4.176 0.642 635 H THR 32 HN THR 32 4.147 4.428 0.583 636 HA THR 32 HA THR 32 4.138 3.438 3.119 637 HB THR 32 HB THR 32 1.730 3.624 3.176 638 HG1 THR 32 1HG THR 32 1.710 3.818 0.331 639 HG21 THR 32 3HG2 THR 32 2.917 5.766 3.024 640 HG22 THR 32 1HG2 THR 32 1.334 5.843 2.235 641 HG23 THR 32 2HG2 THR 32 2.811 5.732 1.256 642 H GLY 33 HN GLY 33 3.488 1.523 0.203 643 HA2 GLY 33 2HA GLY 33 2.496 -0.808 1.707 644 HA3 GLY 33 3HA GLY 33 2.822 -0.727 -0.028 645 H GLU 34 HN GLU 34 5.497 0.567 1.454 646 HA GLU 34 HA GLU 34 6.893 -2.073 1.626 647 HB2 GLU 34 2HB GLU 34 8.006 0.507 0.444 648 HB3 GLU 34 3HB GLU 34 8.792 -1.092 0.493 649 HG2 GLU 34 2HG GLU 34 6.959 -2.037 -0.897 650 HG3 GLU 34 3HG GLU 34 6.269 -0.415 -1.071 651 H LYS 35 HN LYS 35 5.996 0.703 3.321 652 HA LYS 35 HA LYS 35 8.321 1.354 4.845 653 HB2 LYS 35 2HB LYS 35 5.930 2.461 4.653 654 HB3 LYS 35 3HB LYS 35 5.533 1.475 6.041 655 HG2 LYS 35 2HG LYS 35 7.767 3.549 5.803 656 HG3 LYS 35 3HG LYS 35 6.224 3.784 6.608 657 HD2 LYS 35 2HD LYS 35 8.468 1.952 7.547 658 HD3 LYS 35 3HD LYS 35 7.993 3.499 8.235 659 HE2 LYS 35 2HE LYS 35 5.768 2.573 8.807 660 HE3 LYS 35 3HE LYS 35 6.250 1.009 8.124 661 HZ1 LYS 35 3HZ LYS 35 7.970 0.851 9.754 662 HZ2 LYS 35 1HZ LYS 35 6.522 1.065 10.496 663 HZ3 LYS 35 2HZ LYS 35 7.585 2.327 10.394 664 HA PRO 36 HA PRO 36 8.541 -2.686 6.733 665 HB2 PRO 36 2HB PRO 36 10.935 -2.392 8.085 666 HB3 PRO 36 3HB PRO 36 10.805 -2.587 6.316 667 HG2 PRO 36 2HG PRO 36 11.076 0.002 7.877 668 HG3 PRO 36 3HG PRO 36 12.029 -0.544 6.457 669 HD2 PRO 36 2HD PRO 36 9.938 1.127 6.168 670 HD3 PRO 36 3HD PRO 36 10.223 -0.187 4.992 671 H TYR 37 HN TYR 37 7.478 -3.472 8.439 672 HA TYR 37 HA TYR 37 7.912 -2.180 11.133 673 HD1 TYR 37 2HD TYR 37 4.931 -1.653 8.343 674 HD2 TYR 37 1HD TYR 37 5.338 -0.690 12.527 675 HE1 TYR 37 2HE TYR 37 3.679 0.487 7.992 676 HE2 TYR 37 1HE TYR 37 4.042 1.394 12.188 677 HH TYR 37 HH TYR 37 3.074 2.817 10.586 678 HB2 TYR 37 2HB TYR 37 5.295 -3.422 10.153 679 HB3 TYR 37 3HB TYR 37 5.678 -2.851 11.772 680 H GLN 38 HN GLN 38 7.211 -3.857 12.924 681 HA GLN 38 HA GLN 38 7.612 -6.684 12.064 682 HB2 GLN 38 2HB GLN 38 9.779 -6.014 12.956 683 HB3 GLN 38 3HB GLN 38 9.032 -5.352 14.418 684 HG2 GLN 38 2HG GLN 38 8.350 -7.568 15.164 685 HG3 GLN 38 3HG GLN 38 8.842 -8.292 13.626 686 HE21 GLN 38 1HE2 GLN 38 9.695 -8.994 16.476 687 HE22 GLN 38 2HE2 GLN 38 11.442 -8.864 16.303 688 H CYS 39 HN CYS 39 6.457 -8.199 13.264 689 HA CYS 39 HA CYS 39 3.985 -7.643 14.177 690 HB2 CYS 39 2HB CYS 39 4.890 -9.929 13.887 691 HB3 CYS 39 3HB CYS 39 5.778 -9.750 15.415 692 H ASP 40 HN ASP 40 2.991 -6.594 15.792 693 HA ASP 40 HA ASP 40 4.612 -5.530 18.018 694 HB2 ASP 40 2HB ASP 40 2.598 -4.179 18.509 695 HB3 ASP 40 3HB ASP 40 3.132 -3.999 16.851 696 H PHE 41 HN PHE 41 3.561 -8.501 17.660 697 HA PHE 41 HA PHE 41 1.853 -8.921 20.010 698 HD1 PHE 41 1HD PHE 41 0.259 -11.032 20.135 699 HD2 PHE 41 2HD PHE 41 4.137 -12.745 19.414 700 HE1 PHE 41 1HE PHE 41 -0.387 -13.059 21.429 701 HE2 PHE 41 2HE PHE 41 3.509 -14.762 20.681 702 HZ PHE 41 HZ PHE 41 1.235 -14.930 21.703 703 HB2 PHE 41 2HB PHE 41 1.868 -10.456 18.082 704 HB3 PHE 41 3HB PHE 41 3.573 -10.793 18.347 705 H LYS 42 HN LYS 42 5.133 -8.095 19.518 706 HA LYS 42 HA LYS 42 6.894 -7.822 21.007 707 HB2 LYS 42 2HB LYS 42 4.907 -7.611 22.724 708 HB3 LYS 42 3HB LYS 42 5.377 -9.211 23.267 709 HG2 LYS 42 2HG LYS 42 7.108 -6.707 23.211 710 HG3 LYS 42 3HG LYS 42 6.338 -7.416 24.624 711 HD2 LYS 42 2HD LYS 42 8.640 -8.597 23.029 712 HD3 LYS 42 3HD LYS 42 8.701 -7.922 24.651 713 HE2 LYS 42 2HE LYS 42 7.321 -9.721 25.549 714 HE3 LYS 42 3HE LYS 42 7.015 -10.348 23.928 715 HZ1 LYS 42 3HZ LYS 42 8.687 -11.631 24.925 716 HZ2 LYS 42 1HZ LYS 42 9.617 -10.312 25.292 717 HZ3 LYS 42 2HZ LYS 42 9.388 -10.761 23.719 718 H ASP 43 HN ASP 43 5.250 -10.959 21.733 719 HA ASP 43 HA ASP 43 7.872 -12.349 21.744 720 HB2 ASP 43 2HB ASP 43 5.011 -13.332 22.186 721 HB3 ASP 43 3HB ASP 43 6.455 -14.354 22.311 722 H CYS 44 HN CYS 44 7.477 -11.195 19.263 723 HA CYS 44 HA CYS 44 7.257 -13.590 17.547 724 HB2 CYS 44 2HB CYS 44 4.998 -12.618 17.446 725 HB3 CYS 44 3HB CYS 44 5.657 -11.037 17.044 726 H GLU 45 HN GLU 45 8.018 -13.017 15.242 727 HA GLU 45 HA GLU 45 10.091 -10.891 15.244 728 HB2 GLU 45 2HB GLU 45 10.910 -13.291 16.114 729 HB3 GLU 45 3HB GLU 45 10.912 -13.668 14.403 730 HG2 GLU 45 2HG GLU 45 13.096 -12.974 14.756 731 HG3 GLU 45 3HG GLU 45 12.383 -11.470 14.186 732 H ARG 46 HN ARG 46 7.475 -11.556 13.774 733 HA ARG 46 HA ARG 46 8.478 -12.028 11.001 734 HE ARG 46 HE ARG 46 6.007 -13.893 13.718 735 HB2 ARG 46 2HB ARG 46 5.756 -12.108 12.329 736 HB3 ARG 46 3HB ARG 46 5.860 -11.623 10.652 737 HG2 ARG 46 2HG ARG 46 5.440 -13.921 10.573 738 HG3 ARG 46 3HG ARG 46 7.103 -13.676 10.051 739 HD2 ARG 46 2HD ARG 46 6.963 -15.643 11.482 740 HD3 ARG 46 3HD ARG 46 7.894 -14.387 12.307 741 HH11 ARG 46 2HH1 ARG 46 5.364 -16.819 11.907 742 HH12 ARG 46 1HH1 ARG 46 3.949 -17.169 12.889 743 HH21 ARG 46 1HH2 ARG 46 4.274 -14.271 14.764 744 HH22 ARG 46 2HH2 ARG 46 3.308 -15.718 14.507 745 H ARG 47 HN ARG 47 8.787 -10.428 9.593 746 HA ARG 47 HA ARG 47 8.104 -7.674 10.441 747 HE ARG 47 HE ARG 47 10.980 -9.675 5.549 748 HB2 ARG 47 2HB ARG 47 9.661 -6.941 8.746 749 HB3 ARG 47 3HB ARG 47 10.431 -8.165 9.750 750 HG2 ARG 47 2HG ARG 47 10.007 -9.871 7.954 751 HG3 ARG 47 3HG ARG 47 9.278 -8.602 6.949 752 HD2 ARG 47 2HD ARG 47 11.413 -7.331 7.029 753 HD3 ARG 47 3HD ARG 47 12.142 -8.655 7.966 754 HH11 ARG 47 1HH2 ARG 47 13.803 -7.847 6.578 755 HH12 ARG 47 2HH2 ARG 47 14.741 -8.359 5.192 756 HH21 ARG 47 1HH1 ARG 47 12.234 -10.288 3.825 757 HH22 ARG 47 2HH1 ARG 47 13.877 -9.702 3.691 758 H PHE 48 HN PHE 48 7.171 -6.181 8.939 759 HA PHE 48 HA PHE 48 5.622 -7.394 6.695 760 HD1 PHE 48 1HD PHE 48 3.264 -8.441 6.820 761 HD2 PHE 48 2HD PHE 48 4.600 -7.158 10.722 762 HE1 PHE 48 1HE PHE 48 3.039 -10.736 7.655 763 HE2 PHE 48 2HE PHE 48 4.359 -9.477 11.560 764 HZ PHE 48 HZ PHE 48 3.718 -11.280 9.978 765 HB2 PHE 48 2HB PHE 48 4.491 -5.579 8.879 766 HB3 PHE 48 3HB PHE 48 3.635 -6.003 7.390 767 H SER 49 HN SER 49 4.773 -5.681 5.213 768 HA SER 49 HA SER 49 6.848 -3.548 5.022 769 HG SER 49 HG SER 49 4.645 -3.732 2.006 770 HB2 SER 49 2HB SER 49 6.628 -3.713 2.683 771 HB3 SER 49 3HB SER 49 6.504 -5.377 3.223 772 H ARG 50 HN ARG 50 3.791 -3.752 6.212 773 HA ARG 50 HA ARG 50 3.323 -0.905 5.889 774 HE ARG 50 HE ARG 50 -0.405 -2.612 3.237 775 HB2 ARG 50 2HB ARG 50 2.428 -1.780 3.738 776 HB3 ARG 50 3HB ARG 50 1.348 -2.846 4.623 777 HG2 ARG 50 2HG ARG 50 0.002 -1.018 5.362 778 HG3 ARG 50 3HG ARG 50 1.250 0.178 4.987 779 HD2 ARG 50 2HD ARG 50 -0.714 0.101 3.398 780 HD3 ARG 50 3HD ARG 50 0.871 0.012 2.668 781 HH11 ARG 50 2HH2 ARG 50 -0.036 -0.278 0.698 782 HH12 ARG 50 1HH2 ARG 50 0.179 -1.551 -0.487 783 HH21 ARG 50 1HH1 ARG 50 -0.409 -4.058 1.695 784 HH22 ARG 50 2HH1 ARG 50 -0.256 -3.555 -0.003 785 H SER 51 HN SER 51 1.607 -0.123 7.255 786 HA SER 51 HA SER 51 1.321 -1.448 9.742 787 HG SER 51 HG SER 51 1.570 1.657 9.069 788 HB2 SER 51 2HB SER 51 -0.925 0.345 9.034 789 HB3 SER 51 3HB SER 51 0.235 0.465 10.354 790 H ASP 52 HN ASP 52 -0.953 -1.203 6.977 791 HA ASP 52 HA ASP 52 -3.085 -2.660 7.963 792 HB2 ASP 52 2HB ASP 52 -3.022 -1.497 5.789 793 HB3 ASP 52 3HB ASP 52 -1.944 -2.709 5.140 794 H GLN 53 HN GLN 53 -0.105 -3.993 6.436 795 HA GLN 53 HA GLN 53 -1.035 -6.739 6.497 796 HB2 GLN 53 2HB GLN 53 1.598 -5.358 5.937 797 HB3 GLN 53 3HB GLN 53 1.560 -7.110 6.167 798 HG2 GLN 53 2HG GLN 53 1.333 -6.293 3.782 799 HG3 GLN 53 3HG GLN 53 0.159 -7.488 4.326 800 HE21 GLN 53 1HE2 GLN 53 -2.156 -6.916 4.308 801 HE22 GLN 53 2HE2 GLN 53 -2.607 -5.285 3.802 802 H LEU 54 HN LEU 54 0.991 -4.718 8.627 803 HA LEU 54 HA LEU 54 1.717 -6.809 10.471 804 HG LEU 54 HG LEU 54 1.227 -4.367 12.965 805 HB2 LEU 54 2HB LEU 54 2.910 -4.744 10.470 806 HB3 LEU 54 3HB LEU 54 1.458 -3.789 10.652 807 HD11 LEU 54 1HD1 LEU 54 2.899 -5.770 14.081 808 HD12 LEU 54 2HD1 LEU 54 3.657 -6.163 12.528 809 HD13 LEU 54 3HD1 LEU 54 2.020 -6.733 12.884 810 HD21 LEU 54 3HD2 LEU 54 3.043 -2.654 12.161 811 HD22 LEU 54 1HD2 LEU 54 4.196 -3.960 12.594 812 HD23 LEU 54 2HD2 LEU 54 3.147 -3.271 13.824 813 H LYS 55 HN LYS 55 -0.951 -4.353 10.523 814 HA LYS 55 HA LYS 55 -2.339 -5.307 12.802 815 HB2 LYS 55 2HB LYS 55 -2.885 -3.195 11.788 816 HB3 LYS 55 3HB LYS 55 -3.266 -3.954 10.246 817 HG2 LYS 55 2HG LYS 55 -5.312 -4.919 11.140 818 HG3 LYS 55 3HG LYS 55 -4.905 -4.372 12.772 819 HD2 LYS 55 2HD LYS 55 -6.600 -2.919 11.651 820 HD3 LYS 55 3HD LYS 55 -5.151 -2.052 12.150 821 HE2 LYS 55 2HE LYS 55 -5.888 -1.276 9.958 822 HE3 LYS 55 3HE LYS 55 -4.300 -2.049 9.845 823 HZ1 LYS 55 3HZ LYS 55 -5.458 -4.058 9.094 824 HZ2 LYS 55 1HZ LYS 55 -5.663 -2.808 8.064 825 HZ3 LYS 55 2HZ LYS 55 -6.889 -3.232 9.088 826 H ARG 56 HN ARG 56 -2.636 -6.290 9.342 827 HA ARG 56 HA ARG 56 -4.670 -8.263 9.695 828 HE ARG 56 HE ARG 56 -1.594 -10.100 6.357 829 HB2 ARG 56 2HB ARG 56 -3.857 -7.431 7.503 830 HB3 ARG 56 3HB ARG 56 -2.314 -8.237 7.762 831 HG2 ARG 56 2HG ARG 56 -3.532 -10.454 7.776 832 HG3 ARG 56 3HG ARG 56 -5.025 -9.565 7.422 833 HD2 ARG 56 2HD ARG 56 -4.169 -10.359 5.322 834 HD3 ARG 56 3HD ARG 56 -3.880 -8.617 5.367 835 HH11 ARG 56 1HH2 ARG 56 -3.159 -9.253 3.313 836 HH12 ARG 56 2HH2 ARG 56 -1.715 -9.552 2.388 837 HH21 ARG 56 1HH1 ARG 56 0.219 -10.474 5.093 838 HH22 ARG 56 2HH1 ARG 56 0.108 -10.160 3.356 839 H HIS 57 HN HIS 57 -1.082 -8.495 9.918 840 HA HIS 57 HA HIS 57 -0.932 -11.276 10.402 841 HD1 HIS 57 1HD HIS 57 1.378 -12.739 10.316 842 HD2 HIS 57 2HD HIS 57 2.209 -9.998 13.387 843 HE1 HIS 57 1HE HIS 57 2.811 -13.986 12.065 844 HB2 HIS 57 2HB HIS 57 1.012 -9.923 9.845 845 HB3 HIS 57 3HB HIS 57 0.912 -9.032 11.363 846 H GLN 58 HN GLN 58 -1.457 -8.556 12.696 847 HA GLN 58 HA GLN 58 -1.234 -9.968 15.123 848 HB2 GLN 58 2HB GLN 58 -3.161 -7.700 14.390 849 HB3 GLN 58 3HB GLN 58 -2.947 -8.355 15.995 850 HG2 GLN 58 2HG GLN 58 -0.936 -6.790 14.385 851 HG3 GLN 58 3HG GLN 58 -1.565 -6.466 15.993 852 HE21 GLN 58 1HE2 GLN 58 1.097 -7.663 14.316 853 HE22 GLN 58 2HE2 GLN 58 1.817 -8.654 15.602 854 H ARG 59 HN ARG 59 -3.910 -9.966 12.742 855 HA ARG 59 HA ARG 59 -5.910 -11.237 14.346 856 HE ARG 59 HE ARG 59 -7.165 -7.498 11.309 857 HB2 ARG 59 2HB ARG 59 -5.470 -11.613 11.356 858 HB3 ARG 59 3HB ARG 59 -6.948 -11.878 12.273 859 HG2 ARG 59 2HG ARG 59 -7.073 -9.489 12.890 860 HG3 ARG 59 3HG ARG 59 -5.576 -9.169 12.012 861 HD2 ARG 59 2HD ARG 59 -6.701 -10.003 9.921 862 HD3 ARG 59 3HD ARG 59 -8.235 -9.990 10.828 863 HH11 ARG 59 1HH1 ARG 59 -8.000 -9.135 8.305 864 HH12 ARG 59 2HH1 ARG 59 -7.931 -7.626 7.393 865 HH21 ARG 59 1HH2 ARG 59 -7.224 -5.660 10.128 866 HH22 ARG 59 2HH2 ARG 59 -7.542 -5.729 8.401 867 H ARG 60 HN ARG 60 -3.056 -12.545 12.661 868 HA ARG 60 HA ARG 60 -3.763 -15.358 12.841 869 HE ARG 60 HE ARG 60 0.713 -17.969 12.309 870 HB2 ARG 60 2HB ARG 60 -1.976 -14.476 11.341 871 HB3 ARG 60 3HB ARG 60 -1.026 -14.016 12.761 872 HG2 ARG 60 2HG ARG 60 -0.821 -16.378 13.441 873 HG3 ARG 60 3HG ARG 60 -1.667 -16.853 11.961 874 HD2 ARG 60 2HD ARG 60 0.127 -15.639 10.648 875 HD3 ARG 60 3HD ARG 60 0.928 -15.255 12.174 876 HH11 ARG 60 1HH1 ARG 60 2.110 -15.946 9.735 877 HH12 ARG 60 2HH1 ARG 60 3.355 -17.132 9.431 878 HH21 ARG 60 1HH2 ARG 60 2.260 -19.425 11.730 879 HH22 ARG 60 2HH2 ARG 60 3.398 -19.046 10.460 880 H HIS 61 HN HIS 61 -2.225 -13.030 15.086 881 HA HIS 61 HA HIS 61 -1.440 -15.154 16.986 882 HD1 HIS 61 1HD HIS 61 0.925 -15.086 18.245 883 HD2 HIS 61 2HD HIS 61 1.088 -11.776 15.641 884 HE1 HIS 61 1HE HIS 61 3.330 -14.947 17.363 885 HB2 HIS 61 2HB HIS 61 -1.203 -12.124 16.909 886 HB3 HIS 61 3HB HIS 61 -0.986 -12.996 18.419 887 H THR 62 HN THR 62 -3.846 -12.505 16.776 888 HA THR 62 HA THR 62 -5.035 -13.077 19.362 889 HB THR 62 HB THR 62 -6.858 -11.551 18.559 890 HG1 THR 62 1HG THR 62 -5.254 -11.218 16.280 891 HG21 THR 62 3HG2 THR 62 -5.499 -9.516 18.244 892 HG22 THR 62 1HG2 THR 62 -4.044 -10.492 17.953 893 HG23 THR 62 2HG2 THR 62 -4.830 -10.522 19.540 894 H GLY 63 HN GLY 63 -5.507 -14.305 16.081 895 HA2 GLY 63 2HA GLY 63 -6.712 -16.204 15.437 896 HA3 GLY 63 3HA GLY 63 -7.360 -16.355 17.081 897 H VAL 64 HN VAL 64 -7.799 -13.158 16.123 898 HA VAL 64 HA VAL 64 -10.640 -13.447 16.135 899 HB VAL 64 HB VAL 64 -9.238 -11.447 16.841 900 HG11 VAL 64 1HG1 VAL 64 -8.686 -9.684 15.366 901 HG12 VAL 64 2HG1 VAL 64 -7.979 -11.153 14.675 902 HG13 VAL 64 3HG1 VAL 64 -9.455 -10.472 13.973 903 HG21 VAL 64 3HG2 VAL 64 -11.674 -11.418 16.801 904 HG22 VAL 64 1HG2 VAL 64 -11.010 -9.843 16.352 905 HG23 VAL 64 2HG2 VAL 64 -11.670 -10.908 15.100 906 H LYS 65 HN LYS 65 -12.111 -13.754 14.582 907 HA LYS 65 HA LYS 65 -11.319 -13.337 11.726 908 HB2 LYS 65 2HB LYS 65 -12.843 -15.667 12.944 909 HB3 LYS 65 3HB LYS 65 -12.790 -15.337 11.209 910 HG2 LYS 65 2HG LYS 65 -10.476 -15.813 11.063 911 HG3 LYS 65 3HG LYS 65 -10.261 -15.751 12.823 912 HD2 LYS 65 2HD LYS 65 -11.766 -17.812 12.963 913 HD3 LYS 65 3HD LYS 65 -11.690 -17.880 11.192 914 HE2 LYS 65 2HE LYS 65 -9.985 -19.356 11.960 915 HE3 LYS 65 3HE LYS 65 -9.153 -17.893 11.403 916 HZ1 LYS 65 3HZ LYS 65 -9.117 -17.170 13.744 917 HZ2 LYS 65 1HZ LYS 65 -8.281 -18.574 13.506 918 HZ3 LYS 65 2HZ LYS 65 -9.774 -18.596 14.201 919 HA PRO 66 HA PRO 66 -15.158 -11.048 12.865 920 HB2 PRO 66 2HB PRO 66 -14.551 -8.627 11.739 921 HB3 PRO 66 3HB PRO 66 -13.842 -9.173 13.287 922 HG2 PRO 66 2HG PRO 66 -12.613 -9.338 10.521 923 HG3 PRO 66 3HG PRO 66 -11.868 -8.705 12.022 924 HD2 PRO 66 2HD PRO 66 -11.456 -11.252 11.133 925 HD3 PRO 66 3HD PRO 66 -11.527 -10.868 12.874 926 H PHE 67 HN PHE 67 -13.736 -12.025 9.875 927 HA PHE 67 HA PHE 67 -16.025 -11.003 8.259 928 HD1 PHE 67 2HD PHE 67 -15.023 -9.446 5.934 929 HD2 PHE 67 1HD PHE 67 -11.840 -10.965 8.399 930 HE1 PHE 67 2HE PHE 67 -13.844 -7.274 5.751 931 HE2 PHE 67 1HE PHE 67 -10.627 -8.805 8.176 932 HZ PHE 67 HZ PHE 67 -11.646 -6.947 6.866 933 HB2 PHE 67 2HB PHE 67 -13.464 -12.453 7.464 934 HB3 PHE 67 3HB PHE 67 -14.636 -11.911 6.333 935 H GLN 68 HN GLN 68 -17.473 -12.511 9.606 936 HA GLN 68 HA GLN 68 -17.312 -15.354 8.824 937 HB2 GLN 68 2HB GLN 68 -19.241 -15.652 10.260 938 HB3 GLN 68 3HB GLN 68 -17.984 -14.782 11.106 939 HG2 GLN 68 2HG GLN 68 -20.489 -13.455 9.990 940 HG3 GLN 68 3HG GLN 68 -20.274 -14.022 11.643 941 HE21 GLN 68 1HE2 GLN 68 -19.460 -11.444 9.380 942 HE22 GLN 68 2HE2 GLN 68 -18.457 -10.573 10.577 943 H CYS 69 HN CYS 69 -18.474 -16.384 7.311 944 HA CYS 69 HA CYS 69 -19.770 -14.904 5.264 945 HB2 CYS 69 2HB CYS 69 -18.802 -17.123 4.855 946 HB3 CYS 69 3HB CYS 69 -19.965 -17.874 5.959 947 H LYS 70 HN LYS 70 -21.748 -14.044 5.088 948 HA LYS 70 HA LYS 70 -23.799 -14.252 7.030 949 HB2 LYS 70 2HB LYS 70 -25.241 -13.169 5.309 950 HB3 LYS 70 3HB LYS 70 -23.684 -12.393 5.507 951 HG2 LYS 70 2HG LYS 70 -23.389 -12.461 3.318 952 HG3 LYS 70 3HG LYS 70 -23.215 -14.203 3.382 953 HD2 LYS 70 2HD LYS 70 -25.866 -12.746 2.981 954 HD3 LYS 70 3HD LYS 70 -24.830 -13.366 1.687 955 HE2 LYS 70 2HE LYS 70 -25.024 -15.664 2.677 956 HE3 LYS 70 3HE LYS 70 -26.206 -15.023 3.835 957 HZ1 LYS 70 3HZ LYS 70 -27.262 -16.001 1.928 958 HZ2 LYS 70 1HZ LYS 70 -26.482 -14.976 0.905 959 HZ3 LYS 70 2HZ LYS 70 -27.584 -14.386 1.979 960 H THR 71 HN THR 71 -22.824 -16.632 4.785 961 HA THR 71 HA THR 71 -25.564 -17.782 4.485 962 HB THR 71 HB THR 71 -23.247 -19.145 3.178 963 HG1 THR 71 1HG THR 71 -22.508 -17.211 2.805 964 HG21 THR 71 3HG2 THR 71 -25.901 -18.124 2.112 965 HG22 THR 71 1HG2 THR 71 -25.597 -19.765 2.739 966 HG23 THR 71 2HG2 THR 71 -24.758 -19.201 1.281 967 H CYS 72 HN CYS 72 -22.220 -19.040 5.114 968 HA CYS 72 HA CYS 72 -23.475 -21.214 6.763 969 HB2 CYS 72 2HB CYS 72 -21.427 -22.506 6.151 970 HB3 CYS 72 3HB CYS 72 -22.366 -22.000 4.725 971 H GLN 73 HN GLN 73 -21.939 -18.328 7.228 972 HA GLN 73 HA GLN 73 -20.810 -17.384 8.990 973 HB2 GLN 73 2HB GLN 73 -22.501 -19.164 10.182 974 HB3 GLN 73 3HB GLN 73 -20.953 -19.803 10.740 975 HG2 GLN 73 2HG GLN 73 -21.570 -18.257 12.381 976 HG3 GLN 73 3HG GLN 73 -20.405 -17.352 11.434 977 HE21 GLN 73 1HE2 GLN 73 -22.355 -16.414 9.152 978 HE22 GLN 73 2HE2 GLN 73 -23.450 -15.452 10.140 979 H ARG 74 HN ARG 74 -19.486 -19.603 7.093 980 HA ARG 74 HA ARG 74 -17.087 -20.487 8.267 981 HE ARG 74 HE ARG 74 -14.486 -21.432 5.416 982 HB2 ARG 74 2HB ARG 74 -17.901 -19.582 5.517 983 HB3 ARG 74 3HB ARG 74 -16.200 -19.668 5.824 984 HG2 ARG 74 2HG ARG 74 -18.108 -22.009 6.230 985 HG3 ARG 74 3HG ARG 74 -17.088 -21.740 4.815 986 HD2 ARG 74 2HD ARG 74 -16.233 -22.446 7.631 987 HD3 ARG 74 3HD ARG 74 -15.958 -23.351 6.145 988 HH11 ARG 74 1HH1 ARG 74 -14.721 -22.055 8.892 989 HH12 ARG 74 2HH1 ARG 74 -13.523 -20.809 9.227 990 HH21 ARG 74 1HH2 ARG 74 -13.070 -19.842 6.005 991 HH22 ARG 74 2HH2 ARG 74 -12.694 -19.585 7.688 992 H LYS 75 HN LYS 75 -15.924 -19.296 9.676 993 HA LYS 75 HA LYS 75 -15.772 -16.441 9.391 994 HB2 LYS 75 2HB LYS 75 -15.140 -18.506 11.442 995 HB3 LYS 75 3HB LYS 75 -14.052 -17.132 11.470 996 HG2 LYS 75 2HG LYS 75 -15.963 -15.580 11.523 997 HG3 LYS 75 3HG LYS 75 -17.084 -16.962 11.546 998 HD2 LYS 75 2HD LYS 75 -16.085 -17.710 13.695 999 HD3 LYS 75 3HD LYS 75 -15.007 -16.306 13.685 1000 HE2 LYS 75 2HE LYS 75 -18.058 -16.200 13.750 1001 HE3 LYS 75 3HE LYS 75 -16.987 -15.992 15.144 1002 HZ1 LYS 75 3HZ LYS 75 -17.179 -14.215 12.803 1003 HZ2 LYS 75 1HZ LYS 75 -16.004 -14.086 13.924 1004 HZ3 LYS 75 2HZ LYS 75 -17.590 -13.861 14.345 1005 H PHE 76 HN PHE 76 -14.187 -15.149 8.721 1006 HA PHE 76 HA PHE 76 -11.492 -16.323 8.167 1007 HD1 PHE 76 1HD PHE 76 -11.071 -17.299 5.359 1008 HD2 PHE 76 2HD PHE 76 -15.009 -15.602 5.865 1009 HE1 PHE 76 1HE PHE 76 -12.051 -19.159 4.072 1010 HE2 PHE 76 2HE PHE 76 -15.991 -17.501 4.667 1011 HZ PHE 76 HZ PHE 76 -14.525 -19.324 3.797 1012 HB2 PHE 76 2HB PHE 76 -13.015 -14.325 6.422 1013 HB3 PHE 76 3HB PHE 76 -11.405 -14.938 6.113 1014 H SER 77 HN SER 77 -9.754 -14.701 8.091 1015 HA SER 77 HA SER 77 -10.335 -12.328 9.825 1016 HG SER 77 HG SER 77 -8.912 -13.610 11.811 1017 HB2 SER 77 2HB SER 77 -7.696 -13.737 9.239 1018 HB3 SER 77 3HB SER 77 -7.900 -12.349 10.306 1019 H ARG 78 HN ARG 78 -10.122 -13.042 6.612 1020 HA ARG 78 HA ARG 78 -8.858 -10.421 5.931 1021 HE ARG 78 HE ARG 78 -6.042 -13.111 3.218 1022 HB2 ARG 78 2HB ARG 78 -8.221 -13.162 4.767 1023 HB3 ARG 78 3HB ARG 78 -7.841 -11.643 3.938 1024 HG2 ARG 78 2HG ARG 78 -6.305 -10.938 5.553 1025 HG3 ARG 78 3HG ARG 78 -6.859 -12.095 6.758 1026 HD2 ARG 78 2HD ARG 78 -4.693 -12.741 5.888 1027 HD3 ARG 78 3HD ARG 78 -5.924 -13.958 5.583 1028 HH11 ARG 78 2HH2 ARG 78 -3.002 -12.501 4.923 1029 HH12 ARG 78 1HH2 ARG 78 -2.103 -12.888 3.452 1030 HH21 ARG 78 1HH1 ARG 78 -4.795 -13.795 1.616 1031 HH22 ARG 78 2HH1 ARG 78 -3.093 -13.400 1.554 1032 H SER 79 HN SER 79 -10.286 -9.234 4.867 1033 HA SER 79 HA SER 79 -12.737 -10.018 3.862 1034 HG SER 79 HG SER 79 -13.183 -8.235 1.745 1035 HB2 SER 79 2HB SER 79 -11.860 -7.646 4.199 1036 HB3 SER 79 3HB SER 79 -11.070 -7.789 2.626 1037 H ASP 80 HN ASP 80 -9.609 -10.038 2.106 1038 HA ASP 80 HA ASP 80 -10.661 -10.543 -0.494 1039 HB2 ASP 80 2HB ASP 80 -8.328 -11.457 -0.947 1040 HB3 ASP 80 3HB ASP 80 -8.498 -9.808 -0.329 1041 H HIS 81 HN HIS 81 -9.353 -12.909 1.932 1042 HA HIS 81 HA HIS 81 -10.123 -15.270 0.581 1043 HD1 HIS 81 1HD HIS 81 -7.851 -15.949 4.648 1044 HD2 HIS 81 2HD HIS 81 -7.737 -15.020 0.549 1045 HE1 HIS 81 1HE HIS 81 -5.501 -15.971 4.047 1046 HB2 HIS 81 2HB HIS 81 -10.022 -14.731 3.582 1047 HB3 HIS 81 3HB HIS 81 -10.166 -16.325 2.852 1048 H LEU 82 HN LEU 82 -12.092 -13.152 2.744 1049 HA LEU 82 HA LEU 82 -14.397 -14.899 2.800 1050 HG LEU 82 HG LEU 82 -16.489 -13.781 3.161 1051 HB2 LEU 82 2HB LEU 82 -14.115 -13.117 4.416 1052 HB3 LEU 82 3HB LEU 82 -14.177 -11.866 3.172 1053 HD11 LEU 82 1HD1 LEU 82 -16.088 -13.498 5.559 1054 HD12 LEU 82 2HD1 LEU 82 -17.656 -12.957 5.003 1055 HD13 LEU 82 3HD1 LEU 82 -16.448 -11.731 5.365 1056 HD21 LEU 82 3HD2 LEU 82 -16.387 -10.730 3.126 1057 HD22 LEU 82 1HD2 LEU 82 -17.822 -11.740 2.848 1058 HD23 LEU 82 2HD2 LEU 82 -16.499 -11.763 1.690 1059 H LYS 83 HN LYS 83 -13.530 -12.071 0.723 1060 HA LYS 83 HA LYS 83 -15.841 -12.150 -0.982 1061 HB2 LYS 83 2HB LYS 83 -14.149 -10.309 -0.844 1062 HB3 LYS 83 3HB LYS 83 -12.975 -11.331 -1.676 1063 HG2 LYS 83 2HG LYS 83 -14.400 -11.361 -3.690 1064 HG3 LYS 83 3HG LYS 83 -15.650 -10.430 -2.835 1065 HD2 LYS 83 2HD LYS 83 -14.028 -8.566 -2.516 1066 HD3 LYS 83 3HD LYS 83 -12.802 -9.471 -3.414 1067 HE2 LYS 83 2HE LYS 83 -15.498 -8.571 -4.526 1068 HE3 LYS 83 3HE LYS 83 -13.966 -7.717 -4.760 1069 HZ1 LYS 83 3HZ LYS 83 -14.552 -10.456 -5.679 1070 HZ2 LYS 83 1HZ LYS 83 -13.103 -9.692 -5.837 1071 HZ3 LYS 83 2HZ LYS 83 -14.421 -9.113 -6.632 1072 H THR 84 HN THR 84 -12.785 -13.974 -0.979 1073 HA THR 84 HA THR 84 -13.170 -15.269 -3.537 1074 HB THR 84 HB THR 84 -11.566 -15.989 -1.062 1075 HG1 THR 84 1HG THR 84 -10.867 -14.157 -1.932 1076 HG21 THR 84 3HG2 THR 84 -10.147 -17.383 -2.405 1077 HG22 THR 84 1HG2 THR 84 -11.343 -17.292 -3.748 1078 HG23 THR 84 2HG2 THR 84 -11.754 -18.078 -2.201 1079 H HIS 85 HN HIS 85 -13.701 -16.331 -0.124 1080 HA HIS 85 HA HIS 85 -14.872 -18.863 -0.752 1081 HD1 HIS 85 1HD HIS 85 -15.965 -20.761 1.590 1082 HD2 HIS 85 2HD HIS 85 -17.351 -16.873 2.482 1083 HE1 HIS 85 1HE HIS 85 -18.370 -20.990 2.504 1084 HB2 HIS 85 2HB HIS 85 -14.120 -18.566 1.464 1085 HB3 HIS 85 3HB HIS 85 -14.914 -17.009 1.638 1086 H THR 86 HN THR 86 -16.183 -15.595 -0.547 1087 HA THR 86 HA THR 86 -18.940 -16.089 -0.457 1088 HB THR 86 HB THR 86 -17.364 -13.964 -1.939 1089 HG1 THR 86 1HG THR 86 -17.166 -14.004 0.306 1090 HG21 THR 86 3HG2 THR 86 -20.326 -13.908 -1.421 1091 HG22 THR 86 1HG2 THR 86 -19.466 -13.776 -2.991 1092 HG23 THR 86 2HG2 THR 86 -19.294 -12.498 -1.789 1093 H ARG 87 HN ARG 87 -16.668 -16.288 -3.246 1094 HA ARG 87 HA ARG 87 -18.679 -16.480 -5.303 1095 HE ARG 87 HE ARG 87 -16.157 -13.732 -7.836 1096 HB2 ARG 87 2HB ARG 87 -15.904 -17.701 -5.312 1097 HB3 ARG 87 3HB ARG 87 -16.907 -17.331 -6.702 1098 HG2 ARG 87 2HG ARG 87 -15.350 -15.426 -4.947 1099 HG3 ARG 87 3HG ARG 87 -15.287 -15.659 -6.689 1100 HD2 ARG 87 2HD ARG 87 -17.865 -14.851 -6.448 1101 HD3 ARG 87 3HD ARG 87 -17.191 -14.058 -5.026 1102 HH11 ARG 87 1HH1 ARG 87 -16.956 -12.150 -4.799 1103 HH12 ARG 87 2HH1 ARG 87 -16.931 -10.559 -5.539 1104 HH21 ARG 87 1HH2 ARG 87 -16.083 -11.755 -8.664 1105 HH22 ARG 87 2HH2 ARG 87 -16.337 -10.323 -7.673 1106 H THR 88 HN THR 88 -17.407 -18.805 -2.999 1107 HA THR 88 HA THR 88 -18.133 -21.266 -4.181 1108 HB THR 88 HB THR 88 -18.699 -20.641 -1.259 1109 HG1 THR 88 1HG THR 88 -16.820 -19.911 -1.375 1110 HG21 THR 88 3HG2 THR 88 -17.850 -22.967 -0.952 1111 HG22 THR 88 1HG2 THR 88 -17.770 -23.130 -2.720 1112 HG23 THR 88 2HG2 THR 88 -19.334 -22.882 -1.919 1113 H HIS 89 HN HIS 89 -20.192 -18.863 -2.485 1114 HA HIS 89 HA HIS 89 -22.616 -20.516 -3.064 1115 HD1 HIS 89 1HD HIS 89 -22.819 -21.625 -0.533 1116 HD2 HIS 89 2HD HIS 89 -21.182 -17.935 0.685 1117 HE1 HIS 89 1HE HIS 89 -21.739 -21.993 1.778 1118 HB2 HIS 89 2HB HIS 89 -22.422 -17.871 -1.574 1119 HB3 HIS 89 3HB HIS 89 -23.786 -18.983 -1.599 1120 H THR 90 HN THR 90 -20.943 -17.558 -3.966 1121 HA THR 90 HA THR 90 -23.239 -16.434 -5.328 1122 HB THR 90 HB THR 90 -20.344 -15.491 -5.445 1123 HG1 THR 90 1HG THR 90 -20.920 -15.717 -3.324 1124 HG21 THR 90 3HG2 THR 90 -21.331 -13.224 -5.500 1125 HG22 THR 90 1HG2 THR 90 -22.936 -13.951 -5.712 1126 HG23 THR 90 2HG2 THR 90 -21.682 -14.151 -6.960 1127 H GLY 91 HN GLY 91 -20.825 -18.693 -6.427 1128 HA2 GLY 91 2HA GLY 91 -20.895 -19.809 -8.473 1129 HA3 GLY 91 3HA GLY 91 -22.204 -18.740 -9.005 1130 H GLU 92 HN GLU 92 -20.258 -16.393 -8.225 1131 HA GLU 92 HA GLU 92 -19.403 -15.905 -10.903 1132 HB2 GLU 92 2HB GLU 92 -20.049 -14.268 -9.001 1133 HB3 GLU 92 3HB GLU 92 -18.400 -14.387 -8.453 1134 HG2 GLU 92 2HG GLU 92 -19.337 -13.463 -11.201 1135 HG3 GLU 92 3HG GLU 92 -18.853 -12.410 -9.874 1136 H LYS 93 HN LYS 93 -17.952 -17.442 -11.665 1137 HA LYS 93 HA LYS 93 -15.263 -17.527 -10.336 1138 HB2 LYS 93 2HB LYS 93 -16.637 -19.592 -12.112 1139 HB3 LYS 93 3HB LYS 93 -14.992 -19.723 -11.491 1140 HG2 LYS 93 2HG LYS 93 -16.122 -19.461 -9.145 1141 HG3 LYS 93 3HG LYS 93 -17.619 -19.849 -9.972 1142 HD2 LYS 93 2HD LYS 93 -15.115 -21.591 -10.009 1143 HD3 LYS 93 3HD LYS 93 -16.480 -21.821 -8.908 1144 HE2 LYS 93 2HE LYS 93 -17.994 -22.288 -10.731 1145 HE3 LYS 93 3HE LYS 93 -16.773 -21.838 -11.936 1146 HZ1 LYS 93 3HZ LYS 93 -16.964 -24.231 -11.631 1147 HZ2 LYS 93 1HZ LYS 93 -16.481 -24.088 -10.060 1148 HZ3 LYS 93 2HZ LYS 93 -15.452 -23.672 -11.286 1149 HA PRO 94 HA PRO 94 -14.811 -15.273 -14.259 1150 HB2 PRO 94 2HB PRO 94 -12.925 -13.443 -13.495 1151 HB3 PRO 94 3HB PRO 94 -14.622 -13.360 -12.950 1152 HG2 PRO 94 2HG PRO 94 -12.241 -14.486 -11.465 1153 HG3 PRO 94 3HG PRO 94 -13.504 -13.375 -10.851 1154 HD2 PRO 94 2HD PRO 94 -13.544 -16.092 -10.467 1155 HD3 PRO 94 3HD PRO 94 -15.037 -15.120 -10.589 1156 H PHE 95 HN PHE 95 -12.290 -17.004 -12.466 1157 HA PHE 95 HA PHE 95 -10.242 -16.570 -14.569 1158 HD1 PHE 95 2HD PHE 95 -7.971 -15.662 -13.264 1159 HD2 PHE 95 1HD PHE 95 -10.952 -16.965 -10.448 1160 HE1 PHE 95 2HE PHE 95 -7.535 -13.650 -11.882 1161 HE2 PHE 95 1HE PHE 95 -10.483 -14.962 -9.035 1162 HZ PHE 95 HZ PHE 95 -8.803 -13.302 -9.762 1163 HB2 PHE 95 2HB PHE 95 -10.221 -18.427 -12.151 1164 HB3 PHE 95 3HB PHE 95 -8.849 -18.028 -13.180 1165 H SER 96 HN SER 96 -11.544 -17.430 -16.369 1166 HA SER 96 HA SER 96 -12.088 -20.312 -16.329 1167 HG SER 96 HG SER 96 -13.195 -21.021 -17.978 1168 HB2 SER 96 2HB SER 96 -13.622 -18.587 -17.366 1169 HB3 SER 96 3HB SER 96 -12.413 -18.387 -18.651 1170 H CYS 97 HN CYS 97 -11.134 -21.900 -17.567 1171 HA CYS 97 HA CYS 97 -8.353 -21.504 -18.207 1172 HB2 CYS 97 2HB CYS 97 -9.392 -23.676 -17.433 1173 HB3 CYS 97 3HB CYS 97 -10.137 -23.831 -19.028 1174 H ARG 98 HN ARG 98 -7.283 -21.759 -20.218 1175 HA ARG 98 HA ARG 98 -8.911 -20.837 -22.550 1176 HE ARG 98 HE ARG 98 -8.895 -17.435 -23.517 1177 HB2 ARG 98 2HB ARG 98 -6.043 -20.071 -21.864 1178 HB3 ARG 98 3HB ARG 98 -6.980 -19.493 -23.235 1179 HG2 ARG 98 2HG ARG 98 -7.386 -18.833 -20.302 1180 HG3 ARG 98 3HG ARG 98 -6.924 -17.756 -21.610 1181 HD2 ARG 98 2HD ARG 98 -9.650 -18.941 -21.032 1182 HD3 ARG 98 3HD ARG 98 -9.179 -17.260 -21.056 1183 HH11 ARG 98 1HH2 ARG 98 -10.963 -19.944 -22.062 1184 HH12 ARG 98 2HH2 ARG 98 -11.901 -20.061 -23.547 1185 HH21 ARG 98 1HH1 ARG 98 -10.079 -17.789 -25.337 1186 HH22 ARG 98 2HH1 ARG 98 -11.355 -18.982 -25.337 1187 H TRP 99 HN TRP 99 -7.609 -23.545 -21.465 1188 HA TRP 99 HA TRP 99 -5.681 -24.300 -23.456 1189 HD1 TRP 99 1HD TRP 99 -5.476 -23.872 -20.307 1190 HE1 TRP 99 1HE TRP 99 -3.099 -24.336 -19.477 1191 HE3 TRP 99 3HE TRP 99 -4.617 -28.265 -22.780 1192 HZ2 TRP 99 2HZ TRP 99 -1.045 -26.313 -19.909 1193 HZ3 TRP 99 3HZ TRP 99 -2.419 -29.403 -22.579 1194 HH2 TRP 99 2HH TRP 99 -0.627 -28.434 -21.162 1195 HB2 TRP 99 2HB TRP 99 -7.392 -25.747 -21.431 1196 HB3 TRP 99 3HB TRP 99 -6.614 -26.691 -22.683 1197 HA PRO 100 HA PRO 100 -7.650 -25.052 -27.206 1198 HB2 PRO 100 2HB PRO 100 -6.918 -27.992 -26.947 1199 HB3 PRO 100 3HB PRO 100 -6.710 -26.909 -28.359 1200 HG2 PRO 100 2HG PRO 100 -4.599 -27.437 -26.765 1201 HG3 PRO 100 3HG PRO 100 -4.904 -25.750 -27.289 1202 HD2 PRO 100 2HD PRO 100 -5.515 -27.035 -24.634 1203 HD3 PRO 100 3HD PRO 100 -4.876 -25.401 -24.995 1204 H SER 101 HN SER 101 -8.504 -27.545 -24.777 1205 HA SER 101 HA SER 101 -11.340 -27.307 -25.559 1206 HG SER 101 HG SER 101 -9.820 -30.177 -24.425 1207 HB2 SER 101 2HB SER 101 -11.659 -29.725 -25.787 1208 HB3 SER 101 3HB SER 101 -10.468 -29.171 -26.977 1209 H CYS 102 HN CYS 102 -11.557 -26.290 -23.518 1210 HA CYS 102 HA CYS 102 -12.003 -28.166 -21.328 1211 HB2 CYS 102 2HB CYS 102 -9.667 -27.898 -20.866 1212 HB3 CYS 102 3HB CYS 102 -9.704 -26.159 -21.190 1213 H GLN 103 HN GLN 103 -11.120 -24.702 -21.227 1214 HA GLN 103 HA GLN 103 -12.299 -22.826 -20.650 1215 HB2 GLN 103 2HB GLN 103 -14.523 -24.342 -22.122 1216 HB3 GLN 103 3HB GLN 103 -14.708 -22.702 -21.522 1217 HG2 GLN 103 2HG GLN 103 -14.094 -22.784 -23.909 1218 HG3 GLN 103 3HG GLN 103 -13.007 -21.832 -22.910 1219 HE21 GLN 103 1HE2 GLN 103 -10.766 -22.307 -22.976 1220 HE22 GLN 103 2HE2 GLN 103 -10.161 -23.708 -23.890 1221 H LYS 104 HN LYS 104 -12.006 -24.872 -18.615 1222 HA LYS 104 HA LYS 104 -14.440 -24.985 -16.999 1223 HB2 LYS 104 2HB LYS 104 -11.551 -25.704 -16.667 1224 HB3 LYS 104 3HB LYS 104 -12.265 -25.047 -15.237 1225 HG2 LYS 104 2HG LYS 104 -12.694 -27.202 -14.847 1226 HG3 LYS 104 3HG LYS 104 -14.216 -26.756 -15.598 1227 HD2 LYS 104 2HD LYS 104 -11.862 -28.138 -16.969 1228 HD3 LYS 104 3HD LYS 104 -13.292 -28.959 -16.342 1229 HE2 LYS 104 2HE LYS 104 -14.738 -27.823 -17.956 1230 HE3 LYS 104 3HE LYS 104 -13.372 -26.837 -18.514 1231 HZ1 LYS 104 3HZ LYS 104 -13.496 -29.757 -18.771 1232 HZ2 LYS 104 1HZ LYS 104 -12.272 -28.745 -19.260 1233 HZ3 LYS 104 2HZ LYS 104 -13.742 -28.639 -19.976 1234 H LYS 105 HN LYS 105 -14.409 -23.854 -14.755 1235 HA LYS 105 HA LYS 105 -13.310 -21.088 -15.007 1236 HB2 LYS 105 2HB LYS 105 -16.125 -21.836 -14.062 1237 HB3 LYS 105 3HB LYS 105 -15.358 -20.266 -13.872 1238 HG2 LYS 105 2HG LYS 105 -16.574 -19.816 -15.707 1239 HG3 LYS 105 3HG LYS 105 -15.066 -20.309 -16.467 1240 HD2 LYS 105 2HD LYS 105 -16.073 -22.582 -16.895 1241 HD3 LYS 105 3HD LYS 105 -17.536 -22.060 -16.054 1242 HE2 LYS 105 2HE LYS 105 -17.997 -21.851 -18.371 1243 HE3 LYS 105 3HE LYS 105 -17.766 -20.203 -17.762 1244 HZ1 LYS 105 3HZ LYS 105 -15.489 -20.320 -18.637 1245 HZ2 LYS 105 1HZ LYS 105 -16.600 -20.562 -19.834 1246 HZ3 LYS 105 2HZ LYS 105 -15.763 -21.834 -19.195 1247 H PHE 106 HN PHE 106 -12.411 -20.237 -13.179 1248 HA PHE 106 HA PHE 106 -12.820 -21.711 -10.599 1249 HD1 PHE 106 1HD PHE 106 -11.087 -23.665 -9.774 1250 HD2 PHE 106 2HD PHE 106 -9.900 -21.993 -13.561 1251 HE1 PHE 106 1HE PHE 106 -10.879 -25.952 -10.723 1252 HE2 PHE 106 2HE PHE 106 -9.714 -24.277 -14.520 1253 HZ PHE 106 HZ PHE 106 -10.251 -26.252 -13.106 1254 HB2 PHE 106 2HB PHE 106 -10.197 -20.561 -11.668 1255 HB3 PHE 106 3HB PHE 106 -10.441 -21.218 -10.053 1256 H ALA 107 HN ALA 107 -12.602 -20.435 -8.694 1257 HA ALA 107 HA ALA 107 -13.436 -17.632 -9.161 1258 HB1 ALA 107 1HB ALA 107 -14.779 -19.036 -7.596 1259 HB2 ALA 107 2HB ALA 107 -13.337 -19.330 -6.613 1260 HB3 ALA 107 3HB ALA 107 -14.005 -17.696 -6.740 1261 H ARG 108 HN ARG 108 -10.530 -19.265 -8.708 1262 HA ARG 108 HA ARG 108 -9.271 -16.810 -7.576 1263 HE ARG 108 HE ARG 108 -7.269 -19.729 -4.785 1264 HB2 ARG 108 2HB ARG 108 -8.542 -19.675 -6.866 1265 HB3 ARG 108 3HB ARG 108 -7.720 -18.197 -6.343 1266 HG2 ARG 108 2HG ARG 108 -9.330 -17.594 -4.851 1267 HG3 ARG 108 3HG ARG 108 -10.620 -18.512 -5.641 1268 HD2 ARG 108 2HD ARG 108 -9.951 -19.510 -3.502 1269 HD3 ARG 108 3HD ARG 108 -9.788 -20.603 -4.871 1270 HH11 ARG 108 1HH2 ARG 108 -9.276 -20.550 -2.041 1271 HH12 ARG 108 2HH2 ARG 108 -7.924 -21.209 -1.140 1272 HH21 ARG 108 1HH1 ARG 108 -5.615 -20.650 -3.685 1273 HH22 ARG 108 2HH1 ARG 108 -5.890 -21.280 -2.069 1274 H SER 109 HN SER 109 -7.413 -16.172 -8.522 1275 HA SER 109 HA SER 109 -6.734 -17.032 -11.124 1276 HG SER 109 HG SER 109 -5.544 -14.484 -8.506 1277 HB2 SER 109 2HB SER 109 -4.559 -15.752 -10.629 1278 HB3 SER 109 3HB SER 109 -6.055 -14.840 -10.460 1279 H ASP 110 HN ASP 110 -5.219 -17.785 -7.948 1280 HA ASP 110 HA ASP 110 -3.143 -19.414 -9.024 1281 HB2 ASP 110 2HB ASP 110 -2.669 -20.042 -6.820 1282 HB3 ASP 110 3HB ASP 110 -3.201 -18.373 -6.738 1283 H GLU 111 HN GLU 111 -6.523 -20.188 -8.076 1284 HA GLU 111 HA GLU 111 -6.292 -23.064 -8.187 1285 HB2 GLU 111 2HB GLU 111 -8.604 -21.113 -8.460 1286 HB3 GLU 111 3HB GLU 111 -8.799 -22.779 -8.968 1287 HG2 GLU 111 2HG GLU 111 -8.005 -23.582 -6.756 1288 HG3 GLU 111 3HG GLU 111 -8.003 -21.916 -6.178 1289 H LEU 112 HN LEU 112 -7.037 -20.550 -10.666 1290 HA LEU 112 HA LEU 112 -7.271 -22.396 -12.864 1291 HG LEU 112 HG LEU 112 -5.774 -20.599 -14.951 1292 HB2 LEU 112 2HB LEU 112 -8.054 -20.089 -12.993 1293 HB3 LEU 112 3HB LEU 112 -6.410 -19.467 -12.821 1294 HD11 LEU 112 1HD1 LEU 112 -7.454 -21.470 -16.422 1295 HD12 LEU 112 2HD1 LEU 112 -8.760 -21.146 -15.280 1296 HD13 LEU 112 3HD1 LEU 112 -7.530 -22.405 -14.958 1297 HD21 LEU 112 3HD2 LEU 112 -6.502 -18.232 -14.934 1298 HD22 LEU 112 1HD2 LEU 112 -8.167 -18.764 -15.278 1299 HD23 LEU 112 2HD2 LEU 112 -6.879 -19.067 -16.452 1300 H VAL 113 HN VAL 113 -4.442 -20.431 -11.691 1301 HA VAL 113 HA VAL 113 -2.490 -21.414 -13.412 1302 HB VAL 113 HB VAL 113 -2.211 -20.788 -10.441 1303 HG11 VAL 113 1HG1 VAL 113 -0.031 -21.035 -12.538 1304 HG12 VAL 113 2HG1 VAL 113 0.185 -20.316 -10.928 1305 HG13 VAL 113 3HG1 VAL 113 -0.227 -22.023 -11.074 1306 HG21 VAL 113 3HG2 VAL 113 -1.595 -18.579 -10.989 1307 HG22 VAL 113 1HG2 VAL 113 -1.368 -18.973 -12.705 1308 HG23 VAL 113 2HG2 VAL 113 -2.984 -18.881 -12.051 1309 H ARG 114 HN ARG 114 -3.745 -22.965 -10.463 1310 HA ARG 114 HA ARG 114 -1.862 -25.198 -10.482 1311 HE ARG 114 HE ARG 114 -2.304 -25.731 -6.699 1312 HB2 ARG 114 2HB ARG 114 -3.054 -24.569 -8.439 1313 HB3 ARG 114 3HB ARG 114 -4.621 -24.892 -9.193 1314 HG2 ARG 114 2HG ARG 114 -4.092 -27.270 -9.440 1315 HG3 ARG 114 3HG ARG 114 -2.438 -27.006 -8.867 1316 HD2 ARG 114 2HD ARG 114 -4.950 -26.506 -7.221 1317 HD3 ARG 114 3HD ARG 114 -4.002 -28.003 -7.189 1318 HH11 ARG 114 1HH2 ARG 114 -4.705 -27.741 -5.071 1319 HH12 ARG 114 2HH2 ARG 114 -4.066 -27.390 -3.495 1320 HH21 ARG 114 1HH1 ARG 114 -1.550 -25.283 -4.613 1321 HH22 ARG 114 2HH1 ARG 114 -2.443 -25.979 -3.256 1322 H HIS 115 HN HIS 115 -5.283 -24.754 -11.559 1323 HA HIS 115 HA HIS 115 -5.734 -27.299 -12.610 1324 HD1 HIS 115 1HD HIS 115 -8.440 -28.017 -13.700 1325 HD2 HIS 115 2HD HIS 115 -7.077 -24.911 -16.205 1326 HE1 HIS 115 1HE HIS 115 -9.384 -28.462 -16.058 1327 HB2 HIS 115 2HB HIS 115 -7.498 -25.659 -12.493 1328 HB3 HIS 115 3HB HIS 115 -6.678 -24.577 -13.607 1329 H HIS 116 HN HIS 116 -4.325 -24.461 -14.348 1330 HA HIS 116 HA HIS 116 -3.794 -25.777 -16.803 1331 HD1 HIS 116 1HD HIS 116 -5.387 -24.180 -17.749 1332 HD2 HIS 116 2HD HIS 116 -2.796 -21.100 -16.434 1333 HE1 HIS 116 1HE HIS 116 -6.347 -22.023 -18.557 1334 HB2 HIS 116 2HB HIS 116 -2.333 -23.528 -15.370 1335 HB3 HIS 116 3HB HIS 116 -1.947 -24.054 -17.001 1336 H ASN 117 HN ASN 117 -1.951 -25.735 -13.714 1337 HA ASN 117 HA ASN 117 0.459 -26.941 -14.827 1338 HB2 ASN 117 2HB ASN 117 0.099 -25.561 -12.616 1339 HB3 ASN 117 3HB ASN 117 -0.361 -27.103 -11.903 1340 HD21 ASN 117 1HD2 ASN 117 1.612 -28.806 -13.249 1341 HD22 ASN 117 2HD2 ASN 117 3.175 -28.223 -12.623 1342 H MET 118 HN MET 118 -2.671 -28.151 -13.943 1343 HA MET 118 HA MET 118 -1.618 -30.958 -13.821 1344 HB2 MET 118 2HB MET 118 -4.254 -29.763 -12.847 1345 HB3 MET 118 3HB MET 118 -3.844 -31.484 -12.782 1346 HG2 MET 118 2HG MET 118 -1.943 -31.018 -11.317 1347 HG3 MET 118 3HG MET 118 -2.283 -29.287 -11.374 1348 HE1 MET 118 3HE MET 118 -3.120 -30.409 -7.681 1349 HE2 MET 118 1HE MET 118 -1.921 -31.188 -8.738 1350 HE3 MET 118 2HE MET 118 -2.063 -29.416 -8.715 1351 H HIS 119 HN HIS 119 -2.646 -28.850 -16.100 1352 HA HIS 119 HA HIS 119 -4.928 -30.176 -17.230 1353 HD1 HIS 119 1HD HIS 119 -5.377 -30.136 -20.121 1354 HD2 HIS 119 2HD HIS 119 -6.066 -26.611 -17.952 1355 HE1 HIS 119 1HE HIS 119 -7.829 -29.388 -20.618 1356 HB2 HIS 119 2HB HIS 119 -3.848 -27.746 -17.544 1357 HB3 HIS 119 3HB HIS 119 -3.124 -28.510 -18.960 Start of MODEL 18 1 H5 DC 124 5H C 124 -3.942 -31.567 -5.085 2 H6 DC 124 6H C 124 -5.845 -31.148 -6.574 3 H5' DC 124 H5' C 124 -8.815 -32.511 -9.780 4 H5'' DC 124 H5" C 124 -7.432 -32.434 -8.654 5 H4' DC 124 H4' C 124 -10.351 -32.464 -7.758 6 H3' DC 124 H3' C 124 -9.098 -30.286 -8.972 7 H2' DC 124 H2' C 124 -7.367 -29.935 -7.432 8 H2'' DC 124 H2" C 124 -8.638 -28.979 -6.602 9 H1' DC 124 H1' C 124 -9.353 -30.797 -5.296 10 H41 DC 124 1H4 C 124 -4.464 -32.171 -1.498 11 H42 DC 124 2H4 C 124 -3.308 -31.954 -2.794 12 H8 DG 125 8H G 125 -9.197 -26.881 -5.684 13 H1 DG 125 1H G 125 -6.455 -29.048 -0.296 14 H5' DG 125 H5' G 125 -12.981 -29.608 -6.428 15 H5'' DG 125 H5" G 125 -13.979 -28.217 -6.888 16 H4' DG 125 H4' G 125 -13.848 -28.570 -4.409 17 H3' DG 125 H3' G 125 -13.467 -26.089 -5.723 18 H2' DG 125 H2' G 125 -11.178 -25.956 -5.314 19 H2'' DG 125 H2" G 125 -11.706 -25.264 -3.752 20 H1' DG 125 H1' G 125 -11.587 -27.409 -2.647 21 H21 DG 125 1H2 G 125 -7.957 -29.342 1.240 22 H22 DG 125 2H2 G 125 -9.664 -29.070 0.928 23 H5 DC 126 5H C 126 -8.085 -23.976 -4.355 24 H6 DC 126 6H C 126 -10.025 -23.477 -2.929 25 H5' DC 126 H5' C 126 -13.582 -26.122 -1.181 26 H5'' DC 126 H5" C 126 -14.589 -24.850 -0.497 27 H4' DC 126 H4' C 126 -12.683 -25.207 0.945 28 H3' DC 126 H3' C 126 -13.248 -22.672 -0.189 29 H2' DC 126 H2' C 126 -11.383 -22.710 -1.607 30 H2'' DC 126 H2" C 126 -10.629 -21.907 -0.202 31 H1' DC 126 H1' C 126 -9.990 -24.129 0.765 32 H41 DC 126 1H4 C 126 -5.042 -25.524 -2.929 33 H42 DC 126 2H4 C 126 -5.876 -25.026 -4.385 34 H8 DG 127 8H G 127 -9.672 -21.781 1.655 35 H1 DG 127 1H G 127 -3.415 -22.953 0.713 36 H5' DG 127 H5' G 127 -11.976 -23.702 3.845 37 H5'' DG 127 H5" G 127 -12.567 -22.708 5.176 38 H4' DG 127 H4' G 127 -10.510 -23.808 5.871 39 H3' DG 127 H3' G 127 -10.772 -20.976 5.825 40 H2' DG 127 H2' G 127 -9.309 -20.550 4.094 41 H2'' DG 127 H2" G 127 -8.040 -20.716 5.339 42 H1' DG 127 H1' G 127 -7.588 -22.927 4.765 43 H21 DG 127 1H2 G 127 -2.401 -23.254 2.616 44 H22 DG 127 2H2 G 127 -3.254 -23.053 4.137 45 H8 DG 128 8H G 128 -7.525 -18.767 4.156 46 H1 DG 128 1H G 128 -2.667 -19.710 0.051 47 H5' DG 128 H5' G 128 -6.759 -21.926 7.536 48 H5'' DG 128 H5" G 128 -6.568 -21.073 9.071 49 H4' DG 128 H4' G 128 -4.529 -20.757 7.888 50 H3' DG 128 H3' G 128 -6.168 -18.560 8.593 51 H2' DG 128 H2' G 128 -6.786 -18.067 6.373 52 H2'' DG 128 H2" G 128 -5.270 -17.090 6.454 53 H1' DG 128 H1' G 128 -3.953 -19.003 5.725 54 H21 DG 128 1H2 G 128 -0.789 -19.972 1.134 55 H22 DG 128 2H2 G 128 -0.740 -20.036 2.884 56 H8 DG 129 8H G 129 -3.432 -16.306 5.657 57 H1 DG 129 1H G 129 -1.007 -16.462 -0.288 58 H5' DG 129 H5' G 129 -1.603 -18.297 8.749 59 H5'' DG 129 H5" G 129 -0.985 -17.215 9.974 60 H4' DG 129 H4' G 129 0.607 -17.265 8.193 61 H3' DG 129 H3' G 129 -0.650 -14.762 8.714 62 H2' DG 129 H2' G 129 -1.847 -14.787 6.752 63 H2'' DG 129 H2" G 129 -0.390 -14.017 6.096 64 H1' DG 129 H1' G 129 0.472 -16.165 5.312 65 H21 DG 129 1H2 G 129 1.176 -16.413 -0.200 66 H22 DG 129 2H2 G 129 2.031 -16.356 1.332 67 H8 DG 130 8H G 130 0.577 -13.601 4.224 68 H1 DG 130 1H G 130 -0.660 -12.862 -2.023 69 H5' DG 130 H5' G 130 2.818 -15.458 5.540 70 H5'' DG 130 H5" G 130 3.911 -14.657 6.658 71 H4' DG 130 H4' G 130 5.025 -14.493 4.641 72 H3' DG 130 H3' G 130 4.198 -12.107 5.832 73 H2' DG 130 H2' G 130 2.389 -11.725 4.469 74 H2'' DG 130 H2" G 130 3.568 -10.972 3.406 75 H1' DG 130 H1' G 130 3.679 -12.854 1.976 76 H21 DG 130 1H2 G 130 1.137 -12.413 -3.136 77 H22 DG 130 2H2 G 130 2.668 -12.107 -2.330 78 H8 DG 131 8H G 131 2.622 -9.472 2.365 79 H1 DG 131 1H G 131 -1.909 -9.373 -2.166 80 H5' DG 131 H5' G 131 5.942 -11.728 1.669 81 H5'' DG 131 H5" G 131 7.381 -10.706 1.847 82 H4' DG 131 H4' G 131 6.609 -10.302 -0.356 83 H3' DG 131 H3' G 131 6.607 -8.108 1.418 84 H2' DG 131 H2' G 131 4.299 -8.112 1.661 85 H2'' DG 131 H2" G 131 4.387 -7.031 0.272 86 H1' DG 131 H1' G 131 3.900 -8.840 -1.283 87 H21 DG 131 1H2 G 131 -1.080 -8.958 -4.113 88 H22 DG 131 2H2 G 131 0.639 -8.669 -4.340 89 H5 DC 132 5H C 132 1.259 -6.263 1.721 90 H6 DC 132 6H C 132 2.765 -5.593 -0.094 91 H5' DC 132 H5' C 132 5.040 -7.680 -2.728 92 H5'' DC 132 H5" C 132 6.167 -6.558 -3.497 93 H4' DC 132 H4' C 132 4.161 -6.157 -4.633 94 H3' DC 132 H3' C 132 5.251 -4.129 -2.950 95 H2' DC 132 H2' C 132 3.560 -4.225 -1.402 96 H2'' DC 132 H2" C 132 2.722 -3.154 -2.524 97 H1' DC 132 H1' C 132 1.529 -4.972 -3.585 98 H41 DC 132 1H4 C 132 -2.332 -6.635 1.136 99 H42 DC 132 2H4 C 132 -1.003 -6.812 2.289 100 H8 DG 133 8H G 133 1.250 -1.895 -3.189 101 H1 DG 133 1H G 133 -4.931 -2.842 -1.576 102 H5' DG 133 H5' G 133 2.750 -3.197 -6.883 103 H5'' DG 133 H5" G 133 3.291 -1.672 -7.624 104 H4' DG 133 H4' G 133 0.913 -2.041 -8.098 105 H3' DG 133 H3' G 133 2.021 0.265 -6.921 106 H2' DG 133 H2' G 133 1.152 -0.126 -4.826 107 H2'' DG 133 H2" G 133 -0.204 0.791 -5.452 108 H1' DG 133 H1' G 133 -1.410 -1.255 -6.007 109 H21 DG 133 1H2 G 133 -6.215 -2.360 -3.249 110 H22 DG 133 2H2 G 133 -5.585 -1.743 -4.757 111 H5' DT 134 H5' T 134 -2.415 -0.131 -7.116 112 H5'' DT 134 H5" T 134 -2.913 0.948 -8.395 113 H4' DT 134 H4' T 134 -4.782 1.013 -6.975 114 H3' DT 134 H3' T 134 -3.114 3.314 -7.235 115 H2' DT 134 H2' T 134 -2.257 3.245 -5.102 116 H2'' DT 134 H2" T 134 -3.731 4.155 -4.739 117 H1' DT 134 H1' T 134 -4.997 2.099 -4.188 118 H3 DT 134 3H T 134 -3.993 0.275 -0.207 119 H71 DT 134 1H7 T 134 0.529 0.195 -1.615 120 H72 DT 134 2H7 T 134 0.606 1.600 -2.698 121 H73 DT 134 3H7 T 134 0.499 1.839 -0.938 122 H6 DT 134 6H T 134 -1.347 2.053 -3.772 123 H5 DC 135 5H C 135 -3.674 5.011 -2.671 124 H6 DC 135 6H C 135 -5.516 5.426 -4.220 125 H5' DC 135 H5' C 135 -7.587 3.553 -7.373 126 H5'' DC 135 H5" C 135 -8.363 4.947 -8.151 127 H4' DC 135 H4' C 135 -9.659 4.290 -6.224 128 H3' DC 135 H3' C 135 -8.673 6.901 -6.463 129 H2' DC 135 H2' C 135 -7.083 6.604 -4.842 130 H2'' DC 135 H2" C 135 -8.353 7.184 -3.792 131 H1' DC 135 H1' C 135 -9.096 4.897 -3.257 132 H41 DC 135 1H4 C 135 -4.201 3.280 0.484 133 H42 DC 135 2H4 C 135 -3.062 3.898 -0.679 134 H5' DT 136 H5' T 136 -11.122 5.304 -2.704 135 H5'' DT 136 H5" T 136 -12.534 6.341 -2.983 136 H4' DT 136 H4' T 136 -12.470 6.019 -0.649 137 H3' DT 136 H3' T 136 -12.238 8.586 -1.807 138 H2' DT 136 H2' T 136 -10.111 9.051 -1.270 139 H2'' DT 136 H2" T 136 -10.725 9.501 0.289 140 H1' DT 136 H1' T 136 -10.209 7.454 1.317 141 H3 DT 136 3H T 136 -5.811 6.578 1.787 142 H71 DT 136 1H7 T 136 -5.250 9.363 -2.175 143 H72 DT 136 2H7 T 136 -5.146 7.707 -2.818 144 H73 DT 136 3H7 T 136 -6.573 8.709 -3.170 145 H6 DT 136 6H T 136 -8.452 8.170 -1.891 146 H8 DG 137 8H G 137 -9.661 10.309 1.767 147 H1 DG 137 1H G 137 -3.753 9.357 4.033 148 H5' DG 137 H5' G 137 -12.110 7.440 2.418 149 H5'' DG 137 H5" G 137 -13.610 8.120 3.058 150 H4' DG 137 H4' G 137 -12.339 7.864 4.965 151 H3' DG 137 H3' G 137 -12.983 10.493 4.221 152 H2' DG 137 H2' G 137 -10.903 10.994 3.392 153 H2'' DG 137 H2" G 137 -10.576 11.481 5.030 154 H1' DG 137 H1' G 137 -9.411 9.452 5.548 155 H21 DG 137 1H2 G 137 -3.833 8.853 6.155 156 H22 DG 137 2H2 G 137 -5.353 8.828 7.037 157 H5 DC 138 5H C 138 -8.580 13.039 4.102 158 H6 DC 138 6H C 138 -9.162 12.281 6.354 159 H5' DC 138 H5' C 138 -10.251 9.301 7.567 160 H5'' DC 138 H5" C 138 -11.262 9.713 8.958 161 H4' DC 138 H4' C 138 -9.155 9.559 9.870 162 H3' DC 138 H3' C 138 -10.356 12.058 9.971 163 H2' DC 138 H2' C 138 -9.187 13.046 8.285 164 H2'' DC 138 H2" C 138 -8.040 13.405 9.537 165 H1' DC 138 H1' C 138 -6.574 11.647 8.964 166 H41 DC 138 1H4 C 138 -5.077 13.090 2.993 167 H42 DC 138 2H4 C 138 -6.764 13.192 2.531 168 H8 DG 139 8H G 139 -6.374 14.510 9.703 169 H1 DG 139 1H G 139 -2.154 15.851 5.090 170 H5' DG 139 H5' G 139 -6.116 11.013 11.117 171 H5'' DG 139 H5" G 139 -6.207 11.216 12.879 172 H4' DG 139 H4' G 139 -3.941 11.434 12.394 173 H3' DG 139 H3' G 139 -5.176 13.618 13.555 174 H2' DG 139 H2' G 139 -5.385 14.855 11.619 175 H2'' DG 139 H2" G 139 -3.824 15.478 12.095 176 H1' DG 139 H1' G 139 -2.629 14.051 10.608 177 H21 DG 139 1H2 G 139 -0.152 15.351 5.732 178 H22 DG 139 2H2 G 139 0.184 14.813 7.372 179 H5 DC 140 5H C 140 -4.145 17.601 10.570 180 H6 DC 140 6H C 140 -2.110 16.753 11.615 181 H5' DC 140 H5' C 140 -0.763 13.377 12.124 182 H5'' DC 140 H5" C 140 0.150 13.715 13.600 183 H4' DC 140 H4' C 140 1.589 14.113 11.692 184 H3' DC 140 H3' C 140 1.238 15.969 13.717 185 H2' DC 140 H2' C 140 -0.273 17.375 12.599 186 H2'' DC 140 H2" C 140 1.233 18.141 12.046 187 H1' DC 140 H1' C 140 1.245 16.981 9.978 188 H41 DC 140 1H4 C 140 -4.080 18.931 7.159 189 H42 DC 140 2H4 C 140 -5.052 18.471 8.541 190 H8 DG 141 8H G 141 -3.442 21.626 0.906 191 H1 DG 141 1H G 141 -1.644 18.711 6.340 192 H5' DG 141 H5' G 141 -0.857 24.619 -0.608 193 H5'' DG 141 H5" G 141 -1.018 23.945 -2.239 194 H4' DG 141 H4' G 141 0.839 22.953 -0.919 195 H3' DG 141 H3' G 141 -0.941 21.461 -2.492 196 H2' DG 141 H2' G 141 -2.179 20.626 -0.734 197 H2'' DG 141 H2" G 141 -0.956 19.361 -0.722 198 H1' DG 141 H1' G 141 0.259 20.403 1.057 199 H21 DG 141 1H2 G 141 0.485 18.294 6.333 200 H22 DG 141 2H2 G 141 1.474 18.571 4.905 201 H5 DC 142 5H C 142 -2.627 17.755 0.446 202 H6 DC 142 6H C 142 -0.249 17.382 0.043 203 H5' DC 142 H5' C 142 2.000 19.624 0.535 204 H5'' DC 142 H5" C 142 3.221 19.340 -0.693 205 H4' DC 142 H4' C 142 4.002 18.019 0.939 206 H3' DC 142 H3' C 142 3.060 16.641 -1.266 207 H2' DC 142 H2' C 142 1.043 15.880 -0.471 208 H2'' DC 142 H2" C 142 1.969 14.585 0.200 209 H1' DC 142 H1' C 142 1.907 15.439 2.383 210 H41 DC 142 1H4 C 142 -4.173 16.807 3.640 211 H42 DC 142 2H4 C 142 -4.363 17.634 2.106 212 H8 DG 143 8H G 143 1.554 12.982 1.318 213 H1 DG 143 1H G 143 -3.701 12.423 4.941 214 H5' DG 143 H5' G 143 4.240 15.346 3.223 215 H5'' DG 143 H5" G 143 5.700 14.449 2.802 216 H4' DG 143 H4' G 143 4.977 13.578 4.895 217 H3' DG 143 H3' G 143 5.329 11.948 2.678 218 H2' DG 143 H2' G 143 3.130 11.774 2.053 219 H2'' DG 143 H2" G 143 3.074 10.416 3.126 220 H1' DG 143 H1' G 143 2.110 11.652 4.908 221 H21 DG 143 1H2 G 143 -3.198 11.693 6.920 222 H22 DG 143 2H2 G 143 -1.537 11.334 7.371 223 H5 DC 144 5H C 144 0.800 9.461 1.999 224 H6 DC 144 6H C 144 1.813 8.751 4.112 225 H5' DC 144 H5' C 144 3.146 10.949 6.421 226 H5'' DC 144 H5" C 144 4.414 9.950 7.107 227 H4' DC 144 H4' C 144 2.575 9.407 8.341 228 H3' DC 144 H3' C 144 3.704 7.304 6.883 229 H2' DC 144 H2' C 144 2.064 7.028 5.308 230 H2'' DC 144 H2" C 144 1.254 6.127 6.573 231 H1' DC 144 H1' C 144 -0.229 7.824 7.093 232 H41 DC 144 1H4 C 144 -2.829 9.890 1.737 233 H42 DC 144 2H4 C 144 -1.261 10.132 0.994 234 H8 DA 145 8H A 145 -0.227 4.966 5.906 235 H2 DA 145 2H A 145 -6.316 6.159 4.381 236 H5' DA 145 H5' A 145 0.033 7.228 9.666 237 H5'' DA 145 H5" A 145 0.165 5.948 10.887 238 H4' DA 145 H4' A 145 -2.179 6.252 10.405 239 H3' DA 145 H3' A 145 -0.964 3.746 10.142 240 H2' DA 145 H2' A 145 -0.842 3.909 7.769 241 H2'' DA 145 H2" A 145 -2.377 3.068 7.924 242 H1' DA 145 H1' A 145 -3.634 5.159 7.806 243 H61 DA 145 2H6 A 145 -1.949 5.921 1.527 244 H62 DA 145 1H6 A 145 -3.526 6.369 0.914 245 H8 DG 146 8H G 146 -3.780 1.794 7.192 246 H1 DG 146 1H G 146 -5.815 3.302 1.296 247 H5' DG 146 H5' G 146 -5.252 4.691 9.864 248 H5'' DG 146 H5" G 146 -6.448 4.495 11.124 249 H4' DG 146 H4' G 146 -7.852 3.913 9.515 250 H3' DG 146 H3' G 146 -6.705 1.420 10.327 251 H2' DG 146 H2' G 146 -5.617 0.924 8.365 252 H2'' DG 146 H2" G 146 -7.219 0.469 7.772 253 H1' DG 146 H1' G 146 -7.621 2.527 6.781 254 H21 DG 146 1H2 G 146 -7.938 3.570 1.287 255 H22 DG 146 2H2 G 146 -8.896 3.495 2.744 256 H8 DA 147 8H A 147 -6.841 -1.356 6.435 257 H2 DA 147 2H A 147 -6.497 0.459 0.297 258 H5' DA 147 H5' A 147 -10.113 1.875 7.503 259 H5'' DA 147 H5" A 147 -11.506 0.820 7.819 260 H4' DA 147 H4' A 147 -11.241 1.093 5.427 261 H3' DA 147 H3' A 147 -11.258 -1.484 6.631 262 H2' DA 147 H2' A 147 -9.036 -1.972 6.128 263 H2'' DA 147 H2" A 147 -9.732 -2.469 4.553 264 H1' DA 147 H1' A 147 -9.340 -0.313 3.589 265 H61 DA 147 2H6 A 147 -2.780 -0.949 3.664 266 H62 DA 147 1H6 A 147 -2.526 -0.441 2.007 267 H5 DC 148 5H C 148 -7.092 -3.473 3.252 268 H6 DC 148 6H C 148 -9.401 -3.436 2.423 269 H5' DC 148 H5' C 148 -12.259 -0.793 1.998 270 H5'' DC 148 H5" C 148 -13.771 -1.688 1.763 271 H4' DC 148 H4' C 148 -12.729 -1.653 -0.350 272 H3' DC 148 H3' C 148 -13.227 -4.102 0.879 273 H2' DC 148 H2' C 148 -10.996 -4.444 1.507 274 H2'' DC 148 H2" C 148 -10.946 -5.277 -0.056 275 H1' DC 148 H1' C 148 -10.210 -3.305 -1.230 276 H41 DC 148 1H4 C 148 -4.269 -3.244 0.908 277 H42 DC 148 2H4 C 148 -4.779 -3.480 2.581 278 H8 DG 149 8H G 149 -9.247 -6.842 -0.955 279 H1 DG 149 1H G 149 -2.906 -5.808 -1.098 280 H5' DG 149 H5' G 149 -10.988 -3.509 -3.237 281 H5'' DG 149 H5" G 149 -12.179 -4.330 -4.247 282 H4' DG 149 H4' G 149 -10.137 -4.496 -5.439 283 H3' DG 149 H3' G 149 -11.525 -6.787 -4.582 284 H2' DG 149 H2' G 149 -10.078 -7.413 -2.926 285 H2'' DG 149 H2" G 149 -9.238 -8.275 -4.204 286 H1' DG 149 H1' G 149 -7.670 -6.440 -4.507 287 H21 DG 149 1H2 G 149 -2.258 -5.642 -3.165 288 H22 DG 149 2H2 G 149 -3.402 -5.614 -4.494 289 H5 DC 150 5H C 150 -6.937 -9.757 -1.614 290 H6 DC 150 6H C 150 -7.146 -9.881 -4.029 291 H5' DC 150 H5' C 150 -8.190 -9.127 -5.696 292 H5'' DC 150 H5" C 150 -8.077 -7.465 -6.326 293 H4' DC 150 H4' C 150 -6.714 -8.251 -8.205 294 H3' DC 150 H3' C 150 -7.756 -10.760 -7.656 295 H2' DC 150 H2' C 150 -6.823 -11.147 -5.600 296 H2'' DC 150 H2" C 150 -5.507 -11.742 -6.563 297 H1' DC 150 H1' C 150 -4.171 -9.786 -6.286 298 H41 DC 150 1H4 C 150 -3.679 -9.380 -0.028 299 H42 DC 150 2H4 C 150 -5.410 -9.551 0.211 300 H5 DC 151 5H C 151 -5.177 -12.879 -4.369 301 H6 DC 151 6H C 151 -3.955 -12.874 -6.496 302 H5' DC 151 H5' C 151 -3.468 -10.141 -8.966 303 H5'' DC 151 H5" C 151 -3.275 -11.078 -10.462 304 H4' DC 151 H4' C 151 -1.146 -10.926 -9.444 305 H3' DC 151 H3' C 151 -2.166 -13.454 -9.999 306 H2' DC 151 H2' C 151 -2.737 -13.927 -7.835 307 H2'' DC 151 H2" C 151 -1.110 -14.540 -7.740 308 H1' DC 151 H1' C 151 -0.251 -12.534 -6.706 309 H41 DC 151 1H4 C 151 -3.380 -12.881 -1.177 310 H42 DC 151 2H4 C 151 -4.932 -12.745 -1.979 311 H5 DC 152 5H C 152 -3.155 -15.831 -4.979 312 H6 DC 152 6H C 152 -0.962 -15.904 -6.096 313 H5' DC 152 H5' C 152 1.773 -13.254 -7.588 314 H5'' DC 152 H5" C 152 2.954 -14.133 -8.584 315 H4' DC 152 H4' C 152 3.568 -14.669 -6.378 316 H3' DC 152 H3' C 152 2.503 -16.741 -8.020 317 H2' DC 152 H2' C 152 0.681 -17.198 -6.697 318 H2'' DC 152 H2" C 152 1.838 -18.169 -5.758 319 H1' DC 152 H1' C 152 2.257 -16.400 -4.206 320 H41 DC 152 1H4 C 152 -3.415 -16.196 -1.340 321 H42 DC 152 2H4 C 152 -4.257 -15.989 -2.865 322 H5 DC 153 5H C 153 -1.422 -19.564 -4.711 323 H6 DC 153 6H C 153 0.990 -19.951 -4.528 324 H5' DC 153 H5' C 153 4.581 -17.535 -4.083 325 H5'' DC 153 H5" C 153 5.904 -18.668 -4.410 326 H4' DC 153 H4' C 153 5.157 -19.203 -2.241 327 H3' DC 153 H3' C 153 4.733 -21.096 -4.406 328 H2' DC 153 H2' C 153 2.526 -21.332 -4.120 329 H2'' DC 153 H2" C 153 2.921 -22.282 -2.688 330 H1' DC 153 H1' C 153 2.717 -20.448 -1.222 331 H41 DC 153 1H4 C 153 -3.528 -19.210 -1.720 332 H42 DC 153 2H4 C 153 -3.509 -19.536 -3.443 333 H5 DC 154 5H C 154 -0.167 -22.978 -3.102 334 H6 DC 154 6H C 154 1.700 -23.483 -1.582 335 H5' DC 154 H5' C 154 4.598 -21.774 0.068 336 H5'' DC 154 H5" C 154 5.765 -23.047 0.453 337 H4' DC 154 H4' C 154 4.127 -23.054 2.198 338 H3' DC 154 H3' C 154 4.545 -25.356 0.556 339 H2' DC 154 H2' C 154 2.441 -25.347 -0.406 340 H2'' DC 154 H2" C 154 1.946 -26.096 1.131 341 H1' DC 154 H1' C 154 1.216 -24.048 2.065 342 H41 DC 154 1H4 C 154 -3.642 -22.774 -1.823 343 H42 DC 154 2H4 C 154 -2.580 -22.571 -3.203 344 H8 DG 155 8H G 155 0.548 -27.631 0.932 345 H1 DG 155 1H G 155 -5.529 -25.940 -0.346 346 H5' DG 155 H5' G 155 2.330 -25.555 4.538 347 H5'' DG 155 H5" G 155 2.782 -26.927 5.571 348 H4' DG 155 H4' G 155 0.390 -26.423 5.886 349 H3' DG 155 H3' G 155 1.487 -28.921 5.082 350 H2' DG 155 H2' G 155 0.602 -28.843 2.919 351 H2'' DG 155 H2" G 155 -0.810 -29.557 3.742 352 H1' DG 155 H1' G 155 -1.861 -27.401 4.018 353 H21 DG 155 1H2 G 155 -6.691 -25.882 1.484 354 H22 DG 155 2H2 G 155 -5.971 -26.220 3.053 355 H5 DC 156 5H C 156 -1.641 -30.602 1.044 356 H6 DC 156 6H C 156 -2.471 -30.933 3.333 357 H5' DC 156 H5' C 156 -2.694 -28.726 6.852 358 H5'' DC 156 H5" C 156 -2.971 -29.995 8.051 359 H4' DC 156 H4' C 156 -5.072 -29.461 7.002 360 H3' DC 156 H3' C 156 -3.946 -32.091 6.947 361 H2' DC 156 H2' C 156 -3.683 -32.184 4.643 362 H2'' DC 156 H2" C 156 -5.435 -32.492 4.697 363 H1' DC 156 H1' C 156 -6.052 -30.289 4.275 364 H41 DC 156 1H4 C 156 -3.894 -29.331 -1.595 365 H42 DC 156 2H4 C 156 -2.249 -29.739 -1.152 366 H8 DG 157 8H G 157 -6.416 -34.719 4.695 367 H1 DG 157 1H G 157 -6.873 -32.260 -1.203 368 H5' DG 157 H5' G 157 -8.703 -31.535 7.232 369 H5'' DG 157 H5" G 157 -9.511 -32.720 8.280 370 H4' DG 157 H4' G 157 -10.793 -32.365 6.195 371 H3' DG 157 H3' G 157 -10.145 -34.932 7.065 372 H2' DG 157 H2' G 157 -8.351 -35.295 5.572 373 H2'' DG 157 H2" G 157 -9.687 -35.903 4.532 374 H1' DG 157 H1' G 157 -9.980 -33.786 3.484 375 H21 DG 157 1H2 G 157 -8.905 -31.734 -1.628 376 H22 DG 157 2H2 G 157 -10.157 -31.833 -0.406 377 HA ALA 1 HA ALA 1 10.137 -14.263 -21.625 378 H1 ALA 1 HN ALA 1 7.726 -14.566 -21.495 379 HB1 ALA 1 1HB ALA 1 10.223 -14.498 -24.083 380 HB2 ALA 1 2HB ALA 1 9.501 -12.885 -24.273 381 HB3 ALA 1 3HB ALA 1 11.118 -13.057 -23.553 382 H SER 2 HN SER 2 7.399 -12.156 -21.989 383 HA SER 2 HA SER 2 8.598 -9.617 -21.471 384 HG SER 2 HG SER 2 6.727 -9.380 -23.094 385 HB2 SER 2 2HB SER 2 5.819 -10.582 -20.678 386 HB3 SER 2 3HB SER 2 6.335 -8.895 -20.877 387 H GLU 3 HN GLU 3 8.158 -12.351 -19.383 388 HA GLU 3 HA GLU 3 8.087 -10.830 -16.887 389 HB2 GLU 3 2HB GLU 3 8.151 -12.949 -15.804 390 HB3 GLU 3 3HB GLU 3 7.038 -13.079 -17.143 391 HG2 GLU 3 2HG GLU 3 9.893 -14.175 -17.096 392 HG3 GLU 3 3HG GLU 3 8.443 -15.095 -16.744 393 H LYS 4 HN LYS 4 10.570 -11.721 -19.115 394 HA LYS 4 HA LYS 4 12.672 -12.235 -17.141 395 HB2 LYS 4 2HB LYS 4 12.832 -11.754 -20.157 396 HB3 LYS 4 3HB LYS 4 14.147 -12.362 -19.140 397 HG2 LYS 4 2HG LYS 4 12.855 -14.361 -18.559 398 HG3 LYS 4 3HG LYS 4 11.469 -13.763 -19.484 399 HD2 LYS 4 2HD LYS 4 12.779 -13.838 -21.567 400 HD3 LYS 4 3HD LYS 4 14.174 -14.483 -20.667 401 HE2 LYS 4 2HE LYS 4 12.854 -16.440 -19.974 402 HE3 LYS 4 3HE LYS 4 11.410 -15.781 -20.752 403 HZ1 LYS 4 3HZ LYS 4 12.487 -17.412 -22.137 404 HZ2 LYS 4 1HZ LYS 4 13.895 -16.555 -22.141 405 HZ3 LYS 4 2HZ LYS 4 12.550 -15.936 -22.865 406 H ARG 5 HN ARG 5 11.748 -9.875 -16.294 407 HA ARG 5 HA ARG 5 14.080 -8.117 -16.715 408 HE ARG 5 HE ARG 5 8.592 -7.426 -18.794 409 HB2 ARG 5 2HB ARG 5 12.567 -6.082 -17.087 410 HB3 ARG 5 3HB ARG 5 12.805 -7.167 -18.444 411 HG2 ARG 5 2HG ARG 5 10.605 -8.195 -18.089 412 HG3 ARG 5 3HG ARG 5 10.307 -7.124 -16.706 413 HD2 ARG 5 2HD ARG 5 10.332 -5.173 -18.119 414 HD3 ARG 5 3HD ARG 5 10.864 -6.134 -19.522 415 HH11 ARG 5 2HH2 ARG 5 9.129 -4.050 -19.628 416 HH12 ARG 5 1HH2 ARG 5 7.491 -3.853 -20.219 417 HH21 ARG 5 2HH1 ARG 5 6.580 -7.112 -19.500 418 HH22 ARG 5 1HH1 ARG 5 6.071 -5.571 -20.168 419 HA PRO 6 HA PRO 6 12.376 -8.084 -12.411 420 HB2 PRO 6 2HB PRO 6 14.539 -9.050 -11.073 421 HB3 PRO 6 3HB PRO 6 13.446 -10.132 -11.991 422 HG2 PRO 6 2HG PRO 6 16.099 -8.954 -12.901 423 HG3 PRO 6 3HG PRO 6 15.562 -10.661 -12.990 424 HD2 PRO 6 2HD PRO 6 15.356 -8.884 -15.093 425 HD3 PRO 6 3HD PRO 6 14.196 -10.229 -14.842 426 H PHE 7 HN PHE 7 13.010 -6.716 -10.583 427 HA PHE 7 HA PHE 7 15.231 -4.783 -11.140 428 HD1 PHE 7 2HD PHE 7 11.753 -5.074 -12.653 429 HD2 PHE 7 1HD PHE 7 14.381 -1.706 -12.066 430 HE1 PHE 7 2HE PHE 7 11.545 -4.505 -15.042 431 HE2 PHE 7 1HE PHE 7 14.169 -1.141 -14.470 432 HZ PHE 7 HZ PHE 7 12.821 -2.582 -15.979 433 HB2 PHE 7 2HB PHE 7 12.358 -4.147 -10.302 434 HB3 PHE 7 3HB PHE 7 13.675 -2.988 -10.182 435 H MET 8 HN MET 8 15.545 -3.396 -8.993 436 HA MET 8 HA MET 8 14.798 -4.915 -6.558 437 HB2 MET 8 2HB MET 8 17.584 -3.806 -6.567 438 HB3 MET 8 3HB MET 8 16.896 -5.125 -5.635 439 HG2 MET 8 2HG MET 8 16.933 -6.484 -7.811 440 HG3 MET 8 3HG MET 8 17.846 -5.157 -8.517 441 HE1 MET 8 3HE MET 8 20.520 -7.986 -8.081 442 HE2 MET 8 1HE MET 8 18.797 -8.198 -8.462 443 HE3 MET 8 2HE MET 8 19.719 -6.877 -9.219 444 H CYS 9 HN CYS 9 14.675 -3.661 -4.685 445 HA CYS 9 HA CYS 9 14.107 -0.833 -5.054 446 HB2 CYS 9 2HB CYS 9 12.977 -2.012 -3.305 447 HB3 CYS 9 3HB CYS 9 14.454 -2.608 -2.599 448 H ALA 10 HN ALA 10 15.236 0.940 -3.810 449 HA ALA 10 HA ALA 10 18.197 0.648 -4.142 450 HB1 ALA 10 1HB ALA 10 16.433 3.139 -4.243 451 HB2 ALA 10 2HB ALA 10 18.195 3.100 -4.479 452 HB3 ALA 10 3HB ALA 10 17.126 2.289 -5.642 453 H TYR 11 HN TYR 11 15.624 1.839 -1.946 454 HA TYR 11 HA TYR 11 17.088 3.325 -0.145 455 HD1 TYR 11 2HD TYR 11 15.299 1.001 2.798 456 HD2 TYR 11 1HD TYR 11 14.847 5.023 1.319 457 HE1 TYR 11 2HE TYR 11 14.811 1.795 5.093 458 HE2 TYR 11 1HE TYR 11 14.276 5.806 3.615 459 HH TYR 11 HH TYR 11 14.364 3.613 6.432 460 HB2 TYR 11 2HB TYR 11 14.655 3.037 -0.170 461 HB3 TYR 11 3HB TYR 11 14.830 1.415 0.465 462 HA PRO 12 HA PRO 12 19.926 0.468 1.748 463 HB2 PRO 12 2HB PRO 12 20.946 2.064 3.753 464 HB3 PRO 12 3HB PRO 12 21.218 2.382 2.027 465 HG2 PRO 12 2HG PRO 12 19.075 3.622 3.785 466 HG3 PRO 12 3HG PRO 12 20.276 4.461 2.748 467 HD2 PRO 12 2HD PRO 12 17.756 3.952 1.883 468 HD3 PRO 12 3HD PRO 12 19.154 3.811 0.766 469 H GLY 13 HN GLY 13 17.635 -0.566 2.322 470 HA2 GLY 13 2HA GLY 13 17.829 -1.608 4.993 471 HA3 GLY 13 3HA GLY 13 16.559 -0.372 4.926 472 H CYS 14 HN CYS 14 16.433 -1.396 1.878 473 HA CYS 14 HA CYS 14 14.771 -3.803 2.425 474 HB2 CYS 14 2HB CYS 14 13.228 -2.012 1.982 475 HB3 CYS 14 3HB CYS 14 14.233 -1.412 0.661 476 H ASN 15 HN ASN 15 15.539 -2.104 -0.617 477 HA ASN 15 HA ASN 15 16.680 -2.748 -2.493 478 HB2 ASN 15 2HB ASN 15 18.474 -4.181 -0.474 479 HB3 ASN 15 3HB ASN 15 18.863 -3.941 -2.171 480 HD21 ASN 15 1HD2 ASN 15 18.312 -1.429 -2.858 481 HD22 ASN 15 2HD2 ASN 15 19.151 -0.324 -1.741 482 H LYS 16 HN LYS 16 14.505 -4.646 -1.264 483 HA LYS 16 HA LYS 16 15.223 -7.273 -2.204 484 HB2 LYS 16 2HB LYS 16 12.863 -5.927 -0.976 485 HB3 LYS 16 3HB LYS 16 12.399 -7.134 -2.130 486 HG2 LYS 16 2HG LYS 16 12.502 -8.219 -0.036 487 HG3 LYS 16 3HG LYS 16 13.845 -8.814 -1.004 488 HD2 LYS 16 2HD LYS 16 14.627 -8.496 1.235 489 HD3 LYS 16 3HD LYS 16 15.377 -7.237 0.250 490 HE2 LYS 16 2HE LYS 16 13.709 -5.594 1.063 491 HE3 LYS 16 3HE LYS 16 12.880 -6.866 1.975 492 HZ1 LYS 16 3HZ LYS 16 14.357 -5.624 3.382 493 HZ2 LYS 16 1HZ LYS 16 15.632 -5.922 2.390 494 HZ3 LYS 16 2HZ LYS 16 14.943 -7.166 3.238 495 H ARG 17 HN ARG 17 13.390 -8.287 -3.762 496 HA ARG 17 HA ARG 17 14.065 -6.872 -6.254 497 HE ARG 17 HE ARG 17 16.717 -7.150 -4.732 498 HB2 ARG 17 2HB ARG 17 12.921 -9.683 -5.909 499 HB3 ARG 17 3HB ARG 17 13.715 -9.020 -7.332 500 HG2 ARG 17 2HG ARG 17 15.010 -9.775 -4.680 501 HG3 ARG 17 3HG ARG 17 15.178 -10.575 -6.234 502 HD2 ARG 17 2HD ARG 17 17.005 -9.344 -6.632 503 HD3 ARG 17 3HD ARG 17 15.952 -7.948 -6.794 504 HH11 ARG 17 1HH2 ARG 17 17.746 -10.509 -4.988 505 HH12 ARG 17 2HH2 ARG 17 18.755 -10.374 -3.563 506 HH21 ARG 17 1HH1 ARG 17 17.943 -7.077 -2.959 507 HH22 ARG 17 2HH1 ARG 17 18.886 -8.474 -2.442 508 H TYR 18 HN TYR 18 12.600 -6.912 -8.057 509 HA TYR 18 HA TYR 18 9.714 -6.814 -7.403 510 HD1 TYR 18 1HD TYR 18 7.894 -4.468 -7.098 511 HD2 TYR 18 2HD TYR 18 11.963 -4.156 -5.705 512 HE1 TYR 18 1HE TYR 18 7.068 -3.991 -4.826 513 HE2 TYR 18 2HE TYR 18 11.115 -3.483 -3.477 514 HH TYR 18 HH TYR 18 9.269 -3.119 -2.210 515 HB2 TYR 18 2HB TYR 18 11.443 -4.437 -8.138 516 HB3 TYR 18 3HB TYR 18 9.761 -4.509 -8.660 517 H PHE 19 HN PHE 19 8.461 -6.234 -9.446 518 HA PHE 19 HA PHE 19 9.896 -7.247 -11.867 519 HD1 PHE 19 1HD PHE 19 9.526 -8.283 -13.794 520 HD2 PHE 19 2HD PHE 19 5.325 -8.071 -12.784 521 HE1 PHE 19 1HE PHE 19 8.925 -8.785 -16.127 522 HE2 PHE 19 2HE PHE 19 4.745 -8.568 -15.143 523 HZ PHE 19 HZ PHE 19 6.546 -8.899 -16.824 524 HB2 PHE 19 2HB PHE 19 7.990 -8.677 -11.148 525 HB3 PHE 19 3HB PHE 19 6.907 -7.305 -11.209 526 H LYS 20 HN LYS 20 7.079 -6.057 -12.991 527 HA LYS 20 HA LYS 20 7.350 -3.981 -14.488 528 HB2 LYS 20 2HB LYS 20 5.497 -4.064 -12.104 529 HB3 LYS 20 3HB LYS 20 5.428 -2.692 -13.256 530 HG2 LYS 20 2HG LYS 20 4.994 -4.235 -15.100 531 HG3 LYS 20 3HG LYS 20 5.176 -5.630 -14.023 532 HD2 LYS 20 2HD LYS 20 3.217 -4.874 -12.699 533 HD3 LYS 20 3HD LYS 20 3.008 -3.497 -13.806 534 HE2 LYS 20 2HE LYS 20 2.695 -5.057 -15.700 535 HE3 LYS 20 3HE LYS 20 2.958 -6.439 -14.623 536 HZ1 LYS 20 3HZ LYS 20 0.752 -4.496 -14.399 537 HZ2 LYS 20 1HZ LYS 20 0.995 -5.782 -13.401 538 HZ3 LYS 20 2HZ LYS 20 0.624 -6.028 -14.985 539 H LEU 21 HN LEU 21 9.049 -2.585 -14.585 540 HA LEU 21 HA LEU 21 10.510 -1.425 -12.567 541 HG LEU 21 HG LEU 21 9.275 1.257 -15.057 542 HB2 LEU 21 2HB LEU 21 11.317 0.134 -14.114 543 HB3 LEU 21 3HB LEU 21 10.918 -1.292 -15.051 544 HD11 LEU 21 1HD1 LEU 21 11.507 1.548 -16.035 545 HD12 LEU 21 2HD1 LEU 21 10.247 1.591 -17.276 546 HD13 LEU 21 3HD1 LEU 21 11.248 0.134 -17.080 547 HD21 LEU 21 3HD2 LEU 21 9.138 -1.234 -16.828 548 HD22 LEU 21 1HD2 LEU 21 8.243 0.274 -17.093 549 HD23 LEU 21 2HD2 LEU 21 7.878 -0.716 -15.686 550 H SER 22 HN SER 22 7.480 -0.080 -13.958 551 HA SER 22 HA SER 22 7.520 2.362 -12.444 552 HG SER 22 HG SER 22 4.458 0.796 -14.618 553 HB2 SER 22 2HB SER 22 5.053 2.410 -13.098 554 HB3 SER 22 3HB SER 22 6.212 2.285 -14.432 555 H HIS 23 HN HIS 23 6.194 -0.880 -11.818 556 HA HIS 23 HA HIS 23 4.627 -0.102 -9.529 557 HD1 HIS 23 1HD HIS 23 3.764 -4.504 -8.971 558 HD2 HIS 23 2HD HIS 23 7.753 -3.411 -9.745 559 HE1 HIS 23 1HE HIS 23 5.196 -6.582 -8.625 560 HB2 HIS 23 2HB HIS 23 3.955 -2.159 -9.634 561 HB3 HIS 23 3HB HIS 23 4.817 -2.339 -11.073 562 H LEU 24 HN LEU 24 7.965 -1.408 -9.984 563 HA LEU 24 HA LEU 24 8.722 -1.185 -7.240 564 HG LEU 24 HG LEU 24 12.058 -2.245 -8.169 565 HB2 LEU 24 2HB LEU 24 9.965 -2.436 -8.926 566 HB3 LEU 24 3HB LEU 24 10.381 -1.002 -9.784 567 HD11 LEU 24 1HD1 LEU 24 13.385 -0.211 -7.953 568 HD12 LEU 24 2HD1 LEU 24 11.974 0.775 -8.388 569 HD13 LEU 24 3HD1 LEU 24 12.659 -0.369 -9.562 570 HD21 LEU 24 3HD2 LEU 24 11.479 -0.126 -6.152 571 HD22 LEU 24 1HD2 LEU 24 12.233 -1.690 -5.990 572 HD23 LEU 24 2HD2 LEU 24 10.473 -1.587 -6.096 573 H GLN 25 HN GLN 25 8.628 1.230 -9.884 574 HA GLN 25 HA GLN 25 10.016 3.335 -8.530 575 HB2 GLN 25 2HB GLN 25 9.198 3.182 -10.988 576 HB3 GLN 25 3HB GLN 25 7.649 3.796 -10.383 577 HG2 GLN 25 2HG GLN 25 8.826 5.779 -9.454 578 HG3 GLN 25 3HG GLN 25 10.344 5.173 -10.141 579 HE21 GLN 25 1HE2 GLN 25 8.645 7.705 -10.779 580 HE22 GLN 25 2HE2 GLN 25 8.456 7.511 -12.529 581 H MET 26 HN MET 26 6.575 2.269 -8.445 582 HA MET 26 HA MET 26 5.639 4.339 -6.670 583 HB2 MET 26 2HB MET 26 4.084 2.918 -7.950 584 HB3 MET 26 3HB MET 26 4.620 1.483 -7.076 585 HG2 MET 26 2HG MET 26 2.574 2.214 -6.093 586 HG3 MET 26 3HG MET 26 3.843 2.461 -4.935 587 HE1 MET 26 3HE MET 26 1.949 3.865 -3.617 588 HE2 MET 26 1HE MET 26 1.138 5.295 -4.301 589 HE3 MET 26 2HE MET 26 0.816 3.686 -4.984 590 H HIS 27 HN HIS 27 6.909 0.996 -6.075 591 HA HIS 27 HA HIS 27 6.671 1.031 -3.244 592 HD1 HIS 27 1HD HIS 27 7.503 -0.734 -1.404 593 HD2 HIS 27 2HD HIS 27 10.931 -0.682 -3.861 594 HE1 HIS 27 1HE HIS 27 9.555 -1.092 0.127 595 HB2 HIS 27 2HB HIS 27 7.262 -1.043 -4.319 596 HB3 HIS 27 3HB HIS 27 8.678 -0.333 -5.101 597 H SER 28 HN SER 28 9.464 1.938 -5.282 598 HA SER 28 HA SER 28 11.142 2.891 -3.369 599 HG SER 28 HG SER 28 10.929 2.050 -6.391 600 HB2 SER 28 2HB SER 28 10.695 4.312 -6.032 601 HB3 SER 28 3HB SER 28 12.178 4.276 -5.073 602 H ARG 29 HN ARG 29 8.251 4.589 -4.654 603 HA ARG 29 HA ARG 29 8.774 7.176 -3.484 604 HE ARG 29 HE ARG 29 5.853 10.701 -4.758 605 HB2 ARG 29 2HB ARG 29 6.992 6.626 -5.212 606 HB3 ARG 29 3HB ARG 29 6.046 5.885 -3.915 607 HG2 ARG 29 2HG ARG 29 5.292 8.133 -4.389 608 HG3 ARG 29 3HG ARG 29 5.846 7.973 -2.724 609 HD2 ARG 29 2HD ARG 29 7.884 9.195 -3.195 610 HD3 ARG 29 3HD ARG 29 7.593 9.113 -4.938 611 HH11 ARG 29 2HH2 ARG 29 7.446 10.425 -1.553 612 HH12 ARG 29 1HH2 ARG 29 6.610 11.863 -1.024 613 HH21 ARG 29 2HH1 ARG 29 4.894 12.437 -3.938 614 HH22 ARG 29 1HH1 ARG 29 5.132 12.884 -2.267 615 H LYS 30 HN LYS 30 7.370 4.134 -2.214 616 HA LYS 30 HA LYS 30 6.333 5.189 0.252 617 HB2 LYS 30 2HB LYS 30 5.978 2.862 -0.795 618 HB3 LYS 30 3HB LYS 30 7.531 2.390 -0.097 619 HG2 LYS 30 2HG LYS 30 5.408 3.659 1.643 620 HG3 LYS 30 3HG LYS 30 5.240 1.979 1.175 621 HD2 LYS 30 2HD LYS 30 7.125 1.255 2.347 622 HD3 LYS 30 3HD LYS 30 7.839 2.846 2.478 623 HE2 LYS 30 2HE LYS 30 5.331 1.922 3.928 624 HE3 LYS 30 3HE LYS 30 6.939 2.062 4.629 625 HZ1 LYS 30 3HZ LYS 30 5.636 3.988 5.145 626 HZ2 LYS 30 1HZ LYS 30 5.324 4.286 3.562 627 HZ3 LYS 30 2HZ LYS 30 6.848 4.463 4.125 628 H HIS 31 HN HIS 31 9.621 4.255 -0.783 629 HA HIS 31 HA HIS 31 10.680 4.201 1.942 630 HD1 HIS 31 1HD HIS 31 12.343 2.666 2.799 631 HD2 HIS 31 2HD HIS 31 11.993 1.274 -1.145 632 HE1 HIS 31 1HE HIS 31 12.575 0.133 2.909 633 HB2 HIS 31 2HB HIS 31 11.806 3.907 -0.837 634 HB3 HIS 31 3HB HIS 31 12.892 4.368 0.449 635 H THR 32 HN THR 32 10.109 6.676 -0.467 636 HA THR 32 HA THR 32 11.913 8.720 0.536 637 HB THR 32 HB THR 32 10.538 10.325 -0.548 638 HG1 THR 32 1HG THR 32 8.495 8.362 -0.827 639 HG21 THR 32 3HG2 THR 32 10.504 7.824 -2.264 640 HG22 THR 32 1HG2 THR 32 11.850 8.957 -2.070 641 HG23 THR 32 2HG2 THR 32 10.345 9.501 -2.829 642 H GLY 33 HN GLY 33 9.159 7.167 1.916 643 HA2 GLY 33 2HA GLY 33 9.433 8.937 4.264 644 HA3 GLY 33 3HA GLY 33 7.802 8.741 3.598 645 H GLU 34 HN GLU 34 10.599 6.539 4.202 646 HA GLU 34 HA GLU 34 8.943 4.283 4.699 647 HB2 GLU 34 2HB GLU 34 11.605 4.647 4.215 648 HB3 GLU 34 3HB GLU 34 11.670 4.301 5.943 649 HG2 GLU 34 2HG GLU 34 10.346 2.612 3.785 650 HG3 GLU 34 3HG GLU 34 11.902 2.287 4.563 651 H LYS 35 HN LYS 35 7.549 4.052 6.342 652 HA LYS 35 HA LYS 35 8.511 4.628 9.115 653 HB2 LYS 35 2HB LYS 35 5.831 5.364 7.864 654 HB3 LYS 35 3HB LYS 35 6.042 5.195 9.617 655 HG2 LYS 35 2HG LYS 35 7.813 6.879 9.633 656 HG3 LYS 35 3HG LYS 35 7.720 7.043 7.869 657 HD2 LYS 35 2HD LYS 35 5.486 7.951 7.995 658 HD3 LYS 35 3HD LYS 35 5.381 7.620 9.732 659 HE2 LYS 35 2HE LYS 35 5.825 9.996 9.340 660 HE3 LYS 35 3HE LYS 35 7.190 9.233 10.171 661 HZ1 LYS 35 3HZ LYS 35 8.345 9.121 8.091 662 HZ2 LYS 35 1HZ LYS 35 7.882 10.680 8.355 663 HZ3 LYS 35 2HZ LYS 35 7.068 9.740 7.267 664 HA PRO 36 HA PRO 36 7.087 0.314 8.617 665 HB2 PRO 36 2HB PRO 36 9.205 -0.992 9.725 666 HB3 PRO 36 3HB PRO 36 9.329 -0.185 8.138 667 HG2 PRO 36 2HG PRO 36 10.157 0.905 10.854 668 HG3 PRO 36 3HG PRO 36 11.127 0.861 9.348 669 HD2 PRO 36 2HD PRO 36 9.675 3.060 10.168 670 HD3 PRO 36 3HD PRO 36 9.956 2.685 8.443 671 H TYR 37 HN TYR 37 6.813 -1.552 10.197 672 HA TYR 37 HA TYR 37 6.448 -0.603 13.028 673 HD1 TYR 37 2HD TYR 37 4.421 -0.271 9.733 674 HD2 TYR 37 1HD TYR 37 3.216 -0.060 13.875 675 HE1 TYR 37 2HE TYR 37 3.118 1.788 9.251 676 HE2 TYR 37 1HE TYR 37 1.822 1.944 13.363 677 HH TYR 37 HH TYR 37 2.069 3.876 11.064 678 HB2 TYR 37 2HB TYR 37 4.506 -2.296 11.393 679 HB3 TYR 37 3HB TYR 37 4.407 -1.905 13.109 680 H GLN 38 HN GLN 38 6.272 -2.429 14.591 681 HA GLN 38 HA GLN 38 7.341 -5.018 13.598 682 HB2 GLN 38 2HB GLN 38 9.161 -3.479 14.683 683 HB3 GLN 38 3HB GLN 38 8.373 -3.866 16.215 684 HG2 GLN 38 2HG GLN 38 8.798 -6.282 15.794 685 HG3 GLN 38 3HG GLN 38 9.500 -5.882 14.217 686 HE21 GLN 38 1HE2 GLN 38 11.161 -7.336 15.563 687 HE22 GLN 38 2HE2 GLN 38 12.382 -6.369 16.406 688 H CYS 39 HN CYS 39 6.667 -6.828 14.813 689 HA CYS 39 HA CYS 39 4.272 -6.486 16.482 690 HB2 CYS 39 2HB CYS 39 5.730 -8.719 15.194 691 HB3 CYS 39 3HB CYS 39 5.173 -9.142 16.804 692 H ASP 40 HN ASP 40 4.135 -7.442 18.675 693 HA ASP 40 HA ASP 40 6.682 -7.534 20.189 694 HB2 ASP 40 2HB ASP 40 5.874 -5.202 20.403 695 HB3 ASP 40 3HB ASP 40 4.305 -5.769 20.965 696 H PHE 41 HN PHE 41 6.040 -9.832 19.927 697 HA PHE 41 HA PHE 41 3.931 -10.623 21.915 698 HD1 PHE 41 2HD PHE 41 3.576 -9.671 18.106 699 HD2 PHE 41 1HD PHE 41 1.324 -12.066 20.888 700 HE1 PHE 41 2HE PHE 41 1.536 -8.465 17.482 701 HE2 PHE 41 1HE PHE 41 -0.763 -10.895 20.215 702 HZ PHE 41 HZ PHE 41 -0.663 -9.064 18.543 703 HB2 PHE 41 2HB PHE 41 4.529 -11.677 19.144 704 HB3 PHE 41 3HB PHE 41 3.606 -12.598 20.295 705 H LYS 42 HN LYS 42 4.162 -12.838 22.751 706 HA LYS 42 HA LYS 42 6.881 -13.543 23.485 707 HB2 LYS 42 2HB LYS 42 4.952 -14.025 24.937 708 HB3 LYS 42 3HB LYS 42 4.243 -15.060 23.704 709 HG2 LYS 42 2HG LYS 42 5.236 -16.354 25.524 710 HG3 LYS 42 3HG LYS 42 5.998 -16.716 23.988 711 HD2 LYS 42 2HD LYS 42 7.903 -15.133 24.661 712 HD3 LYS 42 3HD LYS 42 7.102 -14.952 26.228 713 HE2 LYS 42 2HE LYS 42 8.831 -16.606 26.462 714 HE3 LYS 42 3HE LYS 42 7.277 -17.456 26.524 715 HZ1 LYS 42 3HZ LYS 42 9.014 -17.220 24.146 716 HZ2 LYS 42 1HZ LYS 42 7.588 -18.025 24.201 717 HZ3 LYS 42 2HZ LYS 42 8.869 -18.566 25.091 718 H ASP 43 HN ASP 43 4.862 -14.179 20.731 719 HA ASP 43 HA ASP 43 6.731 -16.330 19.812 720 HB2 ASP 43 2HB ASP 43 4.853 -17.363 18.664 721 HB3 ASP 43 3HB ASP 43 4.466 -17.177 20.367 722 H CYS 44 HN CYS 44 6.243 -13.139 19.348 723 HA CYS 44 HA CYS 44 7.136 -13.295 16.564 724 HB2 CYS 44 2HB CYS 44 4.613 -13.193 16.361 725 HB3 CYS 44 3HB CYS 44 4.657 -11.587 17.145 726 H GLU 45 HN GLU 45 8.445 -11.704 15.999 727 HA GLU 45 HA GLU 45 8.340 -9.111 17.363 728 HB2 GLU 45 2HB GLU 45 10.171 -10.766 18.439 729 HB3 GLU 45 3HB GLU 45 11.109 -10.308 17.025 730 HG2 GLU 45 2HG GLU 45 10.390 -7.837 17.775 731 HG3 GLU 45 3HG GLU 45 10.049 -8.609 19.309 732 H ARG 46 HN ARG 46 7.479 -10.092 14.793 733 HA ARG 46 HA ARG 46 9.641 -9.679 12.835 734 HE ARG 46 HE ARG 46 7.739 -14.809 11.599 735 HB2 ARG 46 2HB ARG 46 6.673 -10.308 12.535 736 HB3 ARG 46 3HB ARG 46 7.813 -10.270 11.193 737 HG2 ARG 46 2HG ARG 46 8.996 -12.199 11.989 738 HG3 ARG 46 3HG ARG 46 8.220 -12.132 13.575 739 HD2 ARG 46 2HD ARG 46 6.010 -12.597 12.513 740 HD3 ARG 46 3HD ARG 46 6.814 -12.751 10.951 741 HH11 ARG 46 1HH2 ARG 46 6.033 -13.481 14.453 742 HH12 ARG 46 2HH2 ARG 46 6.163 -14.998 15.296 743 HH21 ARG 46 1HH1 ARG 46 7.790 -16.704 12.777 744 HH22 ARG 46 2HH1 ARG 46 7.043 -16.720 14.365 745 H ARG 47 HN ARG 47 9.408 -8.212 11.013 746 HA ARG 47 HA ARG 47 8.037 -5.701 11.861 747 HE ARG 47 HE ARG 47 9.462 -7.868 8.730 748 HB2 ARG 47 2HB ARG 47 9.858 -4.729 10.166 749 HB3 ARG 47 3HB ARG 47 10.182 -5.031 11.848 750 HG2 ARG 47 2HG ARG 47 12.082 -5.665 10.663 751 HG3 ARG 47 3HG ARG 47 11.385 -7.135 11.300 752 HD2 ARG 47 2HD ARG 47 11.057 -6.168 8.422 753 HD3 ARG 47 3HD ARG 47 12.348 -7.243 8.952 754 HH11 ARG 47 1HH1 ARG 47 12.637 -9.205 9.505 755 HH12 ARG 47 2HH1 ARG 47 12.013 -10.840 9.498 756 HH21 ARG 47 1HH2 ARG 47 8.770 -9.897 8.760 757 HH22 ARG 47 2HH2 ARG 47 9.874 -11.226 9.078 758 H PHE 48 HN PHE 48 7.059 -4.381 10.307 759 HA PHE 48 HA PHE 48 6.606 -5.560 7.601 760 HD1 PHE 48 1HD PHE 48 4.275 -7.490 7.178 761 HD2 PHE 48 2HD PHE 48 5.011 -6.258 11.239 762 HE1 PHE 48 1HE PHE 48 4.229 -9.849 7.917 763 HE2 PHE 48 2HE PHE 48 4.945 -8.618 11.984 764 HZ PHE 48 HZ PHE 48 4.666 -10.416 10.301 765 HB2 PHE 48 2HB PHE 48 4.413 -4.594 9.478 766 HB3 PHE 48 3HB PHE 48 4.182 -5.105 7.810 767 H SER 49 HN SER 49 6.421 -4.030 5.996 768 HA SER 49 HA SER 49 7.267 -1.336 6.782 769 HG SER 49 HG SER 49 7.219 -3.067 3.108 770 HB2 SER 49 2HB SER 49 7.414 -1.026 4.258 771 HB3 SER 49 3HB SER 49 8.376 -2.364 4.911 772 H ARG 50 HN ARG 50 4.243 -2.654 6.749 773 HA ARG 50 HA ARG 50 3.019 0.000 6.263 774 HE ARG 50 HE ARG 50 -0.512 -2.416 3.248 775 HB2 ARG 50 2HB ARG 50 2.837 -1.323 4.126 776 HB3 ARG 50 3HB ARG 50 1.874 -2.537 4.973 777 HG2 ARG 50 2HG ARG 50 0.045 -1.019 5.263 778 HG3 ARG 50 3HG ARG 50 1.078 0.393 5.037 779 HD2 ARG 50 2HD ARG 50 -0.283 0.236 3.107 780 HD3 ARG 50 3HD ARG 50 1.369 -0.181 2.650 781 HH11 ARG 50 1HH2 ARG 50 1.009 -0.535 0.691 782 HH12 ARG 50 2HH2 ARG 50 0.586 -1.769 -0.488 783 HH21 ARG 50 2HH1 ARG 50 -1.065 -3.812 1.603 784 HH22 ARG 50 1HH1 ARG 50 -0.535 -3.440 -0.005 785 H SER 51 HN SER 51 1.326 0.454 7.602 786 HA SER 51 HA SER 51 0.997 -0.947 10.017 787 HG SER 51 HG SER 51 0.758 2.197 9.762 788 HB2 SER 51 2HB SER 51 -1.345 0.590 8.948 789 HB3 SER 51 3HB SER 51 -0.569 0.686 10.534 790 H ASP 52 HN ASP 52 -1.051 -1.018 7.063 791 HA ASP 52 HA ASP 52 -3.031 -2.767 7.962 792 HB2 ASP 52 2HB ASP 52 -2.969 -1.498 5.792 793 HB3 ASP 52 3HB ASP 52 -1.828 -2.668 5.161 794 H GLN 53 HN GLN 53 0.182 -3.574 6.542 795 HA GLN 53 HA GLN 53 -0.243 -6.409 6.408 796 HB2 GLN 53 2HB GLN 53 2.234 -4.640 6.456 797 HB3 GLN 53 3HB GLN 53 2.361 -6.394 6.535 798 HG2 GLN 53 2HG GLN 53 1.019 -4.838 4.304 799 HG3 GLN 53 3HG GLN 53 2.601 -5.618 4.233 800 HE21 GLN 53 1HE2 GLN 53 2.526 -8.210 4.705 801 HE22 GLN 53 2HE2 GLN 53 1.043 -8.895 3.988 802 H LEU 54 HN LEU 54 1.355 -4.310 8.886 803 HA LEU 54 HA LEU 54 1.969 -6.406 10.737 804 HG LEU 54 HG LEU 54 1.237 -5.054 13.293 805 HB2 LEU 54 2HB LEU 54 2.857 -4.069 10.922 806 HB3 LEU 54 3HB LEU 54 1.234 -3.491 11.254 807 HD11 LEU 54 1HD1 LEU 54 3.178 -6.452 12.726 808 HD12 LEU 54 2HD1 LEU 54 3.445 -5.626 14.250 809 HD13 LEU 54 3HD1 LEU 54 4.232 -5.001 12.803 810 HD21 LEU 54 3HD2 LEU 54 3.241 -3.273 14.243 811 HD22 LEU 54 1HD2 LEU 54 1.506 -3.236 14.454 812 HD23 LEU 54 2HD2 LEU 54 2.200 -2.409 13.062 813 H LYS 55 HN LYS 55 -0.937 -4.245 10.527 814 HA LYS 55 HA LYS 55 -2.269 -5.322 12.795 815 HB2 LYS 55 2HB LYS 55 -3.270 -3.863 10.319 816 HB3 LYS 55 3HB LYS 55 -4.361 -4.333 11.626 817 HG2 LYS 55 2HG LYS 55 -1.849 -2.694 12.125 818 HG3 LYS 55 3HG LYS 55 -3.396 -1.954 11.732 819 HD2 LYS 55 2HD LYS 55 -4.421 -2.629 13.726 820 HD3 LYS 55 3HD LYS 55 -3.263 -3.916 14.052 821 HE2 LYS 55 2HE LYS 55 -2.563 -0.959 14.130 822 HE3 LYS 55 3HE LYS 55 -3.015 -1.930 15.543 823 HZ1 LYS 55 3HZ LYS 55 -1.140 -3.389 15.051 824 HZ2 LYS 55 1HZ LYS 55 -0.648 -1.840 15.337 825 HZ3 LYS 55 2HZ LYS 55 -0.699 -2.423 13.796 826 H ARG 56 HN ARG 56 -2.507 -6.225 9.314 827 HA ARG 56 HA ARG 56 -4.470 -8.308 9.660 828 HE ARG 56 HE ARG 56 -4.125 -8.563 4.812 829 HB2 ARG 56 2HB ARG 56 -3.773 -7.344 7.446 830 HB3 ARG 56 3HB ARG 56 -2.193 -8.096 7.644 831 HG2 ARG 56 2HG ARG 56 -3.769 -10.309 7.958 832 HG3 ARG 56 3HG ARG 56 -4.856 -9.340 6.976 833 HD2 ARG 56 2HD ARG 56 -1.937 -9.848 6.241 834 HD3 ARG 56 3HD ARG 56 -3.220 -10.982 5.827 835 HH11 ARG 56 1HH1 ARG 56 -1.283 -10.573 4.301 836 HH12 ARG 56 2HH1 ARG 56 -1.105 -10.045 2.634 837 HH21 ARG 56 2HH2 ARG 56 -3.916 -8.075 2.559 838 HH22 ARG 56 1HH2 ARG 56 -2.612 -8.904 1.716 839 H HIS 57 HN HIS 57 -0.877 -8.323 9.654 840 HA HIS 57 HA HIS 57 -0.521 -11.098 10.052 841 HD1 HIS 57 1HD HIS 57 2.402 -12.258 10.009 842 HD2 HIS 57 2HD HIS 57 2.225 -9.345 13.045 843 HE1 HIS 57 1HE HIS 57 3.677 -13.207 12.016 844 HB2 HIS 57 2HB HIS 57 1.341 -9.735 9.388 845 HB3 HIS 57 3HB HIS 57 1.172 -8.669 10.784 846 H GLN 58 HN GLN 58 -1.018 -8.453 12.423 847 HA GLN 58 HA GLN 58 -0.521 -9.780 14.813 848 HB2 GLN 58 2HB GLN 58 -1.898 -7.384 13.989 849 HB3 GLN 58 3HB GLN 58 -2.907 -8.216 15.147 850 HG2 GLN 58 2HG GLN 58 -1.697 -7.228 16.734 851 HG3 GLN 58 3HG GLN 58 -0.413 -8.364 16.367 852 HE21 GLN 58 1HE2 GLN 58 1.702 -7.430 15.493 853 HE22 GLN 58 2HE2 GLN 58 1.642 -5.731 15.136 854 H ARG 59 HN ARG 59 -3.376 -10.032 12.696 855 HA ARG 59 HA ARG 59 -5.185 -11.256 14.517 856 HE ARG 59 HE ARG 59 -6.596 -7.668 11.444 857 HB2 ARG 59 2HB ARG 59 -4.959 -11.761 11.515 858 HB3 ARG 59 3HB ARG 59 -6.372 -12.053 12.533 859 HG2 ARG 59 2HG ARG 59 -6.512 -9.633 13.089 860 HG3 ARG 59 3HG ARG 59 -5.090 -9.323 12.109 861 HD2 ARG 59 2HD ARG 59 -6.348 -10.210 10.112 862 HD3 ARG 59 3HD ARG 59 -7.813 -10.154 11.123 863 HH11 ARG 59 1HH1 ARG 59 -7.895 -9.351 8.644 864 HH12 ARG 59 2HH1 ARG 59 -7.950 -7.866 7.693 865 HH21 ARG 59 1HH2 ARG 59 -6.814 -5.839 10.230 866 HH22 ARG 59 2HH2 ARG 59 -7.380 -5.945 8.581 867 H ARG 60 HN ARG 60 -2.452 -12.609 12.698 868 HA ARG 60 HA ARG 60 -3.106 -15.377 12.812 869 HE ARG 60 HE ARG 60 0.945 -18.220 12.071 870 HB2 ARG 60 2HB ARG 60 -1.231 -14.356 11.514 871 HB3 ARG 60 3HB ARG 60 -0.343 -14.086 13.025 872 HG2 ARG 60 2HG ARG 60 -0.191 -16.484 13.436 873 HG3 ARG 60 3HG ARG 60 -1.246 -16.827 12.059 874 HD2 ARG 60 2HD ARG 60 0.500 -15.765 10.558 875 HD3 ARG 60 3HD ARG 60 1.522 -15.541 11.979 876 HH11 ARG 60 1HH1 ARG 60 2.398 -16.251 9.509 877 HH12 ARG 60 2HH1 ARG 60 3.408 -17.583 8.990 878 HH21 ARG 60 1HH2 ARG 60 2.204 -19.845 11.273 879 HH22 ARG 60 2HH2 ARG 60 3.279 -19.546 9.930 880 H HIS 61 HN HIS 61 -1.763 -13.203 15.333 881 HA HIS 61 HA HIS 61 -1.306 -15.511 17.161 882 HD1 HIS 61 1HD HIS 61 -0.753 -11.184 16.143 883 HD2 HIS 61 2HD HIS 61 2.242 -13.981 16.927 884 HE1 HIS 61 1HE HIS 61 1.432 -10.266 15.109 885 HB2 HIS 61 2HB HIS 61 -1.026 -12.782 18.261 886 HB3 HIS 61 3HB HIS 61 0.045 -14.152 18.365 887 H THR 62 HN THR 62 -3.424 -12.636 16.808 888 HA THR 62 HA THR 62 -4.643 -13.015 19.433 889 HB THR 62 HB THR 62 -6.092 -11.156 18.817 890 HG1 THR 62 1HG THR 62 -5.843 -10.239 16.746 891 HG21 THR 62 3HG2 THR 62 -3.769 -10.566 19.468 892 HG22 THR 62 1HG2 THR 62 -4.466 -9.399 18.333 893 HG23 THR 62 2HG2 THR 62 -3.279 -10.588 17.765 894 H GLY 63 HN GLY 63 -5.103 -14.565 16.429 895 HA2 GLY 63 2HA GLY 63 -6.617 -16.188 15.806 896 HA3 GLY 63 3HA GLY 63 -7.197 -16.165 17.480 897 H VAL 64 HN VAL 64 -7.542 -13.050 16.198 898 HA VAL 64 HA VAL 64 -10.398 -13.206 16.309 899 HB VAL 64 HB VAL 64 -10.361 -10.884 15.511 900 HG11 VAL 64 1HG1 VAL 64 -9.990 -11.413 17.874 901 HG12 VAL 64 2HG1 VAL 64 -8.239 -11.424 17.614 902 HG13 VAL 64 3HG1 VAL 64 -9.165 -9.924 17.396 903 HG21 VAL 64 3HG2 VAL 64 -7.417 -11.296 14.959 904 HG22 VAL 64 1HG2 VAL 64 -8.663 -10.627 13.898 905 HG23 VAL 64 2HG2 VAL 64 -8.117 -9.692 15.285 906 H LYS 65 HN LYS 65 -11.775 -14.001 14.871 907 HA LYS 65 HA LYS 65 -11.158 -13.669 11.959 908 HB2 LYS 65 2HB LYS 65 -12.520 -16.001 13.368 909 HB3 LYS 65 3HB LYS 65 -12.535 -15.752 11.616 910 HG2 LYS 65 2HG LYS 65 -10.235 -16.073 11.378 911 HG3 LYS 65 3HG LYS 65 -9.925 -16.029 13.121 912 HD2 LYS 65 2HD LYS 65 -11.577 -18.152 11.677 913 HD3 LYS 65 3HD LYS 65 -9.863 -18.318 12.051 914 HE2 LYS 65 2HE LYS 65 -12.054 -17.934 14.137 915 HE3 LYS 65 3HE LYS 65 -11.351 -19.489 13.668 916 HZ1 LYS 65 3HZ LYS 65 -10.289 -18.660 15.622 917 HZ2 LYS 65 1HZ LYS 65 -9.891 -17.239 14.905 918 HZ3 LYS 65 2HZ LYS 65 -9.199 -18.643 14.387 919 HA PRO 66 HA PRO 66 -15.083 -11.575 13.308 920 HB2 PRO 66 2HB PRO 66 -14.613 -9.061 12.330 921 HB3 PRO 66 3HB PRO 66 -13.871 -9.656 13.844 922 HG2 PRO 66 2HG PRO 66 -12.634 -9.609 11.068 923 HG3 PRO 66 3HG PRO 66 -11.930 -9.001 12.601 924 HD2 PRO 66 2HD PRO 66 -11.339 -11.477 11.633 925 HD3 PRO 66 3HD PRO 66 -11.517 -11.166 13.389 926 H PHE 67 HN PHE 67 -13.505 -11.948 10.177 927 HA PHE 67 HA PHE 67 -15.819 -10.926 8.650 928 HD1 PHE 67 2HD PHE 67 -14.780 -9.262 6.416 929 HD2 PHE 67 1HD PHE 67 -11.624 -10.982 8.785 930 HE1 PHE 67 2HE PHE 67 -13.558 -7.099 6.370 931 HE2 PHE 67 1HE PHE 67 -10.379 -8.841 8.694 932 HZ PHE 67 HZ PHE 67 -11.351 -6.889 7.488 933 HB2 PHE 67 2HB PHE 67 -13.279 -12.382 7.778 934 HB3 PHE 67 3HB PHE 67 -14.435 -11.750 6.673 935 H GLN 68 HN GLN 68 -17.243 -12.588 9.980 936 HA GLN 68 HA GLN 68 -17.117 -15.276 8.993 937 HB2 GLN 68 2HB GLN 68 -17.897 -14.642 11.243 938 HB3 GLN 68 3HB GLN 68 -19.255 -13.768 10.547 939 HG2 GLN 68 2HG GLN 68 -20.215 -15.860 9.680 940 HG3 GLN 68 3HG GLN 68 -18.828 -16.765 10.316 941 HE21 GLN 68 1HE2 GLN 68 -22.095 -16.457 11.053 942 HE22 GLN 68 2HE2 GLN 68 -21.832 -16.380 12.789 943 H CYS 69 HN CYS 69 -18.190 -16.330 7.416 944 HA CYS 69 HA CYS 69 -19.717 -14.883 5.427 945 HB2 CYS 69 2HB CYS 69 -18.529 -16.959 4.837 946 HB3 CYS 69 3HB CYS 69 -19.501 -17.881 6.004 947 H LYS 70 HN LYS 70 -21.765 -14.183 5.583 948 HA LYS 70 HA LYS 70 -23.472 -14.835 7.767 949 HB2 LYS 70 2HB LYS 70 -23.874 -13.416 5.109 950 HB3 LYS 70 3HB LYS 70 -25.249 -13.733 6.162 951 HG2 LYS 70 2HG LYS 70 -24.348 -11.473 6.504 952 HG3 LYS 70 3HG LYS 70 -24.314 -12.453 7.975 953 HD2 LYS 70 2HD LYS 70 -21.922 -12.839 7.726 954 HD3 LYS 70 3HD LYS 70 -21.899 -11.963 6.177 955 HE2 LYS 70 2HE LYS 70 -22.542 -9.893 7.398 956 HE3 LYS 70 3HE LYS 70 -22.575 -10.819 8.915 957 HZ1 LYS 70 3HZ LYS 70 -20.228 -10.360 7.194 958 HZ2 LYS 70 1HZ LYS 70 -20.235 -11.391 8.465 959 HZ3 LYS 70 2HZ LYS 70 -20.465 -9.770 8.718 960 H THR 71 HN THR 71 -22.733 -16.690 5.001 961 HA THR 71 HA THR 71 -25.400 -17.975 4.810 962 HB THR 71 HB THR 71 -23.158 -19.206 3.293 963 HG1 THR 71 1HG THR 71 -22.352 -17.233 3.098 964 HG21 THR 71 3HG2 THR 71 -25.527 -19.699 2.868 965 HG22 THR 71 1HG2 THR 71 -24.708 -19.017 1.449 966 HG23 THR 71 2HG2 THR 71 -25.788 -17.994 2.418 967 H CYS 72 HN CYS 72 -22.041 -19.335 4.994 968 HA CYS 72 HA CYS 72 -23.153 -21.705 6.382 969 HB2 CYS 72 2HB CYS 72 -20.906 -22.658 5.932 970 HB3 CYS 72 3HB CYS 72 -21.650 -22.013 4.446 971 H GLN 73 HN GLN 73 -21.802 -18.738 7.305 972 HA GLN 73 HA GLN 73 -21.134 -17.923 9.359 973 HB2 GLN 73 2HB GLN 73 -21.520 -20.669 10.635 974 HB3 GLN 73 3HB GLN 73 -21.553 -19.090 11.373 975 HG2 GLN 73 2HG GLN 73 -23.670 -20.368 9.637 976 HG3 GLN 73 3HG GLN 73 -23.813 -19.731 11.267 977 HE21 GLN 73 1HE2 GLN 73 -24.819 -19.102 8.139 978 HE22 GLN 73 2HE2 GLN 73 -24.933 -17.365 8.271 979 H ARG 74 HN ARG 74 -19.352 -19.526 7.381 980 HA ARG 74 HA ARG 74 -17.150 -20.503 9.001 981 HE ARG 74 HE ARG 74 -13.075 -21.493 7.302 982 HB2 ARG 74 2HB ARG 74 -17.553 -21.205 6.641 983 HB3 ARG 74 3HB ARG 74 -17.187 -19.565 6.094 984 HG2 ARG 74 2HG ARG 74 -15.242 -20.941 5.750 985 HG3 ARG 74 3HG ARG 74 -14.862 -19.839 7.079 986 HD2 ARG 74 2HD ARG 74 -15.453 -21.709 8.687 987 HD3 ARG 74 3HD ARG 74 -15.688 -22.764 7.282 988 HH11 ARG 74 1HH2 ARG 74 -14.853 -24.144 8.767 989 HH12 ARG 74 2HH2 ARG 74 -13.398 -25.024 9.177 990 HH21 ARG 74 1HH1 ARG 74 -11.214 -22.731 7.827 991 HH22 ARG 74 2HH1 ARG 74 -11.442 -24.228 8.687 992 H LYS 75 HN LYS 75 -15.965 -19.241 10.292 993 HA LYS 75 HA LYS 75 -15.815 -16.391 9.845 994 HB2 LYS 75 2HB LYS 75 -14.448 -18.152 11.927 995 HB3 LYS 75 3HB LYS 75 -14.579 -16.391 11.962 996 HG2 LYS 75 2HG LYS 75 -17.027 -16.540 12.106 997 HG3 LYS 75 3HG LYS 75 -16.922 -18.311 12.156 998 HD2 LYS 75 2HD LYS 75 -15.593 -18.198 14.224 999 HD3 LYS 75 3HD LYS 75 -15.606 -16.419 14.159 1000 HE2 LYS 75 2HE LYS 75 -18.042 -16.387 14.378 1001 HE3 LYS 75 3HE LYS 75 -18.106 -18.153 14.346 1002 HZ1 LYS 75 3HZ LYS 75 -16.825 -18.164 16.389 1003 HZ2 LYS 75 1HZ LYS 75 -18.206 -17.289 16.584 1004 HZ3 LYS 75 2HZ LYS 75 -16.764 -16.517 16.403 1005 H PHE 76 HN PHE 76 -14.167 -15.141 9.140 1006 HA PHE 76 HA PHE 76 -11.527 -16.444 8.575 1007 HD1 PHE 76 1HD PHE 76 -11.111 -17.496 5.926 1008 HD2 PHE 76 2HD PHE 76 -14.998 -15.633 6.172 1009 HE1 PHE 76 1HE PHE 76 -12.092 -19.333 4.587 1010 HE2 PHE 76 2HE PHE 76 -15.981 -17.494 4.904 1011 HZ PHE 76 HZ PHE 76 -14.525 -19.353 4.089 1012 HB2 PHE 76 2HB PHE 76 -13.002 -14.417 6.824 1013 HB3 PHE 76 3HB PHE 76 -11.408 -15.059 6.515 1014 H SER 77 HN SER 77 -9.698 -14.951 8.515 1015 HA SER 77 HA SER 77 -10.113 -12.582 10.294 1016 HG SER 77 HG SER 77 -8.730 -13.780 12.099 1017 HB2 SER 77 2HB SER 77 -7.596 -14.121 9.499 1018 HB3 SER 77 3HB SER 77 -7.603 -12.686 10.528 1019 H ARG 78 HN ARG 78 -9.955 -13.245 7.008 1020 HA ARG 78 HA ARG 78 -8.818 -10.542 6.417 1021 HE ARG 78 HE ARG 78 -5.935 -12.244 3.408 1022 HB2 ARG 78 2HB ARG 78 -8.158 -13.194 5.070 1023 HB3 ARG 78 3HB ARG 78 -7.872 -11.622 4.304 1024 HG2 ARG 78 2HG ARG 78 -6.312 -10.936 5.959 1025 HG3 ARG 78 3HG ARG 78 -6.731 -12.270 7.036 1026 HD2 ARG 78 2HD ARG 78 -4.598 -12.692 6.031 1027 HD3 ARG 78 3HD ARG 78 -5.767 -13.895 5.512 1028 HH11 ARG 78 1HH1 ARG 78 -3.087 -13.571 4.966 1029 HH12 ARG 78 2HH1 ARG 78 -2.131 -13.409 3.489 1030 HH21 ARG 78 2HH2 ARG 78 -4.661 -12.033 1.644 1031 HH22 ARG 78 1HH2 ARG 78 -3.051 -12.734 1.610 1032 H SER 79 HN SER 79 -9.848 -9.380 4.875 1033 HA SER 79 HA SER 79 -12.549 -10.132 4.178 1034 HG SER 79 HG SER 79 -10.519 -6.749 3.221 1035 HB2 SER 79 2HB SER 79 -12.419 -8.008 2.790 1036 HB3 SER 79 3HB SER 79 -12.058 -7.808 4.513 1037 H ASP 80 HN ASP 80 -9.413 -10.079 2.438 1038 HA ASP 80 HA ASP 80 -10.422 -10.626 -0.158 1039 HB2 ASP 80 2HB ASP 80 -8.118 -11.510 -0.617 1040 HB3 ASP 80 3HB ASP 80 -8.227 -9.890 0.068 1041 H HIS 81 HN HIS 81 -9.385 -12.956 2.453 1042 HA HIS 81 HA HIS 81 -10.057 -15.368 1.042 1043 HD1 HIS 81 1HD HIS 81 -7.452 -15.130 1.522 1044 HD2 HIS 81 2HD HIS 81 -8.334 -16.178 5.492 1045 HE1 HIS 81 1HE HIS 81 -5.287 -15.620 2.576 1046 HB2 HIS 81 2HB HIS 81 -10.178 -14.727 4.031 1047 HB3 HIS 81 3HB HIS 81 -10.326 -16.326 3.344 1048 H LEU 82 HN LEU 82 -11.990 -13.278 3.302 1049 HA LEU 82 HA LEU 82 -14.321 -14.892 3.285 1050 HG LEU 82 HG LEU 82 -16.439 -13.527 3.489 1051 HB2 LEU 82 2HB LEU 82 -14.039 -13.145 4.902 1052 HB3 LEU 82 3HB LEU 82 -13.968 -11.884 3.674 1053 HD11 LEU 82 1HD1 LEU 82 -16.319 -11.802 5.941 1054 HD12 LEU 82 2HD1 LEU 82 -16.132 -13.615 5.876 1055 HD13 LEU 82 3HD1 LEU 82 -17.598 -12.836 5.354 1056 HD21 LEU 82 3HD2 LEU 82 -17.544 -11.356 3.351 1057 HD22 LEU 82 1HD2 LEU 82 -16.148 -11.366 2.274 1058 HD23 LEU 82 2HD2 LEU 82 -16.048 -10.525 3.834 1059 H LYS 83 HN LYS 83 -13.477 -12.078 1.173 1060 HA LYS 83 HA LYS 83 -15.904 -12.146 -0.374 1061 HB2 LYS 83 2HB LYS 83 -14.298 -10.234 -0.301 1062 HB3 LYS 83 3HB LYS 83 -13.103 -11.197 -1.180 1063 HG2 LYS 83 2HG LYS 83 -14.678 -11.351 -3.119 1064 HG3 LYS 83 3HG LYS 83 -15.864 -10.391 -2.215 1065 HD2 LYS 83 2HD LYS 83 -14.271 -8.487 -2.171 1066 HD3 LYS 83 3HD LYS 83 -13.074 -9.470 -3.047 1067 HE2 LYS 83 2HE LYS 83 -14.736 -9.747 -4.908 1068 HE3 LYS 83 3HE LYS 83 -15.838 -8.657 -4.050 1069 HZ1 LYS 83 3HZ LYS 83 -13.142 -7.974 -5.022 1070 HZ2 LYS 83 1HZ LYS 83 -14.152 -6.941 -4.213 1071 HZ3 LYS 83 2HZ LYS 83 -14.560 -7.499 -5.707 1072 H THR 84 HN THR 84 -12.747 -13.816 -0.712 1073 HA THR 84 HA THR 84 -13.267 -15.021 -3.271 1074 HB THR 84 HB THR 84 -11.569 -15.799 -0.894 1075 HG1 THR 84 1HG THR 84 -10.772 -14.082 -1.717 1076 HG21 THR 84 3HG2 THR 84 -11.879 -17.935 -2.092 1077 HG22 THR 84 1HG2 THR 84 -10.248 -17.299 -2.026 1078 HG23 THR 84 2HG2 THR 84 -11.198 -17.156 -3.545 1079 H HIS 85 HN HIS 85 -13.649 -16.252 0.091 1080 HA HIS 85 HA HIS 85 -14.819 -18.742 -0.618 1081 HD1 HIS 85 1HD HIS 85 -15.828 -20.767 1.463 1082 HD2 HIS 85 2HD HIS 85 -17.203 -17.014 2.812 1083 HE1 HIS 85 1HE HIS 85 -18.265 -21.085 2.262 1084 HB2 HIS 85 2HB HIS 85 -13.981 -18.554 1.587 1085 HB3 HIS 85 3HB HIS 85 -14.808 -17.021 1.877 1086 H THR 86 HN THR 86 -16.214 -15.539 0.044 1087 HA THR 86 HA THR 86 -18.929 -16.187 0.201 1088 HB THR 86 HB THR 86 -17.543 -13.772 -1.022 1089 HG1 THR 86 1HG THR 86 -17.159 -14.055 1.134 1090 HG21 THR 86 3HG2 THR 86 -19.838 -13.701 -1.864 1091 HG22 THR 86 1HG2 THR 86 -19.478 -12.448 -0.666 1092 HG23 THR 86 2HG2 THR 86 -20.445 -13.876 -0.189 1093 H ARG 87 HN ARG 87 -16.829 -15.790 -2.702 1094 HA ARG 87 HA ARG 87 -19.036 -15.712 -4.572 1095 HE ARG 87 HE ARG 87 -14.484 -13.264 -5.557 1096 HB2 ARG 87 2HB ARG 87 -16.043 -16.168 -4.840 1097 HB3 ARG 87 3HB ARG 87 -17.136 -16.424 -6.212 1098 HG2 ARG 87 2HG ARG 87 -18.160 -14.158 -5.791 1099 HG3 ARG 87 3HG ARG 87 -16.918 -13.854 -4.575 1100 HD2 ARG 87 2HD ARG 87 -16.425 -14.407 -7.529 1101 HD3 ARG 87 3HD ARG 87 -16.493 -12.809 -6.796 1102 HH11 ARG 87 1HH2 ARG 87 -15.166 -15.879 -7.925 1103 HH12 ARG 87 2HH2 ARG 87 -13.468 -16.365 -7.794 1104 HH21 ARG 87 2HH1 ARG 87 -12.400 -14.093 -5.575 1105 HH22 ARG 87 1HH1 ARG 87 -12.091 -15.506 -6.596 1106 H THR 88 HN THR 88 -17.436 -18.301 -2.844 1107 HA THR 88 HA THR 88 -18.007 -20.553 -4.482 1108 HB THR 88 HB THR 88 -18.359 -20.499 -1.467 1109 HG1 THR 88 1HG THR 88 -16.571 -19.615 -1.558 1110 HG21 THR 88 3HG2 THR 88 -17.358 -22.721 -1.496 1111 HG22 THR 88 1HG2 THR 88 -17.280 -22.663 -3.272 1112 HG23 THR 88 2HG2 THR 88 -18.856 -22.662 -2.447 1113 H HIS 89 HN HIS 89 -20.097 -18.698 -2.215 1114 HA HIS 89 HA HIS 89 -22.344 -20.564 -2.511 1115 HD1 HIS 89 1HD HIS 89 -22.997 -21.451 -0.288 1116 HD2 HIS 89 2HD HIS 89 -20.887 -18.062 1.065 1117 HE1 HIS 89 1HE HIS 89 -21.963 -22.065 1.980 1118 HB2 HIS 89 2HB HIS 89 -22.091 -17.781 -1.283 1119 HB3 HIS 89 3HB HIS 89 -23.586 -18.717 -1.294 1120 H THR 90 HN THR 90 -21.068 -17.872 -4.301 1121 HA THR 90 HA THR 90 -23.658 -17.303 -5.640 1122 HB THR 90 HB THR 90 -22.511 -15.455 -6.681 1123 HG1 THR 90 1HG THR 90 -20.215 -16.852 -5.863 1124 HG21 THR 90 3HG2 THR 90 -23.158 -15.062 -4.319 1125 HG22 THR 90 1HG2 THR 90 -21.738 -14.120 -4.815 1126 HG23 THR 90 2HG2 THR 90 -21.532 -15.555 -3.798 1127 H GLY 91 HN GLY 91 -21.080 -19.484 -6.036 1128 HA2 GLY 91 2HA GLY 91 -20.477 -20.880 -7.789 1129 HA3 GLY 91 3HA GLY 91 -21.927 -20.344 -8.656 1130 H GLU 92 HN GLU 92 -20.028 -17.640 -7.783 1131 HA GLU 92 HA GLU 92 -19.478 -17.052 -10.551 1132 HB2 GLU 92 2HB GLU 92 -20.049 -15.470 -8.601 1133 HB3 GLU 92 3HB GLU 92 -18.349 -15.513 -8.162 1134 HG2 GLU 92 2HG GLU 92 -19.604 -14.611 -10.803 1135 HG3 GLU 92 3HG GLU 92 -19.043 -13.547 -9.517 1136 H LYS 93 HN LYS 93 -17.958 -18.211 -11.604 1137 HA LYS 93 HA LYS 93 -15.216 -18.370 -10.404 1138 HB2 LYS 93 2HB LYS 93 -16.685 -20.364 -12.182 1139 HB3 LYS 93 3HB LYS 93 -14.949 -20.440 -11.873 1140 HG2 LYS 93 2HG LYS 93 -15.315 -20.730 -9.496 1141 HG3 LYS 93 3HG LYS 93 -17.064 -20.510 -9.675 1142 HD2 LYS 93 2HD LYS 93 -17.158 -22.559 -11.078 1143 HD3 LYS 93 3HD LYS 93 -15.422 -22.805 -10.831 1144 HE2 LYS 93 2HE LYS 93 -17.501 -22.678 -8.603 1145 HE3 LYS 93 3HE LYS 93 -16.878 -24.176 -9.313 1146 HZ1 LYS 93 3HZ LYS 93 -15.715 -23.613 -7.295 1147 HZ2 LYS 93 1HZ LYS 93 -15.252 -22.161 -7.912 1148 HZ3 LYS 93 2HZ LYS 93 -14.683 -23.558 -8.577 1149 HA PRO 94 HA PRO 94 -15.082 -15.836 -14.183 1150 HB2 PRO 94 2HB PRO 94 -13.360 -13.890 -13.347 1151 HB3 PRO 94 3HB PRO 94 -15.040 -13.994 -12.750 1152 HG2 PRO 94 2HG PRO 94 -12.518 -14.975 -11.400 1153 HG3 PRO 94 3HG PRO 94 -13.862 -14.036 -10.683 1154 HD2 PRO 94 2HD PRO 94 -13.601 -16.772 -10.515 1155 HD3 PRO 94 3HD PRO 94 -15.184 -15.952 -10.453 1156 H PHE 95 HN PHE 95 -12.431 -17.450 -12.485 1157 HA PHE 95 HA PHE 95 -10.417 -16.755 -14.532 1158 HD1 PHE 95 2HD PHE 95 -8.119 -15.921 -13.264 1159 HD2 PHE 95 1HD PHE 95 -11.033 -17.345 -10.446 1160 HE1 PHE 95 2HE PHE 95 -7.690 -13.936 -11.831 1161 HE2 PHE 95 1HE PHE 95 -10.594 -15.359 -8.995 1162 HZ PHE 95 HZ PHE 95 -8.929 -13.663 -9.690 1163 HB2 PHE 95 2HB PHE 95 -10.321 -18.758 -12.228 1164 HB3 PHE 95 3HB PHE 95 -8.970 -18.281 -13.249 1165 H SER 96 HN SER 96 -11.771 -17.553 -16.358 1166 HA SER 96 HA SER 96 -12.025 -20.459 -16.705 1167 HG SER 96 HG SER 96 -12.921 -20.002 -19.970 1168 HB2 SER 96 2HB SER 96 -13.542 -18.653 -17.728 1169 HB3 SER 96 3HB SER 96 -12.216 -18.312 -18.858 1170 H CYS 97 HN CYS 97 -10.773 -21.805 -17.983 1171 HA CYS 97 HA CYS 97 -8.014 -21.105 -18.308 1172 HB2 CYS 97 2HB CYS 97 -8.842 -23.427 -17.939 1173 HB3 CYS 97 3HB CYS 97 -9.571 -23.422 -19.548 1174 H ARG 98 HN ARG 98 -6.749 -21.048 -20.257 1175 HA ARG 98 HA ARG 98 -8.230 -19.802 -22.547 1176 HE ARG 98 HE ARG 98 -9.803 -18.723 -20.926 1177 HB2 ARG 98 2HB ARG 98 -5.780 -18.978 -21.016 1178 HB3 ARG 98 3HB ARG 98 -5.696 -18.767 -22.749 1179 HG2 ARG 98 2HG ARG 98 -6.386 -16.738 -21.684 1180 HG3 ARG 98 3HG ARG 98 -7.621 -17.313 -22.792 1181 HD2 ARG 98 2HD ARG 98 -7.860 -18.001 -19.855 1182 HD3 ARG 98 3HD ARG 98 -8.187 -16.347 -20.355 1183 HH11 ARG 98 1HH2 ARG 98 -9.285 -15.381 -21.884 1184 HH12 ARG 98 2HH2 ARG 98 -10.887 -15.243 -22.586 1185 HH21 ARG 98 1HH1 ARG 98 -11.844 -18.473 -21.818 1186 HH22 ARG 98 2HH1 ARG 98 -12.257 -16.948 -22.570 1187 H TRP 99 HN TRP 99 -6.761 -22.610 -21.696 1188 HA TRP 99 HA TRP 99 -4.784 -22.987 -23.754 1189 HD1 TRP 99 1HD TRP 99 -4.790 -23.032 -20.344 1190 HE1 TRP 99 1HE TRP 99 -2.434 -23.383 -19.428 1191 HE3 TRP 99 3HE TRP 99 -3.196 -26.605 -23.636 1192 HZ2 TRP 99 2HZ TRP 99 -0.111 -24.979 -20.077 1193 HZ3 TRP 99 3HZ TRP 99 -0.878 -27.489 -23.494 1194 HH2 TRP 99 2HH TRP 99 0.663 -26.695 -21.723 1195 HB2 TRP 99 2HB TRP 99 -6.376 -24.835 -21.949 1196 HB3 TRP 99 3HB TRP 99 -5.418 -25.490 -23.253 1197 HA PRO 100 HA PRO 100 -7.333 -23.551 -27.298 1198 HB2 PRO 100 2HB PRO 100 -5.648 -24.940 -28.982 1199 HB3 PRO 100 3HB PRO 100 -5.312 -23.283 -28.427 1200 HG2 PRO 100 2HG PRO 100 -4.267 -25.866 -27.217 1201 HG3 PRO 100 3HG PRO 100 -3.320 -24.440 -27.757 1202 HD2 PRO 100 2HD PRO 100 -4.038 -24.759 -25.158 1203 HD3 PRO 100 3HD PRO 100 -4.064 -23.137 -25.924 1204 H SER 101 HN SER 101 -7.632 -25.609 -25.077 1205 HA SER 101 HA SER 101 -9.240 -27.510 -26.569 1206 HG SER 101 HG SER 101 -7.201 -27.850 -27.677 1207 HB2 SER 101 2HB SER 101 -6.682 -28.487 -25.223 1208 HB3 SER 101 3HB SER 101 -8.028 -29.561 -25.662 1209 H CYS 102 HN CYS 102 -9.191 -25.486 -24.215 1210 HA CYS 102 HA CYS 102 -10.752 -27.181 -22.357 1211 HB2 CYS 102 2HB CYS 102 -8.353 -27.144 -21.526 1212 HB3 CYS 102 3HB CYS 102 -8.493 -25.385 -21.392 1213 H GLN 103 HN GLN 103 -11.776 -25.799 -20.633 1214 HA GLN 103 HA GLN 103 -11.832 -22.982 -20.865 1215 HB2 GLN 103 2HB GLN 103 -13.360 -23.839 -22.892 1216 HB3 GLN 103 3HB GLN 103 -14.555 -24.094 -21.648 1217 HG2 GLN 103 2HG GLN 103 -14.649 -21.873 -22.886 1218 HG3 GLN 103 3HG GLN 103 -14.608 -21.741 -21.131 1219 HE21 GLN 103 1HE2 GLN 103 -11.590 -22.369 -23.147 1220 HE22 GLN 103 2HE2 GLN 103 -10.946 -20.816 -22.602 1221 H LYS 104 HN LYS 104 -11.449 -25.058 -18.896 1222 HA LYS 104 HA LYS 104 -13.822 -25.194 -17.177 1223 HB2 LYS 104 2HB LYS 104 -10.874 -25.852 -16.711 1224 HB3 LYS 104 3HB LYS 104 -12.159 -26.130 -15.519 1225 HG2 LYS 104 2HG LYS 104 -13.345 -27.616 -17.127 1226 HG3 LYS 104 3HG LYS 104 -12.076 -27.345 -18.313 1227 HD2 LYS 104 2HD LYS 104 -10.488 -28.247 -16.355 1228 HD3 LYS 104 3HD LYS 104 -11.998 -28.931 -15.753 1229 HE2 LYS 104 2HE LYS 104 -11.082 -30.642 -17.120 1230 HE3 LYS 104 3HE LYS 104 -12.328 -29.887 -18.127 1231 HZ1 LYS 104 3HZ LYS 104 -9.414 -29.449 -18.274 1232 HZ2 LYS 104 1HZ LYS 104 -10.483 -28.523 -19.090 1233 HZ3 LYS 104 2HZ LYS 104 -10.375 -30.136 -19.423 1234 H LYS 105 HN LYS 105 -14.172 -24.048 -15.268 1235 HA LYS 105 HA LYS 105 -12.671 -21.471 -15.169 1236 HB2 LYS 105 2HB LYS 105 -15.594 -21.952 -14.417 1237 HB3 LYS 105 3HB LYS 105 -14.728 -20.411 -14.544 1238 HG2 LYS 105 2HG LYS 105 -14.283 -21.103 -17.004 1239 HG3 LYS 105 3HG LYS 105 -15.566 -22.292 -16.775 1240 HD2 LYS 105 2HD LYS 105 -17.155 -20.476 -16.225 1241 HD3 LYS 105 3HD LYS 105 -15.850 -19.276 -16.386 1242 HE2 LYS 105 2HE LYS 105 -15.482 -19.997 -18.737 1243 HE3 LYS 105 3HE LYS 105 -16.804 -21.164 -18.587 1244 HZ1 LYS 105 3HZ LYS 105 -17.062 -18.238 -18.313 1245 HZ2 LYS 105 1HZ LYS 105 -18.297 -19.318 -18.170 1246 HZ3 LYS 105 2HZ LYS 105 -17.535 -19.123 -19.619 1247 H PHE 106 HN PHE 106 -11.990 -20.646 -13.285 1248 HA PHE 106 HA PHE 106 -12.636 -22.201 -10.796 1249 HD1 PHE 106 1HD PHE 106 -10.708 -24.131 -9.887 1250 HD2 PHE 106 2HD PHE 106 -9.746 -22.204 -13.619 1251 HE1 PHE 106 1HE PHE 106 -10.479 -26.349 -10.980 1252 HE2 PHE 106 2HE PHE 106 -9.579 -24.409 -14.726 1253 HZ PHE 106 HZ PHE 106 -9.970 -26.488 -13.410 1254 HB2 PHE 106 2HB PHE 106 -9.988 -20.890 -11.580 1255 HB3 PHE 106 3HB PHE 106 -10.336 -21.657 -10.032 1256 H ALA 107 HN ALA 107 -12.340 -20.946 -8.775 1257 HA ALA 107 HA ALA 107 -13.461 -18.234 -9.195 1258 HB1 ALA 107 1HB ALA 107 -13.301 -20.051 -6.735 1259 HB2 ALA 107 2HB ALA 107 -14.003 -18.423 -6.730 1260 HB3 ALA 107 3HB ALA 107 -14.752 -19.687 -7.697 1261 H ARG 108 HN ARG 108 -10.433 -19.665 -8.677 1262 HA ARG 108 HA ARG 108 -9.406 -17.090 -7.578 1263 HE ARG 108 HE ARG 108 -7.378 -20.014 -4.845 1264 HB2 ARG 108 2HB ARG 108 -8.197 -19.752 -6.789 1265 HB3 ARG 108 3HB ARG 108 -7.964 -18.142 -6.085 1266 HG2 ARG 108 2HG ARG 108 -10.503 -18.306 -5.455 1267 HG3 ARG 108 3HG ARG 108 -10.307 -20.033 -5.758 1268 HD2 ARG 108 2HD ARG 108 -9.041 -18.290 -3.655 1269 HD3 ARG 108 3HD ARG 108 -9.991 -19.779 -3.449 1270 HH11 ARG 108 2HH2 ARG 108 -8.942 -20.037 -1.720 1271 HH12 ARG 108 1HH2 ARG 108 -7.701 -21.035 -0.997 1272 HH21 ARG 108 1HH1 ARG 108 -5.733 -21.124 -3.861 1273 HH22 ARG 108 2HH1 ARG 108 -5.932 -21.628 -2.190 1274 H SER 109 HN SER 109 -7.470 -16.394 -8.383 1275 HA SER 109 HA SER 109 -6.771 -17.169 -11.011 1276 HG SER 109 HG SER 109 -5.687 -14.539 -8.407 1277 HB2 SER 109 2HB SER 109 -4.662 -15.772 -10.498 1278 HB3 SER 109 3HB SER 109 -6.212 -14.953 -10.340 1279 H ASP 110 HN ASP 110 -5.377 -18.068 -7.835 1280 HA ASP 110 HA ASP 110 -3.091 -19.472 -8.960 1281 HB2 ASP 110 2HB ASP 110 -2.698 -20.238 -6.737 1282 HB3 ASP 110 3HB ASP 110 -3.105 -18.529 -6.674 1283 H GLU 111 HN GLU 111 -6.457 -20.337 -8.061 1284 HA GLU 111 HA GLU 111 -6.173 -23.202 -8.225 1285 HB2 GLU 111 2HB GLU 111 -8.515 -21.288 -8.526 1286 HB3 GLU 111 3HB GLU 111 -8.668 -22.970 -8.994 1287 HG2 GLU 111 2HG GLU 111 -8.019 -23.695 -6.739 1288 HG3 GLU 111 3HG GLU 111 -7.971 -22.011 -6.213 1289 H LEU 112 HN LEU 112 -6.919 -20.642 -10.655 1290 HA LEU 112 HA LEU 112 -7.135 -22.463 -12.876 1291 HG LEU 112 HG LEU 112 -5.715 -20.583 -14.947 1292 HB2 LEU 112 2HB LEU 112 -8.006 -20.199 -12.973 1293 HB3 LEU 112 3HB LEU 112 -6.386 -19.508 -12.797 1294 HD11 LEU 112 1HD1 LEU 112 -7.297 -21.581 -16.439 1295 HD12 LEU 112 2HD1 LEU 112 -8.664 -21.230 -15.381 1296 HD13 LEU 112 3HD1 LEU 112 -7.453 -22.452 -14.939 1297 HD21 LEU 112 3HD2 LEU 112 -6.856 -19.098 -16.442 1298 HD22 LEU 112 1HD2 LEU 112 -6.551 -18.255 -14.913 1299 HD23 LEU 112 2HD2 LEU 112 -8.183 -18.864 -15.300 1300 H VAL 113 HN VAL 113 -4.342 -20.620 -11.482 1301 HA VAL 113 HA VAL 113 -2.366 -21.396 -13.382 1302 HB VAL 113 HB VAL 113 -2.115 -20.924 -10.375 1303 HG11 VAL 113 1HG1 VAL 113 -0.152 -22.194 -11.040 1304 HG12 VAL 113 2HG1 VAL 113 0.091 -21.143 -12.451 1305 HG13 VAL 113 3HG1 VAL 113 0.301 -20.509 -10.807 1306 HG21 VAL 113 3HG2 VAL 113 -1.404 -18.716 -10.851 1307 HG22 VAL 113 1HG2 VAL 113 -1.223 -19.060 -12.583 1308 HG23 VAL 113 2HG2 VAL 113 -2.823 -18.942 -11.887 1309 H ARG 114 HN ARG 114 -3.333 -23.021 -10.316 1310 HA ARG 114 HA ARG 114 -1.695 -25.316 -10.594 1311 HE ARG 114 HE ARG 114 -2.158 -26.039 -6.770 1312 HB2 ARG 114 2HB ARG 114 -2.945 -24.742 -8.545 1313 HB3 ARG 114 3HB ARG 114 -4.480 -25.106 -9.340 1314 HG2 ARG 114 2HG ARG 114 -3.825 -27.461 -9.628 1315 HG3 ARG 114 3HG ARG 114 -2.222 -27.135 -8.959 1316 HD2 ARG 114 2HD ARG 114 -4.833 -26.734 -7.440 1317 HD3 ARG 114 3HD ARG 114 -3.866 -28.220 -7.388 1318 HH11 ARG 114 1HH1 ARG 114 -4.871 -27.731 -5.274 1319 HH12 ARG 114 2HH1 ARG 114 -4.266 -27.476 -3.667 1320 HH21 ARG 114 1HH2 ARG 114 -1.479 -25.653 -4.650 1321 HH22 ARG 114 2HH2 ARG 114 -2.522 -26.221 -3.343 1322 H HIS 115 HN HIS 115 -5.123 -24.852 -11.668 1323 HA HIS 115 HA HIS 115 -5.479 -27.320 -12.933 1324 HD1 HIS 115 1HD HIS 115 -8.003 -27.917 -14.704 1325 HD2 HIS 115 2HD HIS 115 -6.546 -24.197 -16.036 1326 HE1 HIS 115 1HE HIS 115 -8.478 -27.747 -17.248 1327 HB2 HIS 115 2HB HIS 115 -7.364 -25.962 -12.752 1328 HB3 HIS 115 3HB HIS 115 -6.570 -24.551 -13.431 1329 H HIS 116 HN HIS 116 -4.067 -24.313 -14.354 1330 HA HIS 116 HA HIS 116 -3.580 -25.319 -16.960 1331 HD1 HIS 116 1HD HIS 116 -5.063 -23.706 -17.819 1332 HD2 HIS 116 2HD HIS 116 -2.517 -20.737 -16.188 1333 HE1 HIS 116 1HE HIS 116 -5.976 -21.497 -18.519 1334 HB2 HIS 116 2HB HIS 116 -2.118 -23.252 -15.275 1335 HB3 HIS 116 3HB HIS 116 -1.653 -23.636 -16.919 1336 H ASN 117 HN ASN 117 -1.821 -25.843 -13.895 1337 HA ASN 117 HA ASN 117 0.597 -26.920 -15.086 1338 HB2 ASN 117 2HB ASN 117 0.060 -26.094 -12.622 1339 HB3 ASN 117 3HB ASN 117 -0.427 -27.768 -12.360 1340 HD21 ASN 117 1HD2 ASN 117 1.575 -29.135 -13.933 1341 HD22 ASN 117 2HD2 ASN 117 3.116 -28.749 -13.122 1342 H MET 118 HN MET 118 -2.645 -28.145 -14.807 1343 HA MET 118 HA MET 118 -1.845 -31.001 -14.963 1344 HB2 MET 118 2HB MET 118 -4.627 -29.814 -15.318 1345 HB3 MET 118 3HB MET 118 -4.205 -31.474 -14.947 1346 HG2 MET 118 2HG MET 118 -3.398 -30.815 -12.720 1347 HG3 MET 118 3HG MET 118 -3.753 -29.120 -13.077 1348 HE1 MET 118 3HE MET 118 -6.472 -29.867 -10.419 1349 HE2 MET 118 1HE MET 118 -4.782 -30.425 -10.461 1350 HE3 MET 118 2HE MET 118 -5.186 -28.761 -10.952 1351 H HIS 119 HN HIS 119 -1.796 -28.456 -17.107 1352 HA HIS 119 HA HIS 119 -2.645 -30.135 -19.442 1353 HD1 HIS 119 1HD HIS 119 -4.921 -29.804 -20.260 1354 HD2 HIS 119 2HD HIS 119 -4.603 -25.840 -18.864 1355 HE1 HIS 119 1HE HIS 119 -7.305 -28.841 -20.144 1356 HB2 HIS 119 2HB HIS 119 -2.321 -27.116 -19.153 1357 HB3 HIS 119 3HB HIS 119 -2.539 -27.948 -20.679 Start of MODEL 19 1 H5 DC 124 5H C 124 -3.965 -31.285 -5.034 2 H6 DC 124 6H C 124 -5.894 -31.001 -6.514 3 H5' DC 124 H5' C 124 -8.892 -32.450 -9.847 4 H5'' DC 124 H5" C 124 -7.450 -32.322 -8.795 5 H4' DC 124 H4' C 124 -10.330 -32.508 -7.784 6 H3' DC 124 H3' C 124 -9.147 -30.269 -8.945 7 H2' DC 124 H2' C 124 -7.441 -30.011 -7.420 8 H2'' DC 124 H2" C 124 -8.673 -29.058 -6.555 9 H1' DC 124 H1' C 124 -9.405 -30.905 -5.244 10 H41 DC 124 1H4 C 124 -4.457 -32.259 -1.533 11 H42 DC 124 2H4 C 124 -3.313 -31.943 -2.822 12 H8 DG 125 8H G 125 -9.146 -26.934 -5.719 13 H1 DG 125 1H G 125 -6.460 -28.889 -0.217 14 H5' DG 125 H5' G 125 -12.941 -29.653 -6.353 15 H5'' DG 125 H5" G 125 -13.973 -28.302 -6.877 16 H4' DG 125 H4' G 125 -13.886 -28.532 -4.395 17 H3' DG 125 H3' G 125 -13.424 -26.068 -5.709 18 H2' DG 125 H2' G 125 -11.155 -25.972 -5.312 19 H2'' DG 125 H2" G 125 -11.644 -25.314 -3.722 20 H1' DG 125 H1' G 125 -11.564 -27.464 -2.693 21 H21 DG 125 1H2 G 125 -7.981 -29.264 1.273 22 H22 DG 125 2H2 G 125 -9.693 -29.109 0.909 23 H5 DC 126 5H C 126 -8.005 -23.810 -4.283 24 H6 DC 126 6H C 126 -10.005 -23.534 -2.923 25 H5' DC 126 H5' C 126 -13.528 -26.171 -1.200 26 H5'' DC 126 H5" C 126 -14.615 -24.949 -0.487 27 H4' DC 126 H4' C 126 -12.683 -25.119 0.903 28 H3' DC 126 H3' C 126 -13.258 -22.622 -0.285 29 H2' DC 126 H2' C 126 -11.407 -22.788 -1.736 30 H2'' DC 126 H2" C 126 -10.626 -21.940 -0.359 31 H1' DC 126 H1' C 126 -10.014 -24.111 0.723 32 H41 DC 126 1H4 C 126 -4.992 -25.399 -2.930 33 H42 DC 126 2H4 C 126 -5.841 -24.877 -4.368 34 H8 DG 127 8H G 127 -9.641 -21.616 1.765 35 H1 DG 127 1H G 127 -3.448 -22.744 0.606 36 H5' DG 127 H5' G 127 -11.928 -23.709 3.758 37 H5'' DG 127 H5" G 127 -12.573 -22.727 5.075 38 H4' DG 127 H4' G 127 -10.555 -23.749 5.842 39 H3' DG 127 H3' G 127 -10.843 -20.994 5.834 40 H2' DG 127 H2' G 127 -9.496 -20.573 3.921 41 H2'' DG 127 H2" G 127 -8.208 -20.541 5.179 42 H1' DG 127 H1' G 127 -7.603 -22.889 4.810 43 H21 DG 127 1H2 G 127 -2.404 -22.994 2.460 44 H22 DG 127 2H2 G 127 -3.247 -23.054 3.995 45 H8 DG 128 8H G 128 -7.461 -18.641 4.232 46 H1 DG 128 1H G 128 -2.761 -19.830 0.066 47 H5' DG 128 H5' G 128 -6.613 -21.937 7.823 48 H5'' DG 128 H5" G 128 -6.534 -20.906 9.262 49 H4' DG 128 H4' G 128 -4.441 -20.643 8.044 50 H3' DG 128 H3' G 128 -6.218 -18.430 8.505 51 H2' DG 128 H2' G 128 -6.616 -17.930 6.270 52 H2'' DG 128 H2" G 128 -5.038 -17.087 6.407 53 H1' DG 128 H1' G 128 -3.863 -19.070 5.769 54 H21 DG 128 1H2 G 128 -0.806 -20.093 1.155 55 H22 DG 128 2H2 G 128 -0.758 -20.138 2.904 56 H8 DG 129 8H G 129 -3.436 -16.245 5.562 57 H1 DG 129 1H G 129 -0.962 -16.414 -0.328 58 H5' DG 129 H5' G 129 -1.743 -18.358 8.558 59 H5'' DG 129 H5" G 129 -0.989 -17.519 9.887 60 H4' DG 129 H4' G 129 0.592 -17.368 8.113 61 H3' DG 129 H3' G 129 -0.704 -14.891 8.794 62 H2' DG 129 H2' G 129 -1.921 -14.817 6.840 63 H2'' DG 129 H2" G 129 -0.471 -13.999 6.220 64 H1' DG 129 H1' G 129 0.444 -16.098 5.383 65 H21 DG 129 1H2 G 129 1.196 -16.449 -0.264 66 H22 DG 129 2H2 G 129 2.081 -16.410 1.251 67 H8 DG 130 8H G 130 0.609 -13.445 4.250 68 H1 DG 130 1H G 130 -0.604 -12.912 -1.994 69 H5' DG 130 H5' G 130 3.011 -15.472 5.697 70 H5'' DG 130 H5" G 130 4.117 -14.513 6.683 71 H4' DG 130 H4' G 130 5.114 -14.477 4.558 72 H3' DG 130 H3' G 130 4.103 -12.087 5.753 73 H2' DG 130 H2' G 130 2.405 -11.604 4.294 74 H2'' DG 130 H2" G 130 3.664 -10.997 3.204 75 H1' DG 130 H1' G 130 3.679 -12.923 1.915 76 H21 DG 130 1H2 G 130 1.196 -12.398 -3.068 77 H22 DG 130 2H2 G 130 2.721 -12.117 -2.238 78 H8 DG 131 8H G 131 2.628 -9.324 2.374 79 H1 DG 131 1H G 131 -1.909 -9.383 -2.128 80 H5' DG 131 H5' G 131 5.715 -11.711 1.773 81 H5'' DG 131 H5" G 131 7.290 -10.923 1.861 82 H4' DG 131 H4' G 131 6.666 -10.342 -0.279 83 H3' DG 131 H3' G 131 6.611 -8.192 1.483 84 H2' DG 131 H2' G 131 4.316 -8.167 1.728 85 H2'' DG 131 H2" G 131 4.432 -7.042 0.371 86 H1' DG 131 H1' G 131 3.897 -8.768 -1.257 87 H21 DG 131 1H2 G 131 -1.054 -9.024 -4.091 88 H22 DG 131 2H2 G 131 0.673 -8.787 -4.322 89 H5 DC 132 5H C 132 1.314 -6.502 1.590 90 H6 DC 132 6H C 132 2.802 -5.840 -0.246 91 H5' DC 132 H5' C 132 5.264 -7.632 -2.925 92 H5'' DC 132 H5" C 132 6.284 -6.317 -3.555 93 H4' DC 132 H4' C 132 4.187 -6.100 -4.649 94 H3' DC 132 H3' C 132 5.199 -4.045 -2.909 95 H2' DC 132 H2' C 132 3.423 -4.140 -1.439 96 H2'' DC 132 H2" C 132 2.626 -3.140 -2.654 97 H1' DC 132 H1' C 132 1.520 -5.054 -3.680 98 H41 DC 132 1H4 C 132 -2.335 -6.584 1.092 99 H42 DC 132 2H4 C 132 -1.001 -6.926 2.172 100 H8 DG 133 8H G 133 1.220 -1.840 -3.160 101 H1 DG 133 1H G 133 -4.903 -2.747 -1.478 102 H5' DG 133 H5' G 133 2.723 -3.331 -6.682 103 H5'' DG 133 H5" G 133 3.347 -1.917 -7.571 104 H4' DG 133 H4' G 133 0.990 -2.104 -8.039 105 H3' DG 133 H3' G 133 2.054 0.226 -6.895 106 H2' DG 133 H2' G 133 1.184 -0.208 -4.764 107 H2'' DG 133 H2" G 133 -0.154 0.748 -5.373 108 H1' DG 133 H1' G 133 -1.426 -1.249 -5.963 109 H21 DG 133 1H2 G 133 -6.216 -2.335 -3.154 110 H22 DG 133 2H2 G 133 -5.601 -1.819 -4.710 111 H5' DT 134 H5' T 134 -2.448 -0.176 -7.287 112 H5'' DT 134 H5" T 134 -2.849 1.032 -8.513 113 H4' DT 134 H4' T 134 -4.746 1.052 -7.083 114 H3' DT 134 H3' T 134 -3.021 3.349 -7.238 115 H2' DT 134 H2' T 134 -2.335 3.190 -5.045 116 H2'' DT 134 H2" T 134 -3.834 4.079 -4.760 117 H1' DT 134 H1' T 134 -5.100 1.991 -4.278 118 H3 DT 134 3H T 134 -4.119 0.456 -0.086 119 H71 DT 134 1H7 T 134 0.510 2.142 -2.216 120 H72 DT 134 2H7 T 134 0.392 1.387 -0.610 121 H73 DT 134 3H7 T 134 0.537 0.373 -2.060 122 H6 DT 134 6H T 134 -1.399 1.869 -3.798 123 H5 DC 135 5H C 135 -3.709 4.908 -2.668 124 H6 DC 135 6H C 135 -5.541 5.378 -4.204 125 H5' DC 135 H5' C 135 -7.532 3.590 -7.470 126 H5'' DC 135 H5" C 135 -8.398 4.962 -8.190 127 H4' DC 135 H4' C 135 -9.616 4.214 -6.221 128 H3' DC 135 H3' C 135 -8.692 6.892 -6.470 129 H2' DC 135 H2' C 135 -7.052 6.598 -4.839 130 H2'' DC 135 H2" C 135 -8.361 7.151 -3.797 131 H1' DC 135 H1' C 135 -9.092 4.828 -3.319 132 H41 DC 135 1H4 C 135 -4.278 3.304 0.547 133 H42 DC 135 2H4 C 135 -3.136 4.040 -0.541 134 H5' DT 136 H5' T 136 -10.903 5.237 -2.530 135 H5'' DT 136 H5" T 136 -12.429 6.019 -2.986 136 H4' DT 136 H4' T 136 -12.577 6.027 -0.691 137 H3' DT 136 H3' T 136 -12.318 8.552 -1.837 138 H2' DT 136 H2' T 136 -10.171 8.992 -1.327 139 H2'' DT 136 H2" T 136 -10.741 9.483 0.229 140 H1' DT 136 H1' T 136 -10.272 7.477 1.332 141 H3 DT 136 3H T 136 -5.895 6.608 1.836 142 H71 DT 136 1H7 T 136 -5.394 7.525 -2.866 143 H72 DT 136 2H7 T 136 -6.630 8.783 -3.087 144 H73 DT 136 3H7 T 136 -5.156 9.134 -2.151 145 H6 DT 136 6H T 136 -8.545 8.115 -1.885 146 H8 DG 137 8H G 137 -9.718 10.391 1.773 147 H1 DG 137 1H G 137 -3.795 9.355 4.025 148 H5' DG 137 H5' G 137 -12.067 7.530 2.435 149 H5'' DG 137 H5" G 137 -13.610 8.143 3.026 150 H4' DG 137 H4' G 137 -12.433 7.936 4.976 151 H3' DG 137 H3' G 137 -13.065 10.534 4.256 152 H2' DG 137 H2' G 137 -11.011 11.045 3.369 153 H2'' DG 137 H2" G 137 -10.692 11.602 4.986 154 H1' DG 137 H1' G 137 -9.472 9.635 5.583 155 H21 DG 137 1H2 G 137 -3.830 8.858 6.132 156 H22 DG 137 2H2 G 137 -5.329 8.863 7.048 157 H5 DC 138 5H C 138 -8.629 13.135 4.069 158 H6 DC 138 6H C 138 -9.220 12.356 6.308 159 H5' DC 138 H5' C 138 -10.494 9.208 7.670 160 H5'' DC 138 H5" C 138 -11.408 9.830 9.061 161 H4' DC 138 H4' C 138 -9.185 9.531 9.819 162 H3' DC 138 H3' C 138 -10.421 12.038 9.918 163 H2' DC 138 H2' C 138 -9.236 13.066 8.269 164 H2'' DC 138 H2" C 138 -8.062 13.368 9.517 165 H1' DC 138 H1' C 138 -6.666 11.563 8.899 166 H41 DC 138 1H4 C 138 -5.126 13.245 2.998 167 H42 DC 138 2H4 C 138 -6.808 13.368 2.528 168 H8 DG 139 8H G 139 -6.458 14.558 9.619 169 H1 DG 139 1H G 139 -2.191 15.878 5.038 170 H5' DG 139 H5' G 139 -6.239 11.112 11.188 171 H5'' DG 139 H5" G 139 -6.293 11.393 12.928 172 H4' DG 139 H4' G 139 -4.019 11.476 12.388 173 H3' DG 139 H3' G 139 -5.219 13.742 13.497 174 H2' DG 139 H2' G 139 -5.386 14.942 11.542 175 H2'' DG 139 H2" G 139 -3.773 15.491 11.950 176 H1' DG 139 H1' G 139 -2.719 13.960 10.502 177 H21 DG 139 1H2 G 139 -0.184 15.365 5.690 178 H22 DG 139 2H2 G 139 0.141 14.824 7.331 179 H5 DC 140 5H C 140 -4.210 17.701 10.574 180 H6 DC 140 6H C 140 -2.178 16.878 11.661 181 H5' DC 140 H5' C 140 -0.808 13.390 12.103 182 H5'' DC 140 H5" C 140 0.099 13.731 13.585 183 H4' DC 140 H4' C 140 1.539 14.172 11.686 184 H3' DC 140 H3' C 140 1.125 15.997 13.729 185 H2' DC 140 H2' C 140 -0.359 17.430 12.639 186 H2'' DC 140 H2" C 140 1.153 18.197 12.082 187 H1' DC 140 H1' C 140 1.178 17.038 10.033 188 H41 DC 140 1H4 C 140 -4.119 18.904 7.113 189 H42 DC 140 2H4 C 140 -5.107 18.473 8.494 190 H8 DG 141 8H G 141 -3.466 21.641 0.879 191 H1 DG 141 1H G 141 -1.708 18.659 6.285 192 H5' DG 141 H5' G 141 -0.852 24.545 -0.712 193 H5'' DG 141 H5" G 141 -1.079 23.826 -2.312 194 H4' DG 141 H4' G 141 0.841 22.888 -1.029 195 H3' DG 141 H3' G 141 -0.962 21.409 -2.540 196 H2' DG 141 H2' G 141 -2.222 20.651 -0.766 197 H2'' DG 141 H2" G 141 -1.045 19.336 -0.759 198 H1' DG 141 H1' G 141 0.209 20.309 1.005 199 H21 DG 141 1H2 G 141 0.444 18.301 6.303 200 H22 DG 141 2H2 G 141 1.444 18.629 4.896 201 H5 DC 142 5H C 142 -2.712 17.722 0.413 202 H6 DC 142 6H C 142 -0.346 17.321 -0.025 203 H5' DC 142 H5' C 142 2.029 19.659 0.390 204 H5'' DC 142 H5" C 142 3.219 19.260 -0.842 205 H4' DC 142 H4' C 142 3.920 18.029 0.916 206 H3' DC 142 H3' C 142 3.120 16.560 -1.279 207 H2' DC 142 H2' C 142 1.034 15.925 -0.535 208 H2'' DC 142 H2" C 142 1.898 14.603 0.177 209 H1' DC 142 H1' C 142 1.882 15.521 2.359 210 H41 DC 142 1H4 C 142 -4.206 16.836 3.628 211 H42 DC 142 2H4 C 142 -4.409 17.644 2.087 212 H8 DG 143 8H G 143 1.483 13.010 1.311 213 H1 DG 143 1H G 143 -3.773 12.452 4.965 214 H5' DG 143 H5' G 143 4.219 15.357 3.259 215 H5'' DG 143 H5" G 143 5.667 14.420 2.849 216 H4' DG 143 H4' G 143 4.845 13.540 4.909 217 H3' DG 143 H3' G 143 5.238 11.945 2.661 218 H2' DG 143 H2' G 143 3.049 11.754 2.026 219 H2'' DG 143 H2" G 143 3.009 10.403 3.128 220 H1' DG 143 H1' G 143 2.049 11.653 4.883 221 H21 DG 143 1H2 G 143 -3.239 11.737 6.965 222 H22 DG 143 2H2 G 143 -1.571 11.399 7.406 223 H5 DC 144 5H C 144 0.751 9.489 1.960 224 H6 DC 144 6H C 144 1.768 8.720 4.041 225 H5' DC 144 H5' C 144 3.156 10.934 6.311 226 H5'' DC 144 H5" C 144 4.396 9.957 7.051 227 H4' DC 144 H4' C 144 2.557 9.536 8.346 228 H3' DC 144 H3' C 144 3.727 7.413 6.978 229 H2' DC 144 H2' C 144 2.164 7.155 5.326 230 H2'' DC 144 H2" C 144 1.328 6.173 6.501 231 H1' DC 144 H1' C 144 -0.223 7.854 7.085 232 H41 DC 144 1H4 C 144 -2.897 9.906 1.670 233 H42 DC 144 2H4 C 144 -1.329 10.149 0.922 234 H8 DA 145 8H A 145 -0.273 4.989 6.001 235 H2 DA 145 2H A 145 -6.361 6.209 4.410 236 H5' DA 145 H5' A 145 0.027 7.200 9.667 237 H5'' DA 145 H5" A 145 0.154 5.835 10.786 238 H4' DA 145 H4' A 145 -2.163 6.294 10.358 239 H3' DA 145 H3' A 145 -1.054 3.789 10.128 240 H2' DA 145 H2' A 145 -0.916 3.880 7.792 241 H2'' DA 145 H2" A 145 -2.472 3.069 7.949 242 H1' DA 145 H1' A 145 -3.705 5.133 7.797 243 H61 DA 145 2H6 A 145 -1.958 5.973 1.604 244 H62 DA 145 1H6 A 145 -3.539 6.420 0.981 245 H8 DG 146 8H G 146 -3.856 1.635 7.276 246 H1 DG 146 1H G 146 -5.875 3.240 1.407 247 H5' DG 146 H5' G 146 -5.284 4.665 9.919 248 H5'' DG 146 H5" G 146 -6.479 4.422 11.147 249 H4' DG 146 H4' G 146 -7.835 3.985 9.465 250 H3' DG 146 H3' G 146 -6.899 1.500 10.474 251 H2' DG 146 H2' G 146 -5.617 0.936 8.574 252 H2'' DG 146 H2" G 146 -7.182 0.378 7.959 253 H1' DG 146 H1' G 146 -7.658 2.435 6.891 254 H21 DG 146 1H2 G 146 -7.979 3.715 1.462 255 H22 DG 146 2H2 G 146 -8.857 3.861 2.961 256 H8 DA 147 8H A 147 -6.911 -1.235 6.485 257 H2 DA 147 2H A 147 -6.606 0.431 0.306 258 H5' DA 147 H5' A 147 -10.182 1.877 7.476 259 H5'' DA 147 H5" A 147 -11.547 0.792 7.775 260 H4' DA 147 H4' A 147 -11.258 1.126 5.397 261 H3' DA 147 H3' A 147 -11.373 -1.411 6.613 262 H2' DA 147 H2' A 147 -9.102 -1.908 6.269 263 H2'' DA 147 H2" A 147 -9.753 -2.536 4.714 264 H1' DA 147 H1' A 147 -9.430 -0.429 3.624 265 H61 DA 147 2H6 A 147 -2.864 -0.753 3.777 266 H62 DA 147 1H6 A 147 -2.600 -0.242 2.113 267 H5 DC 148 5H C 148 -7.123 -3.497 3.350 268 H6 DC 148 6H C 148 -9.387 -3.440 2.430 269 H5' DC 148 H5' C 148 -12.286 -0.785 1.926 270 H5'' DC 148 H5" C 148 -13.747 -1.768 1.722 271 H4' DC 148 H4' C 148 -12.692 -1.684 -0.390 272 H3' DC 148 H3' C 148 -13.148 -4.168 0.833 273 H2' DC 148 H2' C 148 -10.912 -4.474 1.470 274 H2'' DC 148 H2" C 148 -10.829 -5.280 -0.099 275 H1' DC 148 H1' C 148 -10.061 -3.281 -1.237 276 H41 DC 148 1H4 C 148 -4.184 -3.194 1.153 277 H42 DC 148 2H4 C 148 -4.771 -3.433 2.792 278 H8 DG 149 8H G 149 -9.259 -6.948 -1.060 279 H1 DG 149 1H G 149 -2.906 -5.894 -1.111 280 H5' DG 149 H5' G 149 -10.880 -3.525 -3.134 281 H5'' DG 149 H5" G 149 -12.119 -4.238 -4.171 282 H4' DG 149 H4' G 149 -10.160 -4.475 -5.414 283 H3' DG 149 H3' G 149 -11.574 -6.718 -4.558 284 H2' DG 149 H2' G 149 -10.085 -7.359 -2.946 285 H2'' DG 149 H2" G 149 -9.302 -8.235 -4.233 286 H1' DG 149 H1' G 149 -7.667 -6.476 -4.558 287 H21 DG 149 1H2 G 149 -2.218 -5.549 -3.143 288 H22 DG 149 2H2 G 149 -3.339 -5.410 -4.483 289 H5 DC 150 5H C 150 -6.977 -9.607 -1.653 290 H6 DC 150 6H C 150 -7.167 -9.812 -4.068 291 H5' DC 150 H5' C 150 -8.167 -8.979 -5.722 292 H5'' DC 150 H5" C 150 -8.012 -7.349 -6.420 293 H4' DC 150 H4' C 150 -6.679 -8.254 -8.237 294 H3' DC 150 H3' C 150 -7.788 -10.734 -7.703 295 H2' DC 150 H2' C 150 -6.781 -11.123 -5.676 296 H2'' DC 150 H2" C 150 -5.473 -11.699 -6.656 297 H1' DC 150 H1' C 150 -4.149 -9.777 -6.330 298 H41 DC 150 1H4 C 150 -3.712 -9.422 -0.055 299 H42 DC 150 2H4 C 150 -5.451 -9.564 0.174 300 H5 DC 151 5H C 151 -5.105 -12.846 -4.318 301 H6 DC 151 6H C 151 -3.917 -12.814 -6.456 302 H5' DC 151 H5' C 151 -3.489 -10.155 -9.004 303 H5'' DC 151 H5" C 151 -3.262 -11.056 -10.518 304 H4' DC 151 H4' C 151 -1.103 -10.885 -9.486 305 H3' DC 151 H3' C 151 -2.235 -13.417 -10.068 306 H2' DC 151 H2' C 151 -2.787 -13.854 -7.840 307 H2'' DC 151 H2" C 151 -1.217 -14.545 -7.792 308 H1' DC 151 H1' C 151 -0.218 -12.493 -6.744 309 H41 DC 151 1H4 C 151 -3.234 -12.893 -1.162 310 H42 DC 151 2H4 C 151 -4.801 -12.783 -1.931 311 H5 DC 152 5H C 152 -3.166 -15.770 -5.060 312 H6 DC 152 6H C 152 -0.950 -15.817 -6.122 313 H5' DC 152 H5' C 152 1.694 -13.240 -7.447 314 H5'' DC 152 H5" C 152 2.851 -14.070 -8.483 315 H4' DC 152 H4' C 152 3.537 -14.637 -6.358 316 H3' DC 152 H3' C 152 2.553 -16.707 -8.028 317 H2' DC 152 H2' C 152 0.673 -17.139 -6.743 318 H2'' DC 152 H2" C 152 1.781 -18.175 -5.819 319 H1' DC 152 H1' C 152 2.213 -16.461 -4.179 320 H41 DC 152 1H4 C 152 -3.507 -16.314 -1.424 321 H42 DC 152 2H4 C 152 -4.327 -16.118 -2.964 322 H5 DC 153 5H C 153 -1.341 -19.574 -4.640 323 H6 DC 153 6H C 153 1.073 -19.920 -4.453 324 H5' DC 153 H5' C 153 4.608 -17.577 -4.075 325 H5'' DC 153 H5" C 153 5.897 -18.739 -4.455 326 H4' DC 153 H4' C 153 5.215 -19.242 -2.294 327 H3' DC 153 H3' C 153 4.871 -21.184 -4.328 328 H2' DC 153 H2' C 153 2.624 -21.204 -4.194 329 H2'' DC 153 H2" C 153 2.885 -22.319 -2.856 330 H1' DC 153 H1' C 153 2.738 -20.586 -1.178 331 H41 DC 153 1H4 C 153 -3.407 -19.072 -1.652 332 H42 DC 153 2H4 C 153 -3.306 -18.965 -3.398 333 H5 DC 154 5H C 154 -0.162 -22.934 -3.147 334 H6 DC 154 6H C 154 1.699 -23.496 -1.616 335 H5' DC 154 H5' C 154 4.522 -21.688 0.098 336 H5'' DC 154 H5" C 154 5.717 -22.923 0.552 337 H4' DC 154 H4' C 154 4.019 -23.018 2.216 338 H3' DC 154 H3' C 154 4.420 -25.330 0.547 339 H2' DC 154 H2' C 154 2.285 -25.531 -0.269 340 H2'' DC 154 H2" C 154 1.859 -26.107 1.379 341 H1' DC 154 H1' C 154 1.139 -24.053 2.078 342 H41 DC 154 1H4 C 154 -3.643 -22.744 -1.862 343 H42 DC 154 2H4 C 154 -2.599 -22.692 -3.268 344 H8 DG 155 8H G 155 0.506 -27.664 0.905 345 H1 DG 155 1H G 155 -5.537 -25.901 -0.336 346 H5' DG 155 H5' G 155 2.234 -25.505 4.499 347 H5'' DG 155 H5" G 155 2.794 -26.832 5.545 348 H4' DG 155 H4' G 155 0.415 -26.537 5.888 349 H3' DG 155 H3' G 155 1.422 -29.017 5.055 350 H2' DG 155 H2' G 155 0.524 -28.953 2.891 351 H2'' DG 155 H2" G 155 -0.886 -29.647 3.751 352 H1' DG 155 H1' G 155 -1.906 -27.487 4.019 353 H21 DG 155 1H2 G 155 -6.710 -25.858 1.444 354 H22 DG 155 2H2 G 155 -6.013 -26.195 3.021 355 H5 DC 156 5H C 156 -1.598 -30.608 1.132 356 H6 DC 156 6H C 156 -2.482 -30.916 3.393 357 H5' DC 156 H5' C 156 -2.696 -28.703 6.813 358 H5'' DC 156 H5" C 156 -2.987 -29.915 8.071 359 H4' DC 156 H4' C 156 -5.067 -29.435 6.994 360 H3' DC 156 H3' C 156 -3.975 -32.070 6.990 361 H2' DC 156 H2' C 156 -3.681 -32.185 4.681 362 H2'' DC 156 H2" C 156 -5.433 -32.502 4.722 363 H1' DC 156 H1' C 156 -6.054 -30.294 4.265 364 H41 DC 156 1H4 C 156 -3.765 -29.358 -1.553 365 H42 DC 156 2H4 C 156 -2.141 -29.789 -1.068 366 H8 DG 157 8H G 157 -6.403 -34.770 4.711 367 H1 DG 157 1H G 157 -6.892 -32.249 -1.184 368 H5' DG 157 H5' G 157 -8.760 -31.510 7.302 369 H5'' DG 157 H5" G 157 -9.561 -32.726 8.321 370 H4' DG 157 H4' G 157 -10.837 -32.352 6.232 371 H3' DG 157 H3' G 157 -10.164 -34.898 7.125 372 H2' DG 157 H2' G 157 -8.306 -35.186 5.701 373 H2'' DG 157 H2" G 157 -9.580 -35.881 4.648 374 H1' DG 157 H1' G 157 -9.952 -33.799 3.532 375 H21 DG 157 1H2 G 157 -9.008 -31.841 -1.621 376 H22 DG 157 2H2 G 157 -10.248 -32.021 -0.396 377 HA ALA 1 HA ALA 1 7.117 -0.802 -26.268 378 H1 ALA 1 HN ALA 1 8.455 -2.311 -25.147 379 HB1 ALA 1 1HB ALA 1 6.896 0.356 -23.450 380 HB2 ALA 1 2HB ALA 1 5.758 0.637 -24.786 381 HB3 ALA 1 3HB ALA 1 5.935 -0.990 -24.099 382 H SER 2 HN SER 2 9.795 0.522 -24.421 383 HA SER 2 HA SER 2 10.412 2.443 -26.497 384 HG SER 2 HG SER 2 8.169 3.151 -26.159 385 HB2 SER 2 2HB SER 2 9.195 3.463 -23.899 386 HB3 SER 2 3HB SER 2 10.295 4.461 -24.870 387 H GLU 3 HN GLU 3 12.466 3.505 -26.151 388 HA GLU 3 HA GLU 3 14.346 1.917 -24.623 389 HB2 GLU 3 2HB GLU 3 16.012 3.530 -25.416 390 HB3 GLU 3 3HB GLU 3 14.956 3.014 -26.728 391 HG2 GLU 3 2HG GLU 3 13.663 5.154 -26.502 392 HG3 GLU 3 3HG GLU 3 14.780 5.674 -25.236 393 H LYS 4 HN LYS 4 12.407 4.729 -23.893 394 HA LYS 4 HA LYS 4 13.643 4.824 -21.188 395 HB2 LYS 4 2HB LYS 4 14.561 6.738 -22.483 396 HB3 LYS 4 3HB LYS 4 12.923 7.283 -22.869 397 HG2 LYS 4 2HG LYS 4 12.471 7.727 -20.512 398 HG3 LYS 4 3HG LYS 4 14.036 7.036 -20.035 399 HD2 LYS 4 2HD LYS 4 15.153 8.903 -21.267 400 HD3 LYS 4 3HD LYS 4 13.559 9.573 -21.665 401 HE2 LYS 4 2HE LYS 4 14.678 9.127 -18.856 402 HE3 LYS 4 3HE LYS 4 14.574 10.685 -19.687 403 HZ1 LYS 4 3HZ LYS 4 12.753 10.385 -18.161 404 HZ2 LYS 4 1HZ LYS 4 12.273 9.000 -18.897 405 HZ3 LYS 4 2HZ LYS 4 12.172 10.436 -19.699 406 H ARG 5 HN ARG 5 12.182 5.620 -19.538 407 HA ARG 5 HA ARG 5 9.300 5.527 -20.334 408 HE ARG 5 HE ARG 5 10.652 1.960 -22.005 409 HB2 ARG 5 2HB ARG 5 10.493 4.376 -17.780 410 HB3 ARG 5 3HB ARG 5 8.810 4.271 -18.284 411 HG2 ARG 5 2HG ARG 5 11.188 2.964 -19.686 412 HG3 ARG 5 3HG ARG 5 10.049 2.144 -18.655 413 HD2 ARG 5 2HD ARG 5 8.265 2.333 -20.217 414 HD3 ARG 5 3HD ARG 5 9.093 3.567 -21.157 415 HH11 ARG 5 2HH1 ARG 5 7.956 0.367 -20.376 416 HH12 ARG 5 1HH1 ARG 5 8.330 -1.155 -21.165 417 HH21 ARG 5 1HH2 ARG 5 11.074 0.101 -22.851 418 HH22 ARG 5 2HH2 ARG 5 10.044 -1.311 -22.581 419 HA PRO 6 HA PRO 6 8.575 9.354 -18.459 420 HB2 PRO 6 2HB PRO 6 6.507 7.919 -16.720 421 HB3 PRO 6 3HB PRO 6 6.363 9.489 -17.572 422 HG2 PRO 6 2HG PRO 6 5.322 7.308 -18.706 423 HG3 PRO 6 3HG PRO 6 6.356 8.363 -19.711 424 HD2 PRO 6 2HD PRO 6 7.126 5.778 -18.326 425 HD3 PRO 6 3HD PRO 6 7.455 6.315 -20.007 426 H PHE 7 HN PHE 7 8.016 7.097 -15.643 427 HA PHE 7 HA PHE 7 9.993 8.765 -14.084 428 HD1 PHE 7 1HD PHE 7 8.442 10.905 -12.645 429 HD2 PHE 7 2HD PHE 7 5.783 8.079 -14.512 430 HE1 PHE 7 1HE PHE 7 7.025 12.774 -13.463 431 HE2 PHE 7 2HE PHE 7 4.404 9.951 -15.392 432 HZ PHE 7 HZ PHE 7 5.041 12.300 -14.887 433 HB2 PHE 7 2HB PHE 7 7.519 7.320 -13.049 434 HB3 PHE 7 3HB PHE 7 8.542 8.428 -12.149 435 H MET 8 HN MET 8 11.324 7.685 -12.493 436 HA MET 8 HA MET 8 10.883 4.745 -12.243 437 HB2 MET 8 2HB MET 8 13.538 6.207 -12.481 438 HB3 MET 8 3HB MET 8 13.385 4.537 -11.978 439 HG2 MET 8 2HG MET 8 12.187 4.105 -14.198 440 HG3 MET 8 3HG MET 8 12.669 5.726 -14.675 441 HE1 MET 8 3HE MET 8 14.723 2.884 -12.631 442 HE2 MET 8 1HE MET 8 13.726 2.072 -13.859 443 HE3 MET 8 2HE MET 8 15.495 2.100 -14.019 444 H CYS 9 HN CYS 9 11.623 3.775 -10.266 445 HA CYS 9 HA CYS 9 11.306 5.472 -7.887 446 HB2 CYS 9 2HB CYS 9 10.552 3.097 -7.900 447 HB3 CYS 9 3HB CYS 9 12.220 2.565 -8.156 448 H ALA 10 HN ALA 10 13.077 5.235 -6.122 449 HA ALA 10 HA ALA 10 15.805 5.374 -7.273 450 HB1 ALA 10 1HB ALA 10 16.227 7.567 -6.220 451 HB2 ALA 10 2HB ALA 10 14.902 7.683 -7.393 452 HB3 ALA 10 3HB ALA 10 14.543 7.634 -5.651 453 H TYR 11 HN TYR 11 13.894 3.886 -5.046 454 HA TYR 11 HA TYR 11 15.474 4.278 -2.618 455 HD1 TYR 11 1HD TYR 11 13.442 4.224 -0.376 456 HD2 TYR 11 2HD TYR 11 14.653 0.363 -1.853 457 HE1 TYR 11 1HE TYR 11 13.716 3.437 1.966 458 HE2 TYR 11 2HE TYR 11 15.177 -0.338 0.484 459 HH TYR 11 HH TYR 11 14.680 1.844 3.278 460 HB2 TYR 11 2HB TYR 11 13.046 3.572 -2.721 461 HB3 TYR 11 3HB TYR 11 13.576 2.019 -3.348 462 HA PRO 12 HA PRO 12 18.792 1.541 -3.743 463 HB2 PRO 12 2HB PRO 12 19.862 1.016 -1.246 464 HB3 PRO 12 3HB PRO 12 19.982 2.594 -2.060 465 HG2 PRO 12 2HG PRO 12 17.942 1.758 0.025 466 HG3 PRO 12 3HG PRO 12 18.968 3.231 0.005 467 HD2 PRO 12 2HD PRO 12 16.420 3.275 -0.881 468 HD3 PRO 12 3HD PRO 12 17.687 4.203 -1.735 469 H GLY 13 HN GLY 13 17.276 -0.105 -4.534 470 HA2 GLY 13 2HA GLY 13 17.592 -2.691 -3.917 471 HA3 GLY 13 3HA GLY 13 16.505 -2.213 -2.600 472 H CYS 14 HN CYS 14 15.751 -0.253 -5.228 473 HA CYS 14 HA CYS 14 13.793 -2.204 -6.356 474 HB2 CYS 14 2HB CYS 14 12.549 -0.890 -4.786 475 HB3 CYS 14 3HB CYS 14 13.239 0.635 -5.373 476 H ASN 15 HN ASN 15 14.412 1.301 -6.886 477 HA ASN 15 HA ASN 15 14.586 2.475 -8.872 478 HB2 ASN 15 2HB ASN 15 16.638 1.930 -10.193 479 HB3 ASN 15 3HB ASN 15 16.903 2.062 -8.473 480 HD21 ASN 15 1HD2 ASN 15 16.308 -0.444 -10.921 481 HD22 ASN 15 2HD2 ASN 15 17.480 -1.596 -10.206 482 H LYS 16 HN LYS 16 12.369 1.232 -9.259 483 HA LYS 16 HA LYS 16 12.499 -0.314 -11.827 484 HB2 LYS 16 2HB LYS 16 10.280 0.068 -9.771 485 HB3 LYS 16 3HB LYS 16 10.001 -0.716 -11.333 486 HG2 LYS 16 2HG LYS 16 11.530 -2.506 -10.837 487 HG3 LYS 16 3HG LYS 16 12.117 -1.684 -9.392 488 HD2 LYS 16 2HD LYS 16 9.754 -1.826 -8.445 489 HD3 LYS 16 3HD LYS 16 9.332 -2.841 -9.829 490 HE2 LYS 16 2HE LYS 16 9.842 -4.208 -7.870 491 HE3 LYS 16 3HE LYS 16 11.058 -4.493 -9.130 492 HZ1 LYS 16 3HZ LYS 16 12.567 -3.105 -7.959 493 HZ2 LYS 16 1HZ LYS 16 11.966 -4.168 -6.848 494 HZ3 LYS 16 2HZ LYS 16 11.445 -2.590 -6.910 495 H ARG 17 HN ARG 17 10.246 0.294 -13.110 496 HA ARG 17 HA ARG 17 10.404 3.262 -13.452 497 HE ARG 17 HE ARG 17 8.486 2.672 -16.538 498 HB2 ARG 17 2HB ARG 17 10.246 2.938 -15.860 499 HB3 ARG 17 3HB ARG 17 11.637 2.137 -15.197 500 HG2 ARG 17 2HG ARG 17 10.854 0.759 -16.887 501 HG3 ARG 17 3HG ARG 17 10.515 -0.076 -15.390 502 HD2 ARG 17 2HD ARG 17 8.802 -0.117 -17.341 503 HD3 ARG 17 3HD ARG 17 8.206 0.059 -15.699 504 HH11 ARG 17 1HH2 ARG 17 6.640 -0.045 -17.764 505 HH12 ARG 17 2HH2 ARG 17 5.398 0.992 -18.428 506 HH21 ARG 17 1HH1 ARG 17 6.821 3.913 -17.258 507 HH22 ARG 17 2HH1 ARG 17 5.516 3.156 -18.159 508 H TYR 18 HN TYR 18 8.574 4.396 -13.728 509 HA TYR 18 HA TYR 18 5.994 2.914 -13.866 510 HD1 TYR 18 2HD TYR 18 8.543 3.883 -11.102 511 HD2 TYR 18 1HD TYR 18 4.310 3.028 -11.227 512 HE1 TYR 18 2HE TYR 18 8.861 1.996 -9.527 513 HE2 TYR 18 1HE TYR 18 4.666 1.083 -9.765 514 HH TYR 18 HH TYR 18 7.766 0.317 -8.333 515 HB2 TYR 18 2HB TYR 18 6.911 5.374 -12.338 516 HB3 TYR 18 3HB TYR 18 5.223 4.926 -12.469 517 H PHE 19 HN PHE 19 4.134 4.421 -14.540 518 HA PHE 19 HA PHE 19 5.042 6.073 -16.881 519 HD1 PHE 19 1HD PHE 19 4.800 4.628 -19.445 520 HD2 PHE 19 2HD PHE 19 1.099 6.196 -17.885 521 HE1 PHE 19 1HE PHE 19 4.235 5.518 -21.680 522 HE2 PHE 19 2HE PHE 19 0.538 7.088 -20.134 523 HZ PHE 19 HZ PHE 19 2.108 6.753 -22.031 524 HB2 PHE 19 2HB PHE 19 3.825 3.837 -17.266 525 HB3 PHE 19 3HB PHE 19 2.404 4.590 -16.581 526 H LYS 20 HN LYS 20 3.361 6.153 -13.877 527 HA LYS 20 HA LYS 20 2.158 8.815 -14.578 528 HB2 LYS 20 2HB LYS 20 0.882 6.407 -13.329 529 HB3 LYS 20 3HB LYS 20 0.390 8.019 -12.722 530 HG2 LYS 20 2HG LYS 20 -0.201 8.686 -15.009 531 HG3 LYS 20 3HG LYS 20 0.377 7.131 -15.638 532 HD2 LYS 20 2HD LYS 20 -1.369 5.939 -14.346 533 HD3 LYS 20 3HD LYS 20 -1.913 7.475 -13.652 534 HE2 LYS 20 2HE LYS 20 -3.414 6.866 -15.444 535 HE3 LYS 20 3HE LYS 20 -2.492 8.297 -15.929 536 HZ1 LYS 20 3HZ LYS 20 -2.627 6.675 -17.688 537 HZ2 LYS 20 1HZ LYS 20 -1.911 5.523 -16.753 538 HZ3 LYS 20 2HZ LYS 20 -1.060 6.858 -17.213 539 H LEU 21 HN LEU 21 2.760 10.425 -13.255 540 HA LEU 21 HA LEU 21 4.788 10.087 -11.390 541 HG LEU 21 HG LEU 21 2.037 12.739 -10.455 542 HB2 LEU 21 2HB LEU 21 4.443 12.357 -10.734 543 HB3 LEU 21 3HB LEU 21 4.257 12.214 -12.457 544 HD11 LEU 21 1HD1 LEU 21 3.324 14.432 -12.644 545 HD12 LEU 21 2HD1 LEU 21 3.614 14.592 -10.896 546 HD13 LEU 21 3HD1 LEU 21 2.012 14.934 -11.558 547 HD21 LEU 21 3HD2 LEU 21 1.000 11.504 -12.322 548 HD22 LEU 21 1HD2 LEU 21 1.878 12.517 -13.500 549 HD23 LEU 21 2HD2 LEU 21 0.621 13.212 -12.464 550 H SER 22 HN SER 22 1.271 10.469 -10.679 551 HA SER 22 HA SER 22 1.591 10.245 -7.813 552 HG SER 22 HG SER 22 -1.858 10.024 -9.974 553 HB2 SER 22 2HB SER 22 -0.893 9.790 -7.889 554 HB3 SER 22 3HB SER 22 -0.399 11.275 -8.723 555 H HIS 23 HN HIS 23 0.358 7.903 -10.254 556 HA HIS 23 HA HIS 23 0.248 5.714 -8.653 557 HD1 HIS 23 1HD HIS 23 0.010 2.898 -12.096 558 HD2 HIS 23 2HD HIS 23 3.255 5.525 -11.870 559 HE1 HIS 23 1HE HIS 23 1.701 2.145 -13.865 560 HB2 HIS 23 2HB HIS 23 -0.341 4.759 -10.492 561 HB3 HIS 23 3HB HIS 23 0.067 6.146 -11.387 562 H LEU 24 HN LEU 24 3.227 7.075 -10.003 563 HA LEU 24 HA LEU 24 4.977 4.976 -8.931 564 HG LEU 24 HG LEU 24 7.754 6.262 -10.462 565 HB2 LEU 24 2HB LEU 24 5.594 6.515 -10.800 566 HB3 LEU 24 3HB LEU 24 5.590 7.851 -9.707 567 HD11 LEU 24 1HD1 LEU 24 7.607 8.192 -8.137 568 HD12 LEU 24 2HD1 LEU 24 7.821 8.621 -9.849 569 HD13 LEU 24 3HD1 LEU 24 9.074 7.687 -9.010 570 HD21 LEU 24 3HD2 LEU 24 7.065 4.588 -8.585 571 HD22 LEU 24 1HD2 LEU 24 7.688 5.852 -7.485 572 HD23 LEU 24 2HD2 LEU 24 8.735 5.150 -8.699 573 H GLN 25 HN GLN 25 3.830 8.211 -7.797 574 HA GLN 25 HA GLN 25 5.256 8.291 -5.328 575 HB2 GLN 25 2HB GLN 25 3.889 10.158 -6.349 576 HB3 GLN 25 3HB GLN 25 2.429 9.306 -5.844 577 HG2 GLN 25 2HG GLN 25 3.165 9.472 -3.463 578 HG3 GLN 25 3HG GLN 25 4.572 10.405 -3.997 579 HE21 GLN 25 1HE2 GLN 25 3.516 12.151 -2.426 580 HE22 GLN 25 2HE2 GLN 25 2.257 13.074 -3.235 581 H MET 26 HN MET 26 2.195 6.675 -6.248 582 HA MET 26 HA MET 26 1.513 5.708 -3.643 583 HB2 MET 26 2HB MET 26 0.837 4.852 -6.462 584 HB3 MET 26 3HB MET 26 0.270 3.920 -5.066 585 HG2 MET 26 2HG MET 26 -0.247 6.880 -5.542 586 HG3 MET 26 3HG MET 26 -1.361 5.576 -5.958 587 HE1 MET 26 3HE MET 26 -3.256 6.886 -4.617 588 HE2 MET 26 1HE MET 26 -3.059 7.425 -2.930 589 HE3 MET 26 2HE MET 26 -2.058 8.141 -4.213 590 H HIS 27 HN HIS 27 3.413 4.246 -6.373 591 HA HIS 27 HA HIS 27 4.128 1.811 -5.038 592 HD1 HIS 27 1HD HIS 27 6.248 -0.145 -5.944 593 HD2 HIS 27 2HD HIS 27 8.025 3.620 -6.662 594 HE1 HIS 27 1HE HIS 27 8.754 -0.362 -5.422 595 HB2 HIS 27 2HB HIS 27 4.707 1.893 -7.321 596 HB3 HIS 27 3HB HIS 27 5.455 3.479 -7.217 597 H SER 28 HN SER 28 5.564 5.086 -4.936 598 HA SER 28 HA SER 28 7.899 4.500 -3.496 599 HG SER 28 HG SER 28 5.312 7.123 -3.091 600 HB2 SER 28 2HB SER 28 8.142 6.768 -3.208 601 HB3 SER 28 3HB SER 28 7.047 6.740 -4.586 602 H ARG 29 HN ARG 29 4.546 4.664 -2.350 603 HA ARG 29 HA ARG 29 4.974 5.252 0.401 604 HE ARG 29 HE ARG 29 0.081 3.298 -0.361 605 HB2 ARG 29 2HB ARG 29 2.933 3.388 -0.879 606 HB3 ARG 29 3HB ARG 29 2.883 3.939 0.779 607 HG2 ARG 29 2HG ARG 29 2.408 6.175 0.208 608 HG3 ARG 29 3HG ARG 29 2.859 5.954 -1.482 609 HD2 ARG 29 2HD ARG 29 0.373 6.063 -1.105 610 HD3 ARG 29 3HD ARG 29 0.941 4.629 -1.964 611 HH11 ARG 29 2HH2 ARG 29 0.499 6.433 1.215 612 HH12 ARG 29 1HH2 ARG 29 -0.224 5.805 2.704 613 HH21 ARG 29 1HH1 ARG 29 -0.996 2.708 1.545 614 HH22 ARG 29 2HH1 ARG 29 -1.048 3.892 2.829 615 H LYS 30 HN LYS 30 5.326 2.187 -1.428 616 HA LYS 30 HA LYS 30 5.617 0.390 0.799 617 HB2 LYS 30 2HB LYS 30 5.351 -0.598 -1.317 618 HB3 LYS 30 3HB LYS 30 6.562 0.424 -2.075 619 HG2 LYS 30 2HG LYS 30 7.369 -1.809 -2.045 620 HG3 LYS 30 3HG LYS 30 8.375 -0.782 -1.044 621 HD2 LYS 30 2HD LYS 30 6.825 -1.711 0.925 622 HD3 LYS 30 3HD LYS 30 6.483 -3.008 -0.234 623 HE2 LYS 30 2HE LYS 30 8.892 -3.481 -0.448 624 HE3 LYS 30 3HE LYS 30 9.278 -2.039 0.505 625 HZ1 LYS 30 3HZ LYS 30 7.965 -4.474 1.489 626 HZ2 LYS 30 1HZ LYS 30 8.087 -3.075 2.356 627 HZ3 LYS 30 2HZ LYS 30 9.461 -3.875 1.898 628 H HIS 31 HN HIS 31 7.869 2.682 -0.730 629 HA HIS 31 HA HIS 31 10.157 1.629 0.811 630 HD1 HIS 31 1HD HIS 31 11.381 0.299 -0.505 631 HD2 HIS 31 2HD HIS 31 10.298 2.921 -3.659 632 HE1 HIS 31 1HE HIS 31 11.809 -0.928 -2.661 633 HB2 HIS 31 2HB HIS 31 9.850 3.849 -1.234 634 HB3 HIS 31 3HB HIS 31 11.335 3.519 -0.378 635 H THR 32 HN THR 32 7.947 4.470 0.805 636 HA THR 32 HA THR 32 9.259 6.117 2.717 637 HB THR 32 HB THR 32 7.093 6.937 3.373 638 HG1 THR 32 1HG THR 32 6.009 4.585 2.239 639 HG21 THR 32 3HG2 THR 32 6.087 7.607 1.231 640 HG22 THR 32 1HG2 THR 32 7.142 6.485 0.384 641 HG23 THR 32 2HG2 THR 32 7.846 7.825 1.290 642 H GLY 33 HN GLY 33 7.461 3.101 3.100 643 HA2 GLY 33 2HA GLY 33 8.567 2.952 5.857 644 HA3 GLY 33 3HA GLY 33 6.922 2.379 5.504 645 H GLU 34 HN GLU 34 10.321 2.021 4.322 646 HA GLU 34 HA GLU 34 9.837 -0.526 3.080 647 HB2 GLU 34 2HB GLU 34 11.727 0.957 2.452 648 HB3 GLU 34 3HB GLU 34 12.472 0.705 4.035 649 HG2 GLU 34 2HG GLU 34 13.479 -0.798 2.291 650 HG3 GLU 34 3HG GLU 34 12.736 -1.707 3.562 651 H LYS 35 HN LYS 35 8.848 -1.995 4.441 652 HA LYS 35 HA LYS 35 8.468 -3.370 6.288 653 HB2 LYS 35 2HB LYS 35 10.225 -5.074 6.513 654 HB3 LYS 35 3HB LYS 35 9.843 -4.694 4.856 655 HG2 LYS 35 2HG LYS 35 11.924 -3.503 4.545 656 HG3 LYS 35 3HG LYS 35 12.315 -3.607 6.262 657 HD2 LYS 35 2HD LYS 35 13.610 -5.260 5.096 658 HD3 LYS 35 3HD LYS 35 12.407 -6.080 6.089 659 HE2 LYS 35 2HE LYS 35 12.509 -7.215 3.977 660 HE3 LYS 35 3HE LYS 35 10.967 -6.356 4.036 661 HZ1 LYS 35 3HZ LYS 35 13.400 -5.426 2.650 662 HZ2 LYS 35 1HZ LYS 35 11.965 -4.623 2.673 663 HZ3 LYS 35 2HZ LYS 35 12.077 -6.082 1.920 664 HA PRO 36 HA PRO 36 10.708 -1.191 9.764 665 HB2 PRO 36 2HB PRO 36 9.149 0.910 10.424 666 HB3 PRO 36 3HB PRO 36 10.215 0.985 8.983 667 HG2 PRO 36 2HG PRO 36 7.239 0.354 9.072 668 HG3 PRO 36 3HG PRO 36 8.099 1.483 7.988 669 HD2 PRO 36 2HD PRO 36 7.459 -1.134 7.353 670 HD3 PRO 36 3HD PRO 36 8.834 -0.209 6.645 671 H TYR 37 HN TYR 37 7.302 -2.129 9.210 672 HA TYR 37 HA TYR 37 6.620 -2.098 12.091 673 HD1 TYR 37 1HD TYR 37 4.474 -1.309 12.958 674 HD2 TYR 37 2HD TYR 37 4.369 -0.814 8.682 675 HE1 TYR 37 1HE TYR 37 3.227 0.813 13.243 676 HE2 TYR 37 2HE TYR 37 3.175 1.356 8.963 677 HH TYR 37 HH TYR 37 2.514 2.782 12.089 678 HB2 TYR 37 2HB TYR 37 5.153 -2.803 9.537 679 HB3 TYR 37 3HB TYR 37 4.499 -3.296 11.037 680 H GLN 38 HN GLN 38 7.976 -3.570 13.098 681 HA GLN 38 HA GLN 38 8.017 -6.388 12.129 682 HB2 GLN 38 2HB GLN 38 10.106 -5.100 12.893 683 HB3 GLN 38 3HB GLN 38 9.440 -5.155 14.510 684 HG2 GLN 38 2HG GLN 38 9.344 -7.800 14.029 685 HG3 GLN 38 3HG GLN 38 10.571 -7.394 12.843 686 HE21 GLN 38 1HE2 GLN 38 9.808 -7.685 16.251 687 HE22 GLN 38 2HE2 GLN 38 11.464 -7.353 16.801 688 H CYS 39 HN CYS 39 7.007 -8.037 13.152 689 HA CYS 39 HA CYS 39 5.085 -7.594 15.255 690 HB2 CYS 39 2HB CYS 39 5.121 -9.569 13.664 691 HB3 CYS 39 3HB CYS 39 6.504 -10.217 14.565 692 H ASP 40 HN ASP 40 5.175 -8.419 17.460 693 HA ASP 40 HA ASP 40 7.911 -8.623 18.634 694 HB2 ASP 40 2HB ASP 40 5.648 -6.851 19.668 695 HB3 ASP 40 3HB ASP 40 7.116 -7.219 20.577 696 H PHE 41 HN PHE 41 5.534 -10.447 17.905 697 HA PHE 41 HA PHE 41 4.320 -11.353 20.353 698 HD1 PHE 41 1HD PHE 41 2.094 -12.598 20.306 699 HD2 PHE 41 2HD PHE 41 4.454 -15.024 17.628 700 HE1 PHE 41 1HE PHE 41 0.679 -14.572 20.832 701 HE2 PHE 41 2HE PHE 41 3.012 -16.969 18.129 702 HZ PHE 41 HZ PHE 41 1.123 -16.749 19.721 703 HB2 PHE 41 2HB PHE 41 3.469 -11.785 18.060 704 HB3 PHE 41 3HB PHE 41 4.880 -12.786 17.771 705 H LYS 42 HN LYS 42 4.650 -13.635 21.216 706 HA LYS 42 HA LYS 42 7.234 -13.726 22.386 707 HB2 LYS 42 2HB LYS 42 6.474 -15.643 23.564 708 HB3 LYS 42 3HB LYS 42 5.068 -14.603 23.355 709 HG2 LYS 42 2HG LYS 42 4.399 -16.077 21.375 710 HG3 LYS 42 3HG LYS 42 5.741 -17.152 21.828 711 HD2 LYS 42 2HD LYS 42 4.698 -17.294 24.151 712 HD3 LYS 42 3HD LYS 42 3.272 -16.491 23.477 713 HE2 LYS 42 2HE LYS 42 4.481 -19.140 22.556 714 HE3 LYS 42 3HE LYS 42 3.016 -18.949 23.532 715 HZ1 LYS 42 3HZ LYS 42 2.439 -19.286 21.264 716 HZ2 LYS 42 1HZ LYS 42 3.419 -18.070 20.754 717 HZ3 LYS 42 2HZ LYS 42 2.068 -17.721 21.643 718 H ASP 43 HN ASP 43 6.189 -15.027 19.339 719 HA ASP 43 HA ASP 43 8.807 -16.388 19.014 720 HB2 ASP 43 2HB ASP 43 7.726 -18.443 18.113 721 HB3 ASP 43 3HB ASP 43 7.392 -18.179 19.807 722 H CYS 44 HN CYS 44 7.395 -13.916 17.914 723 HA CYS 44 HA CYS 44 7.895 -14.571 15.064 724 HB2 CYS 44 2HB CYS 44 5.387 -14.591 15.437 725 HB3 CYS 44 3HB CYS 44 5.543 -12.893 15.950 726 H GLU 45 HN GLU 45 8.797 -12.947 13.877 727 HA GLU 45 HA GLU 45 9.022 -10.231 15.005 728 HB2 GLU 45 2HB GLU 45 11.490 -10.181 14.697 729 HB3 GLU 45 3HB GLU 45 10.992 -11.312 15.940 730 HG2 GLU 45 2HG GLU 45 11.299 -13.220 14.377 731 HG3 GLU 45 3HG GLU 45 11.794 -12.106 13.103 732 H ARG 46 HN ARG 46 7.597 -11.481 12.748 733 HA ARG 46 HA ARG 46 9.068 -11.045 10.279 734 HE ARG 46 HE ARG 46 6.903 -13.796 11.902 735 HB2 ARG 46 2HB ARG 46 6.278 -11.800 11.077 736 HB3 ARG 46 3HB ARG 46 6.409 -10.911 9.575 737 HG2 ARG 46 2HG ARG 46 6.450 -13.310 9.164 738 HG3 ARG 46 3HG ARG 46 7.898 -12.494 8.589 739 HD2 ARG 46 2HD ARG 46 8.498 -14.621 9.536 740 HD3 ARG 46 3HD ARG 46 9.170 -13.338 10.551 741 HH11 ARG 46 1HH1 ARG 46 9.180 -16.238 10.732 742 HH12 ARG 46 2HH1 ARG 46 8.728 -17.313 12.045 743 HH21 ARG 46 1HH2 ARG 46 6.509 -15.091 13.438 744 HH22 ARG 46 2HH2 ARG 46 7.273 -16.666 13.627 745 H ARG 47 HN ARG 47 9.028 -9.316 8.887 746 HA ARG 47 HA ARG 47 8.078 -6.774 10.127 747 HE ARG 47 HE ARG 47 13.093 -6.265 11.808 748 HB2 ARG 47 2HB ARG 47 10.330 -7.375 8.137 749 HB3 ARG 47 3HB ARG 47 9.762 -5.743 8.555 750 HG2 ARG 47 2HG ARG 47 10.197 -6.141 10.898 751 HG3 ARG 47 3HG ARG 47 10.875 -7.744 10.551 752 HD2 ARG 47 2HD ARG 47 12.781 -6.834 9.499 753 HD3 ARG 47 3HD ARG 47 12.012 -5.269 9.216 754 HH11 ARG 47 1HH2 ARG 47 11.578 -3.538 10.103 755 HH12 ARG 47 2HH2 ARG 47 11.509 -2.608 11.588 756 HH21 ARG 47 1HH1 ARG 47 12.870 -5.038 13.597 757 HH22 ARG 47 2HH1 ARG 47 12.453 -3.339 13.443 758 H PHE 48 HN PHE 48 6.607 -5.571 9.184 759 HA PHE 48 HA PHE 48 5.881 -6.138 6.329 760 HD1 PHE 48 2HD PHE 48 4.765 -6.965 10.130 761 HD2 PHE 48 1HD PHE 48 3.173 -7.787 6.205 762 HE1 PHE 48 2HE PHE 48 4.558 -9.358 10.724 763 HE2 PHE 48 1HE PHE 48 2.925 -10.168 6.818 764 HZ PHE 48 HZ PHE 48 3.721 -10.972 9.029 765 HB2 PHE 48 2HB PHE 48 4.065 -5.109 8.549 766 HB3 PHE 48 3HB PHE 48 3.606 -5.499 6.895 767 H SER 49 HN SER 49 4.853 -4.195 5.247 768 HA SER 49 HA SER 49 6.615 -1.885 5.815 769 HG SER 49 HG SER 49 7.310 -1.015 3.835 770 HB2 SER 49 2HB SER 49 5.374 -3.076 3.427 771 HB3 SER 49 3HB SER 49 5.135 -1.318 3.502 772 H ARG 50 HN ARG 50 3.142 -2.718 5.593 773 HA ARG 50 HA ARG 50 2.498 0.088 6.446 774 HE ARG 50 HE ARG 50 -0.848 -1.948 3.164 775 HB2 ARG 50 2HB ARG 50 0.785 -2.001 5.048 776 HB3 ARG 50 3HB ARG 50 0.224 -0.420 5.590 777 HG2 ARG 50 2HG ARG 50 1.921 0.664 4.094 778 HG3 ARG 50 3HG ARG 50 2.298 -0.933 3.422 779 HD2 ARG 50 2HD ARG 50 -0.467 0.368 3.444 780 HD3 ARG 50 3HD ARG 50 0.626 0.391 2.070 781 HH11 ARG 50 2HH1 ARG 50 1.242 -0.733 0.618 782 HH12 ARG 50 1HH1 ARG 50 0.819 -2.075 -0.429 783 HH21 ARG 50 1HH2 ARG 50 -1.253 -3.594 1.727 784 HH22 ARG 50 2HH2 ARG 50 -0.479 -3.601 0.189 785 H SER 51 HN SER 51 0.913 0.450 8.035 786 HA SER 51 HA SER 51 1.028 -1.177 10.332 787 HG SER 51 HG SER 51 1.004 1.860 10.312 788 HB2 SER 51 2HB SER 51 -1.423 0.475 9.870 789 HB3 SER 51 3HB SER 51 -0.374 0.406 11.287 790 H ASP 52 HN ASP 52 -1.461 -0.983 7.743 791 HA ASP 52 HA ASP 52 -3.289 -2.793 8.926 792 HB2 ASP 52 2HB ASP 52 -4.430 -2.742 6.918 793 HB3 ASP 52 3HB ASP 52 -3.616 -1.180 6.970 794 H GLN 53 HN GLN 53 -0.429 -3.366 6.866 795 HA GLN 53 HA GLN 53 -0.956 -6.149 6.325 796 HB2 GLN 53 2HB GLN 53 1.622 -4.562 6.473 797 HB3 GLN 53 3HB GLN 53 1.529 -6.231 5.932 798 HG2 GLN 53 2HG GLN 53 0.303 -5.657 3.973 799 HG3 GLN 53 3HG GLN 53 0.030 -4.004 4.522 800 HE21 GLN 53 1HE2 GLN 53 1.183 -4.204 2.005 801 HE22 GLN 53 2HE2 GLN 53 2.904 -3.836 2.171 802 H LEU 54 HN LEU 54 1.031 -4.436 8.810 803 HA LEU 54 HA LEU 54 1.802 -6.801 10.249 804 HG LEU 54 HG LEU 54 1.571 -5.273 13.159 805 HB2 LEU 54 2HB LEU 54 2.941 -4.682 10.512 806 HB3 LEU 54 3HB LEU 54 1.488 -3.897 11.116 807 HD11 LEU 54 1HD1 LEU 54 4.280 -6.288 12.197 808 HD12 LEU 54 2HD1 LEU 54 2.806 -7.261 12.228 809 HD13 LEU 54 3HD1 LEU 54 3.498 -6.638 13.739 810 HD21 LEU 54 3HD2 LEU 54 2.893 -3.047 12.848 811 HD22 LEU 54 1HD2 LEU 54 4.351 -4.103 12.940 812 HD23 LEU 54 2HD2 LEU 54 3.207 -4.064 14.255 813 H LYS 55 HN LYS 55 -0.994 -4.534 10.668 814 HA LYS 55 HA LYS 55 -2.118 -5.778 12.994 815 HB2 LYS 55 2HB LYS 55 -3.288 -4.109 10.740 816 HB3 LYS 55 3HB LYS 55 -4.307 -4.770 12.014 817 HG2 LYS 55 2HG LYS 55 -3.049 -3.597 13.744 818 HG3 LYS 55 3HG LYS 55 -1.939 -2.925 12.540 819 HD2 LYS 55 2HD LYS 55 -3.834 -1.757 11.434 820 HD3 LYS 55 3HD LYS 55 -4.959 -2.467 12.610 821 HE2 LYS 55 2HE LYS 55 -3.663 -1.328 14.446 822 HE3 LYS 55 3HE LYS 55 -2.695 -0.517 13.201 823 HZ1 LYS 55 3HZ LYS 55 -4.745 0.443 12.353 824 HZ2 LYS 55 1HZ LYS 55 -4.503 0.865 13.919 825 HZ3 LYS 55 2HZ LYS 55 -5.620 -0.287 13.543 826 H ARG 56 HN ARG 56 -2.761 -6.318 9.484 827 HA ARG 56 HA ARG 56 -4.703 -8.389 9.788 828 HE ARG 56 HE ARG 56 -2.066 -9.111 5.946 829 HB2 ARG 56 2HB ARG 56 -4.164 -7.210 7.662 830 HB3 ARG 56 3HB ARG 56 -2.600 -8.020 7.614 831 HG2 ARG 56 2HG ARG 56 -3.834 -10.233 7.441 832 HG3 ARG 56 3HG ARG 56 -5.355 -9.326 7.432 833 HD2 ARG 56 2HD ARG 56 -4.737 -9.856 5.134 834 HD3 ARG 56 3HD ARG 56 -4.577 -8.109 5.376 835 HH11 ARG 56 2HH2 ARG 56 -4.071 -9.306 3.013 836 HH12 ARG 56 1HH2 ARG 56 -2.644 -9.535 2.018 837 HH21 ARG 56 1HH1 ARG 56 -0.394 -9.357 4.618 838 HH22 ARG 56 2HH1 ARG 56 -0.626 -9.546 2.894 839 H HIS 57 HN HIS 57 -1.121 -8.499 9.570 840 HA HIS 57 HA HIS 57 -0.838 -11.320 9.684 841 HD1 HIS 57 1HD HIS 57 2.113 -12.654 10.260 842 HD2 HIS 57 2HD HIS 57 1.987 -9.165 12.603 843 HE1 HIS 57 1HE HIS 57 3.462 -13.135 12.375 844 HB2 HIS 57 2HB HIS 57 1.095 -10.210 9.109 845 HB3 HIS 57 3HB HIS 57 0.904 -8.942 10.292 846 H GLN 58 HN GLN 58 -1.019 -8.880 12.349 847 HA GLN 58 HA GLN 58 -0.582 -10.580 14.556 848 HB2 GLN 58 2HB GLN 58 -2.348 -8.105 14.278 849 HB3 GLN 58 3HB GLN 58 -2.175 -8.987 15.778 850 HG2 GLN 58 2HG GLN 58 0.017 -7.532 14.283 851 HG3 GLN 58 3HG GLN 58 -0.631 -7.186 15.876 852 HE21 GLN 58 1HE2 GLN 58 2.151 -8.201 14.552 853 HE22 GLN 58 2HE2 GLN 58 2.666 -9.413 15.688 854 H ARG 59 HN ARG 59 -3.452 -10.378 12.449 855 HA ARG 59 HA ARG 59 -5.406 -11.520 14.186 856 HE ARG 59 HE ARG 59 -7.113 -8.202 9.645 857 HB2 ARG 59 2HB ARG 59 -5.122 -11.954 11.185 858 HB3 ARG 59 3HB ARG 59 -6.543 -12.260 12.151 859 HG2 ARG 59 2HG ARG 59 -6.717 -9.867 12.772 860 HG3 ARG 59 3HG ARG 59 -5.313 -9.496 11.774 861 HD2 ARG 59 2HD ARG 59 -6.480 -10.406 9.779 862 HD3 ARG 59 3HD ARG 59 -7.903 -10.743 10.773 863 HH11 ARG 59 2HH1 ARG 59 -8.872 -9.554 12.359 864 HH12 ARG 59 1HH1 ARG 59 -9.890 -8.136 12.516 865 HH21 ARG 59 2HH2 ARG 59 -8.419 -6.418 9.925 866 HH22 ARG 59 1HH2 ARG 59 -9.652 -6.439 11.162 867 H ARG 60 HN ARG 60 -2.745 -13.002 12.362 868 HA ARG 60 HA ARG 60 -3.462 -15.771 12.636 869 HE ARG 60 HE ARG 60 0.926 -18.481 12.123 870 HB2 ARG 60 2HB ARG 60 -1.642 -14.964 11.183 871 HB3 ARG 60 3HB ARG 60 -0.739 -14.406 12.600 872 HG2 ARG 60 2HG ARG 60 -0.486 -16.728 13.407 873 HG3 ARG 60 3HG ARG 60 -1.368 -17.302 11.981 874 HD2 ARG 60 2HD ARG 60 0.410 -16.032 10.591 875 HD3 ARG 60 3HD ARG 60 1.287 -15.792 12.102 876 HH11 ARG 60 2HH2 ARG 60 2.223 -16.410 9.552 877 HH12 ARG 60 1HH2 ARG 60 3.299 -17.676 9.009 878 HH21 ARG 60 1HH1 ARG 60 2.298 -20.008 11.324 879 HH22 ARG 60 2HH1 ARG 60 3.327 -19.644 9.959 880 H HIS 61 HN HIS 61 -1.706 -13.505 14.819 881 HA HIS 61 HA HIS 61 -1.074 -15.644 16.733 882 HD1 HIS 61 1HD HIS 61 1.149 -15.943 16.177 883 HD2 HIS 61 2HD HIS 61 1.575 -11.761 15.860 884 HE1 HIS 61 1HE HIS 61 3.312 -15.507 14.877 885 HB2 HIS 61 2HB HIS 61 -0.737 -12.613 16.864 886 HB3 HIS 61 3HB HIS 61 -0.140 -13.747 18.072 887 H THR 62 HN THR 62 -3.580 -13.221 16.282 888 HA THR 62 HA THR 62 -4.564 -13.557 19.065 889 HB THR 62 HB THR 62 -6.182 -11.751 18.416 890 HG1 THR 62 1HG THR 62 -4.636 -11.496 16.099 891 HG21 THR 62 3HG2 THR 62 -3.272 -11.081 17.694 892 HG22 THR 62 1HG2 THR 62 -3.973 -11.069 19.321 893 HG23 THR 62 2HG2 THR 62 -4.554 -9.921 18.104 894 H GLY 63 HN GLY 63 -4.908 -15.305 16.260 895 HA2 GLY 63 2HA GLY 63 -6.464 -16.834 15.499 896 HA3 GLY 63 3HA GLY 63 -7.040 -16.845 17.175 897 H VAL 64 HN VAL 64 -7.339 -13.744 15.693 898 HA VAL 64 HA VAL 64 -10.202 -13.900 16.048 899 HB VAL 64 HB VAL 64 -8.648 -11.941 16.523 900 HG11 VAL 64 1HG1 VAL 64 -9.071 -11.142 13.631 901 HG12 VAL 64 2HG1 VAL 64 -8.186 -10.273 14.905 902 HG13 VAL 64 3HG1 VAL 64 -7.561 -11.811 14.284 903 HG21 VAL 64 3HG2 VAL 64 -10.386 -10.273 16.115 904 HG22 VAL 64 1HG2 VAL 64 -11.230 -11.389 15.027 905 HG23 VAL 64 2HG2 VAL 64 -11.050 -11.787 16.744 906 H LYS 65 HN LYS 65 -11.814 -14.196 14.621 907 HA LYS 65 HA LYS 65 -11.257 -13.883 11.701 908 HB2 LYS 65 2HB LYS 65 -12.611 -16.249 13.081 909 HB3 LYS 65 3HB LYS 65 -12.793 -15.894 11.352 910 HG2 LYS 65 2HG LYS 65 -10.460 -16.074 10.964 911 HG3 LYS 65 3HG LYS 65 -10.113 -16.361 12.686 912 HD2 LYS 65 2HD LYS 65 -11.498 -18.474 12.484 913 HD3 LYS 65 3HD LYS 65 -11.586 -18.183 10.734 914 HE2 LYS 65 2HE LYS 65 -9.055 -18.551 12.406 915 HE3 LYS 65 3HE LYS 65 -9.745 -19.744 11.296 916 HZ1 LYS 65 3HZ LYS 65 -8.691 -17.094 10.529 917 HZ2 LYS 65 1HZ LYS 65 -9.325 -18.212 9.491 918 HZ3 LYS 65 2HZ LYS 65 -7.927 -18.539 10.299 919 HA PRO 66 HA PRO 66 -15.057 -11.694 13.115 920 HB2 PRO 66 2HB PRO 66 -14.472 -9.150 12.355 921 HB3 PRO 66 3HB PRO 66 -13.689 -9.912 13.772 922 HG2 PRO 66 2HG PRO 66 -12.585 -9.632 10.960 923 HG3 PRO 66 3HG PRO 66 -11.778 -9.275 12.517 924 HD2 PRO 66 2HD PRO 66 -11.500 -11.659 11.126 925 HD3 PRO 66 3HD PRO 66 -11.314 -11.528 12.893 926 H PHE 67 HN PHE 67 -13.516 -11.940 9.949 927 HA PHE 67 HA PHE 67 -15.690 -10.596 8.498 928 HD1 PHE 67 2HD PHE 67 -14.499 -9.010 6.315 929 HD2 PHE 67 1HD PHE 67 -11.606 -11.104 8.707 930 HE1 PHE 67 2HE PHE 67 -13.028 -7.006 6.300 931 HE2 PHE 67 1HE PHE 67 -10.120 -9.110 8.669 932 HZ PHE 67 HZ PHE 67 -10.830 -7.062 7.451 933 HB2 PHE 67 2HB PHE 67 -13.367 -12.328 7.524 934 HB3 PHE 67 3HB PHE 67 -14.462 -11.460 6.487 935 H GLN 68 HN GLN 68 -17.429 -11.968 9.535 936 HA GLN 68 HA GLN 68 -17.647 -14.660 8.652 937 HB2 GLN 68 2HB GLN 68 -18.607 -13.703 10.750 938 HB3 GLN 68 3HB GLN 68 -19.778 -12.799 9.790 939 HG2 GLN 68 2HG GLN 68 -20.763 -14.919 8.966 940 HG3 GLN 68 3HG GLN 68 -19.551 -15.837 9.873 941 HE21 GLN 68 1HE2 GLN 68 -22.852 -14.923 10.026 942 HE22 GLN 68 2HE2 GLN 68 -22.870 -14.893 11.791 943 H CYS 69 HN CYS 69 -18.805 -15.668 7.092 944 HA CYS 69 HA CYS 69 -19.465 -14.277 4.710 945 HB2 CYS 69 2HB CYS 69 -18.894 -16.667 4.724 946 HB3 CYS 69 3HB CYS 69 -20.323 -17.025 5.692 947 H LYS 70 HN LYS 70 -21.567 -14.101 3.643 948 HA LYS 70 HA LYS 70 -23.610 -13.057 5.571 949 HB2 LYS 70 2HB LYS 70 -22.919 -12.453 2.691 950 HB3 LYS 70 3HB LYS 70 -24.597 -12.321 3.179 951 HG2 LYS 70 2HG LYS 70 -23.550 -10.182 3.280 952 HG3 LYS 70 3HG LYS 70 -24.102 -10.669 4.870 953 HD2 LYS 70 2HD LYS 70 -21.203 -11.048 4.014 954 HD3 LYS 70 3HD LYS 70 -21.783 -9.479 4.561 955 HE2 LYS 70 2HE LYS 70 -21.883 -12.029 6.222 956 HE3 LYS 70 3HE LYS 70 -20.671 -10.765 6.356 957 HZ1 LYS 70 3HZ LYS 70 -22.403 -9.224 6.964 958 HZ2 LYS 70 1HZ LYS 70 -22.390 -10.515 7.988 959 HZ3 LYS 70 2HZ LYS 70 -23.553 -10.397 6.829 960 H THR 71 HN THR 71 -22.760 -15.800 3.780 961 HA THR 71 HA THR 71 -25.610 -16.586 3.302 962 HB THR 71 HB THR 71 -23.774 -18.362 1.929 963 HG1 THR 71 1HG THR 71 -22.247 -16.663 2.009 964 HG21 THR 71 3HG2 THR 71 -24.876 -17.525 -0.052 965 HG22 THR 71 1HG2 THR 71 -25.565 -16.169 0.868 966 HG23 THR 71 2HG2 THR 71 -26.061 -17.842 1.232 967 H CYS 72 HN CYS 72 -22.589 -18.555 3.595 968 HA CYS 72 HA CYS 72 -24.056 -20.541 5.190 969 HB2 CYS 72 2HB CYS 72 -22.054 -21.866 4.985 970 HB3 CYS 72 3HB CYS 72 -22.369 -21.124 3.397 971 H GLN 73 HN GLN 73 -22.277 -17.702 5.867 972 HA GLN 73 HA GLN 73 -21.694 -16.698 7.852 973 HB2 GLN 73 2HB GLN 73 -22.796 -19.084 9.408 974 HB3 GLN 73 3HB GLN 73 -22.591 -17.441 9.931 975 HG2 GLN 73 2HG GLN 73 -24.674 -18.459 7.969 976 HG3 GLN 73 3HG GLN 73 -24.927 -17.864 9.602 977 HE21 GLN 73 1HE2 GLN 73 -25.358 -16.988 6.444 978 HE22 GLN 73 2HE2 GLN 73 -25.225 -15.237 6.670 979 H ARG 74 HN ARG 74 -19.857 -18.593 6.408 980 HA ARG 74 HA ARG 74 -18.187 -19.839 8.468 981 HE ARG 74 HE ARG 74 -15.306 -20.016 7.577 982 HB2 ARG 74 2HB ARG 74 -18.145 -19.468 5.506 983 HB3 ARG 74 3HB ARG 74 -16.603 -19.342 6.232 984 HG2 ARG 74 2HG ARG 74 -18.409 -21.755 6.569 985 HG3 ARG 74 3HG ARG 74 -17.072 -21.604 5.428 986 HD2 ARG 74 2HD ARG 74 -16.926 -21.769 8.447 987 HD3 ARG 74 3HD ARG 74 -16.222 -22.857 7.253 988 HH11 ARG 74 2HH1 ARG 74 -14.283 -23.379 7.374 989 HH12 ARG 74 1HH1 ARG 74 -12.603 -22.921 7.582 990 HH21 ARG 74 1HH2 ARG 74 -13.288 -19.554 7.948 991 HH22 ARG 74 2HH2 ARG 74 -12.030 -20.760 7.811 992 H LYS 75 HN LYS 75 -16.764 -18.806 9.742 993 HA LYS 75 HA LYS 75 -16.296 -15.950 9.350 994 HB2 LYS 75 2HB LYS 75 -15.424 -17.947 11.489 995 HB3 LYS 75 3HB LYS 75 -14.982 -16.235 11.502 996 HG2 LYS 75 2HG LYS 75 -17.369 -15.588 11.439 997 HG3 LYS 75 3HG LYS 75 -17.834 -17.297 11.528 998 HD2 LYS 75 2HD LYS 75 -16.727 -17.494 13.727 999 HD3 LYS 75 3HD LYS 75 -16.193 -15.801 13.624 1000 HE2 LYS 75 2HE LYS 75 -18.558 -15.057 13.509 1001 HE3 LYS 75 3HE LYS 75 -19.100 -16.731 13.609 1002 HZ1 LYS 75 3HZ LYS 75 -17.538 -15.318 15.676 1003 HZ2 LYS 75 1HZ LYS 75 -18.063 -16.878 15.776 1004 HZ3 LYS 75 2HZ LYS 75 -19.152 -15.642 15.746 1005 H PHE 76 HN PHE 76 -14.381 -14.895 8.918 1006 HA PHE 76 HA PHE 76 -11.928 -16.517 8.373 1007 HD1 PHE 76 1HD PHE 76 -11.652 -17.839 5.962 1008 HD2 PHE 76 2HD PHE 76 -15.171 -15.345 5.699 1009 HE1 PHE 76 1HE PHE 76 -12.857 -19.651 4.777 1010 HE2 PHE 76 2HE PHE 76 -16.367 -17.162 4.534 1011 HZ PHE 76 HZ PHE 76 -15.213 -19.324 4.074 1012 HB2 PHE 76 2HB PHE 76 -13.110 -14.427 6.486 1013 HB3 PHE 76 3HB PHE 76 -11.597 -15.282 6.249 1014 H SER 77 HN SER 77 -9.977 -15.056 8.052 1015 HA SER 77 HA SER 77 -10.161 -12.731 9.926 1016 HG SER 77 HG SER 77 -8.722 -14.265 11.590 1017 HB2 SER 77 2HB SER 77 -7.730 -14.276 8.909 1018 HB3 SER 77 3HB SER 77 -7.689 -12.971 10.092 1019 H ARG 78 HN ARG 78 -10.148 -13.331 6.594 1020 HA ARG 78 HA ARG 78 -9.024 -10.628 5.997 1021 HE ARG 78 HE ARG 78 -6.032 -13.012 3.296 1022 HB2 ARG 78 2HB ARG 78 -8.164 -13.267 4.718 1023 HB3 ARG 78 3HB ARG 78 -7.830 -11.661 4.040 1024 HG2 ARG 78 2HG ARG 78 -6.439 -11.014 5.809 1025 HG3 ARG 78 3HG ARG 78 -6.921 -12.350 6.838 1026 HD2 ARG 78 2HD ARG 78 -4.648 -12.587 5.933 1027 HD3 ARG 78 3HD ARG 78 -5.720 -13.953 5.654 1028 HH11 ARG 78 2HH2 ARG 78 -2.947 -12.378 4.914 1029 HH12 ARG 78 1HH2 ARG 78 -2.078 -12.845 3.448 1030 HH21 ARG 78 1HH1 ARG 78 -4.822 -13.785 1.693 1031 HH22 ARG 78 2HH1 ARG 78 -3.114 -13.415 1.593 1032 H SER 79 HN SER 79 -10.589 -9.539 4.949 1033 HA SER 79 HA SER 79 -12.862 -10.633 3.793 1034 HG SER 79 HG SER 79 -11.436 -6.859 3.281 1035 HB2 SER 79 2HB SER 79 -13.022 -8.377 2.586 1036 HB3 SER 79 3HB SER 79 -12.882 -8.328 4.338 1037 H ASP 80 HN ASP 80 -9.678 -10.600 2.373 1038 HA ASP 80 HA ASP 80 -10.560 -10.635 -0.434 1039 HB2 ASP 80 2HB ASP 80 -8.189 -11.406 -0.837 1040 HB3 ASP 80 3HB ASP 80 -8.418 -9.817 -0.112 1041 H HIS 81 HN HIS 81 -9.754 -12.958 2.156 1042 HA HIS 81 HA HIS 81 -10.133 -15.331 0.470 1043 HD1 HIS 81 1HD HIS 81 -7.821 -15.911 4.590 1044 HD2 HIS 81 2HD HIS 81 -7.747 -15.167 0.458 1045 HE1 HIS 81 1HE HIS 81 -5.439 -15.770 3.981 1046 HB2 HIS 81 2HB HIS 81 -10.089 -14.982 3.504 1047 HB3 HIS 81 3HB HIS 81 -10.143 -16.519 2.655 1048 H LEU 82 HN LEU 82 -12.105 -13.233 2.596 1049 HA LEU 82 HA LEU 82 -14.412 -14.952 2.693 1050 HG LEU 82 HG LEU 82 -16.430 -13.922 3.495 1051 HB2 LEU 82 2HB LEU 82 -13.988 -13.026 4.181 1052 HB3 LEU 82 3HB LEU 82 -14.273 -11.909 2.846 1053 HD11 LEU 82 1HD1 LEU 82 -17.330 -12.463 5.205 1054 HD12 LEU 82 2HD1 LEU 82 -15.991 -11.316 4.991 1055 HD13 LEU 82 3HD1 LEU 82 -15.695 -12.984 5.599 1056 HD21 LEU 82 3HD2 LEU 82 -17.937 -12.041 2.895 1057 HD22 LEU 82 1HD2 LEU 82 -16.850 -12.385 1.563 1058 HD23 LEU 82 2HD2 LEU 82 -16.535 -10.990 2.609 1059 H LYS 83 HN LYS 83 -13.557 -12.179 0.519 1060 HA LYS 83 HA LYS 83 -15.883 -12.406 -1.178 1061 HB2 LYS 83 2HB LYS 83 -14.202 -10.478 -1.064 1062 HB3 LYS 83 3HB LYS 83 -13.085 -11.494 -1.990 1063 HG2 LYS 83 2HG LYS 83 -15.118 -11.688 -3.690 1064 HG3 LYS 83 3HG LYS 83 -15.743 -10.287 -2.832 1065 HD2 LYS 83 2HD LYS 83 -13.093 -10.503 -4.343 1066 HD3 LYS 83 3HD LYS 83 -14.555 -9.679 -4.875 1067 HE2 LYS 83 2HE LYS 83 -13.236 -7.926 -4.124 1068 HE3 LYS 83 3HE LYS 83 -14.328 -8.212 -2.763 1069 HZ1 LYS 83 3HZ LYS 83 -12.070 -7.968 -2.027 1070 HZ2 LYS 83 1HZ LYS 83 -11.553 -9.194 -3.013 1071 HZ3 LYS 83 2HZ LYS 83 -12.557 -9.510 -1.741 1072 H THR 84 HN THR 84 -12.654 -13.967 -1.220 1073 HA THR 84 HA THR 84 -12.973 -15.370 -3.694 1074 HB THR 84 HB THR 84 -11.433 -16.059 -1.162 1075 HG1 THR 84 1HG THR 84 -10.665 -14.226 -2.000 1076 HG21 THR 84 3HG2 THR 84 -11.131 -17.284 -3.892 1077 HG22 THR 84 1HG2 THR 84 -11.577 -18.125 -2.380 1078 HG23 THR 84 2HG2 THR 84 -9.965 -17.414 -2.528 1079 H HIS 85 HN HIS 85 -13.626 -16.380 -0.289 1080 HA HIS 85 HA HIS 85 -14.739 -18.935 -0.914 1081 HD1 HIS 85 1HD HIS 85 -16.064 -20.729 1.480 1082 HD2 HIS 85 2HD HIS 85 -17.264 -16.725 2.112 1083 HE1 HIS 85 1HE HIS 85 -18.529 -20.773 2.261 1084 HB2 HIS 85 2HB HIS 85 -14.106 -18.652 1.330 1085 HB3 HIS 85 3HB HIS 85 -14.817 -17.050 1.440 1086 H THR 86 HN THR 86 -16.138 -15.677 -0.798 1087 HA THR 86 HA THR 86 -18.894 -16.247 -0.808 1088 HB THR 86 HB THR 86 -17.443 -14.070 -2.363 1089 HG1 THR 86 1HG THR 86 -17.095 -14.160 -0.033 1090 HG21 THR 86 3HG2 THR 86 -20.301 -14.065 -1.429 1091 HG22 THR 86 1HG2 THR 86 -19.737 -14.108 -3.128 1092 HG23 THR 86 2HG2 THR 86 -19.357 -12.708 -2.106 1093 H ARG 87 HN ARG 87 -16.496 -16.441 -3.461 1094 HA ARG 87 HA ARG 87 -18.353 -16.640 -5.642 1095 HE ARG 87 HE ARG 87 -14.754 -13.770 -7.485 1096 HB2 ARG 87 2HB ARG 87 -15.557 -17.831 -5.382 1097 HB3 ARG 87 3HB ARG 87 -16.456 -17.623 -6.872 1098 HG2 ARG 87 2HG ARG 87 -16.475 -15.137 -6.502 1099 HG3 ARG 87 3HG ARG 87 -15.484 -15.372 -5.064 1100 HD2 ARG 87 2HD ARG 87 -13.680 -16.320 -6.340 1101 HD3 ARG 87 3HD ARG 87 -14.641 -16.296 -7.829 1102 HH11 ARG 87 1HH1 ARG 87 -11.841 -15.681 -6.917 1103 HH12 ARG 87 2HH1 ARG 87 -10.828 -14.244 -6.812 1104 HH21 ARG 87 1HH2 ARG 87 -13.406 -12.066 -7.550 1105 HH22 ARG 87 2HH2 ARG 87 -11.679 -12.257 -7.315 1106 H THR 88 HN THR 88 -17.411 -18.918 -3.160 1107 HA THR 88 HA THR 88 -17.921 -21.427 -4.413 1108 HB THR 88 HB THR 88 -18.693 -20.663 -1.568 1109 HG1 THR 88 1HG THR 88 -16.765 -20.087 -1.574 1110 HG21 THR 88 3HG2 THR 88 -18.019 -23.009 -1.051 1111 HG22 THR 88 1HG2 THR 88 -17.900 -23.310 -2.800 1112 HG23 THR 88 2HG2 THR 88 -19.461 -22.881 -2.076 1113 H HIS 89 HN HIS 89 -20.176 -19.038 -2.911 1114 HA HIS 89 HA HIS 89 -22.501 -20.798 -3.512 1115 HD1 HIS 89 1HD HIS 89 -20.625 -17.347 -1.445 1116 HD2 HIS 89 2HD HIS 89 -22.901 -20.445 0.271 1117 HE1 HIS 89 1HE HIS 89 -19.905 -17.496 0.978 1118 HB2 HIS 89 2HB HIS 89 -22.926 -17.992 -2.600 1119 HB3 HIS 89 3HB HIS 89 -23.713 -19.470 -2.092 1120 H THR 90 HN THR 90 -20.740 -18.126 -4.884 1121 HA THR 90 HA THR 90 -22.988 -17.179 -6.520 1122 HB THR 90 HB THR 90 -20.086 -16.319 -6.721 1123 HG1 THR 90 1HG THR 90 -20.648 -16.177 -4.503 1124 HG21 THR 90 3HG2 THR 90 -20.990 -14.079 -7.143 1125 HG22 THR 90 1HG2 THR 90 -22.644 -14.721 -7.050 1126 HG23 THR 90 2HG2 THR 90 -21.554 -15.218 -8.364 1127 H GLY 91 HN GLY 91 -20.995 -19.817 -6.813 1128 HA2 GLY 91 2HA GLY 91 -19.976 -21.000 -8.549 1129 HA3 GLY 91 3HA GLY 91 -21.356 -20.415 -9.498 1130 H GLU 92 HN GLU 92 -19.139 -18.040 -8.200 1131 HA GLU 92 HA GLU 92 -18.751 -16.991 -10.860 1132 HB2 GLU 92 2HB GLU 92 -19.125 -15.617 -8.827 1133 HB3 GLU 92 3HB GLU 92 -17.570 -16.107 -8.191 1134 HG2 GLU 92 2HG GLU 92 -16.469 -14.980 -10.161 1135 HG3 GLU 92 3HG GLU 92 -18.066 -14.483 -10.723 1136 H LYS 93 HN LYS 93 -17.549 -18.672 -11.928 1137 HA LYS 93 HA LYS 93 -14.683 -18.838 -11.120 1138 HB2 LYS 93 2HB LYS 93 -16.373 -20.578 -12.952 1139 HB3 LYS 93 3HB LYS 93 -14.662 -20.852 -12.604 1140 HG2 LYS 93 2HG LYS 93 -15.124 -21.243 -10.251 1141 HG3 LYS 93 3HG LYS 93 -16.826 -20.829 -10.447 1142 HD2 LYS 93 2HD LYS 93 -15.399 -23.215 -11.683 1143 HD3 LYS 93 3HD LYS 93 -16.491 -23.256 -10.304 1144 HE2 LYS 93 2HE LYS 93 -17.257 -22.463 -13.148 1145 HE3 LYS 93 3HE LYS 93 -17.574 -24.025 -12.388 1146 HZ1 LYS 93 3HZ LYS 93 -18.671 -21.434 -11.481 1147 HZ2 LYS 93 1HZ LYS 93 -18.939 -22.893 -10.762 1148 HZ3 LYS 93 2HZ LYS 93 -19.494 -22.608 -12.285 1149 HA PRO 94 HA PRO 94 -14.583 -16.238 -14.932 1150 HB2 PRO 94 2HB PRO 94 -13.037 -14.178 -14.063 1151 HB3 PRO 94 3HB PRO 94 -14.745 -14.346 -13.552 1152 HG2 PRO 94 2HG PRO 94 -12.258 -15.219 -12.037 1153 HG3 PRO 94 3HG PRO 94 -13.634 -14.246 -11.429 1154 HD2 PRO 94 2HD PRO 94 -13.460 -16.953 -11.064 1155 HD3 PRO 94 3HD PRO 94 -15.022 -16.099 -11.293 1156 H PHE 95 HN PHE 95 -12.047 -17.681 -12.932 1157 HA PHE 95 HA PHE 95 -9.869 -16.996 -14.797 1158 HD1 PHE 95 2HD PHE 95 -7.792 -16.006 -13.284 1159 HD2 PHE 95 1HD PHE 95 -10.835 -17.622 -10.709 1160 HE1 PHE 95 2HE PHE 95 -7.544 -14.054 -11.767 1161 HE2 PHE 95 1HE PHE 95 -10.591 -15.675 -9.191 1162 HZ PHE 95 HZ PHE 95 -8.937 -13.893 -9.712 1163 HB2 PHE 95 2HB PHE 95 -9.915 -18.975 -12.466 1164 HB3 PHE 95 3HB PHE 95 -8.506 -18.417 -13.349 1165 H SER 96 HN SER 96 -10.973 -17.857 -16.735 1166 HA SER 96 HA SER 96 -11.222 -20.761 -17.037 1167 HG SER 96 HG SER 96 -10.807 -20.543 -20.070 1168 HB2 SER 96 2HB SER 96 -12.647 -19.201 -18.313 1169 HB3 SER 96 3HB SER 96 -11.217 -18.495 -19.080 1170 H CYS 97 HN CYS 97 -9.885 -22.154 -18.146 1171 HA CYS 97 HA CYS 97 -7.099 -21.444 -18.445 1172 HB2 CYS 97 2HB CYS 97 -8.098 -23.779 -17.969 1173 HB3 CYS 97 3HB CYS 97 -8.514 -23.831 -19.681 1174 H ARG 98 HN ARG 98 -5.930 -21.471 -20.445 1175 HA ARG 98 HA ARG 98 -7.548 -20.464 -22.757 1176 HE ARG 98 HE ARG 98 -8.100 -16.008 -21.480 1177 HB2 ARG 98 2HB ARG 98 -5.114 -19.305 -21.375 1178 HB3 ARG 98 3HB ARG 98 -5.247 -19.112 -23.110 1179 HG2 ARG 98 2HG ARG 98 -6.102 -17.163 -22.191 1180 HG3 ARG 98 3HG ARG 98 -7.467 -18.045 -22.869 1181 HD2 ARG 98 2HD ARG 98 -8.242 -18.655 -20.645 1182 HD3 ARG 98 3HD ARG 98 -6.762 -18.009 -19.903 1183 HH11 ARG 98 1HH1 ARG 98 -8.487 -17.540 -18.314 1184 HH12 ARG 98 2HH1 ARG 98 -9.152 -16.059 -17.627 1185 HH21 ARG 98 1HH2 ARG 98 -9.031 -14.257 -20.548 1186 HH22 ARG 98 2HH2 ARG 98 -9.509 -14.308 -18.866 1187 H TRP 99 HN TRP 99 -5.907 -23.064 -21.783 1188 HA TRP 99 HA TRP 99 -3.839 -23.427 -23.733 1189 HD1 TRP 99 1HD TRP 99 -3.900 -23.369 -20.368 1190 HE1 TRP 99 1HE TRP 99 -1.550 -23.651 -19.406 1191 HE3 TRP 99 3HE TRP 99 -2.197 -27.023 -23.517 1192 HZ2 TRP 99 2HZ TRP 99 0.803 -25.227 -19.967 1193 HZ3 TRP 99 3HZ TRP 99 0.136 -27.848 -23.320 1194 HH2 TRP 99 2HH TRP 99 1.636 -26.973 -21.551 1195 HB2 TRP 99 2HB TRP 99 -5.437 -25.228 -21.899 1196 HB3 TRP 99 3HB TRP 99 -4.477 -25.955 -23.174 1197 HA PRO 100 HA PRO 100 -6.030 -24.077 -27.433 1198 HB2 PRO 100 2HB PRO 100 -4.423 -25.871 -28.809 1199 HB3 PRO 100 3HB PRO 100 -3.963 -24.185 -28.453 1200 HG2 PRO 100 2HG PRO 100 -3.229 -26.674 -26.879 1201 HG3 PRO 100 3HG PRO 100 -2.137 -25.382 -27.480 1202 HD2 PRO 100 2HD PRO 100 -3.040 -25.358 -24.939 1203 HD3 PRO 100 3HD PRO 100 -2.946 -23.832 -25.870 1204 H SER 101 HN SER 101 -6.144 -26.427 -25.099 1205 HA SER 101 HA SER 101 -8.198 -27.940 -26.585 1206 HG SER 101 HG SER 101 -6.454 -29.587 -24.079 1207 HB2 SER 101 2HB SER 101 -7.295 -30.101 -26.101 1208 HB3 SER 101 3HB SER 101 -5.977 -29.179 -26.838 1209 H CYS 102 HN CYS 102 -8.332 -25.932 -24.473 1210 HA CYS 102 HA CYS 102 -9.729 -27.566 -22.431 1211 HB2 CYS 102 2HB CYS 102 -7.365 -27.134 -21.613 1212 HB3 CYS 102 3HB CYS 102 -7.730 -25.397 -21.644 1213 H GLN 103 HN GLN 103 -11.003 -26.180 -20.935 1214 HA GLN 103 HA GLN 103 -11.516 -23.421 -21.605 1215 HB2 GLN 103 2HB GLN 103 -13.851 -23.600 -22.280 1216 HB3 GLN 103 3HB GLN 103 -12.850 -24.456 -23.419 1217 HG2 GLN 103 2HG GLN 103 -14.001 -26.354 -23.142 1218 HG3 GLN 103 3HG GLN 103 -13.704 -26.376 -21.411 1219 HE21 GLN 103 1HE2 GLN 103 -15.153 -24.397 -20.284 1220 HE22 GLN 103 2HE2 GLN 103 -16.863 -24.596 -20.776 1221 H LYS 104 HN LYS 104 -10.837 -25.358 -19.339 1222 HA LYS 104 HA LYS 104 -13.224 -25.451 -17.615 1223 HB2 LYS 104 2HB LYS 104 -10.305 -26.265 -17.290 1224 HB3 LYS 104 3HB LYS 104 -11.442 -26.318 -15.933 1225 HG2 LYS 104 2HG LYS 104 -12.894 -27.859 -17.019 1226 HG3 LYS 104 3HG LYS 104 -12.099 -27.679 -18.580 1227 HD2 LYS 104 2HD LYS 104 -10.680 -28.865 -16.160 1228 HD3 LYS 104 3HD LYS 104 -11.630 -29.820 -17.316 1229 HE2 LYS 104 2HE LYS 104 -10.208 -28.828 -19.180 1230 HE3 LYS 104 3HE LYS 104 -9.169 -28.138 -17.950 1231 HZ1 LYS 104 3HZ LYS 104 -8.808 -30.412 -17.127 1232 HZ2 LYS 104 1HZ LYS 104 -8.333 -30.228 -18.697 1233 HZ3 LYS 104 2HZ LYS 104 -9.739 -31.011 -18.346 1234 H LYS 105 HN LYS 105 -13.511 -24.304 -15.680 1235 HA LYS 105 HA LYS 105 -11.904 -21.791 -15.546 1236 HB2 LYS 105 2HB LYS 105 -14.902 -21.927 -15.050 1237 HB3 LYS 105 3HB LYS 105 -13.857 -20.521 -15.330 1238 HG2 LYS 105 2HG LYS 105 -13.415 -21.542 -17.665 1239 HG3 LYS 105 3HG LYS 105 -14.807 -22.586 -17.336 1240 HD2 LYS 105 2HD LYS 105 -16.163 -20.470 -16.927 1241 HD3 LYS 105 3HD LYS 105 -14.773 -19.546 -17.504 1242 HE2 LYS 105 2HE LYS 105 -16.463 -21.559 -19.040 1243 HE3 LYS 105 3HE LYS 105 -16.294 -19.827 -19.352 1244 HZ1 LYS 105 3HZ LYS 105 -14.233 -21.905 -19.732 1245 HZ2 LYS 105 1HZ LYS 105 -13.929 -20.307 -19.888 1246 HZ3 LYS 105 2HZ LYS 105 -14.994 -21.044 -20.912 1247 H PHE 106 HN PHE 106 -11.485 -20.888 -13.615 1248 HA PHE 106 HA PHE 106 -12.405 -22.411 -11.190 1249 HD1 PHE 106 1HD PHE 106 -10.463 -24.454 -10.245 1250 HD2 PHE 106 2HD PHE 106 -9.242 -22.321 -13.786 1251 HE1 PHE 106 1HE PHE 106 -10.052 -26.607 -11.405 1252 HE2 PHE 106 2HE PHE 106 -8.894 -24.466 -14.969 1253 HZ PHE 106 HZ PHE 106 -9.324 -26.614 -13.787 1254 HB2 PHE 106 2HB PHE 106 -9.674 -21.125 -11.674 1255 HB3 PHE 106 3HB PHE 106 -10.184 -21.991 -10.226 1256 H ALA 107 HN ALA 107 -12.476 -21.184 -9.194 1257 HA ALA 107 HA ALA 107 -13.251 -18.383 -9.692 1258 HB1 ALA 107 1HB ALA 107 -14.185 -18.552 -7.383 1259 HB2 ALA 107 2HB ALA 107 -14.786 -19.844 -8.423 1260 HB3 ALA 107 3HB ALA 107 -13.511 -20.182 -7.229 1261 H ARG 108 HN ARG 108 -10.365 -19.859 -9.041 1262 HA ARG 108 HA ARG 108 -9.375 -17.443 -7.603 1263 HE ARG 108 HE ARG 108 -7.345 -20.274 -4.832 1264 HB2 ARG 108 2HB ARG 108 -8.717 -20.334 -6.994 1265 HB3 ARG 108 3HB ARG 108 -7.751 -18.966 -6.431 1266 HG2 ARG 108 2HG ARG 108 -9.469 -18.145 -5.064 1267 HG3 ARG 108 3HG ARG 108 -10.719 -19.166 -5.803 1268 HD2 ARG 108 2HD ARG 108 -10.060 -19.972 -3.581 1269 HD3 ARG 108 3HD ARG 108 -9.789 -21.167 -4.847 1270 HH11 ARG 108 2HH1 ARG 108 -9.256 -20.535 -1.896 1271 HH12 ARG 108 1HH1 ARG 108 -7.816 -20.660 -0.908 1272 HH21 ARG 108 1HH2 ARG 108 -5.646 -20.217 -3.574 1273 HH22 ARG 108 2HH2 ARG 108 -5.808 -20.334 -1.816 1274 H SER 109 HN SER 109 -7.500 -16.621 -8.348 1275 HA SER 109 HA SER 109 -6.599 -17.267 -10.946 1276 HG SER 109 HG SER 109 -5.766 -14.587 -8.270 1277 HB2 SER 109 2HB SER 109 -4.540 -15.850 -10.166 1278 HB3 SER 109 3HB SER 109 -6.119 -15.078 -10.228 1279 H ASP 110 HN ASP 110 -5.344 -18.227 -7.714 1280 HA ASP 110 HA ASP 110 -2.986 -19.554 -8.763 1281 HB2 ASP 110 2HB ASP 110 -2.967 -20.609 -6.445 1282 HB3 ASP 110 3HB ASP 110 -2.785 -18.871 -6.570 1283 H GLU 111 HN GLU 111 -6.359 -20.570 -8.059 1284 HA GLU 111 HA GLU 111 -5.955 -23.406 -8.303 1285 HB2 GLU 111 2HB GLU 111 -8.353 -21.591 -8.738 1286 HB3 GLU 111 3HB GLU 111 -8.411 -23.285 -9.172 1287 HG2 GLU 111 2HG GLU 111 -7.867 -23.992 -6.914 1288 HG3 GLU 111 3HG GLU 111 -7.770 -22.318 -6.376 1289 H LEU 112 HN LEU 112 -6.634 -20.807 -10.707 1290 HA LEU 112 HA LEU 112 -6.617 -22.584 -12.986 1291 HG LEU 112 HG LEU 112 -5.107 -20.539 -14.871 1292 HB2 LEU 112 2HB LEU 112 -7.598 -20.378 -13.115 1293 HB3 LEU 112 3HB LEU 112 -6.046 -19.596 -12.766 1294 HD11 LEU 112 1HD1 LEU 112 -7.947 -21.479 -15.480 1295 HD12 LEU 112 2HD1 LEU 112 -6.579 -22.559 -15.099 1296 HD13 LEU 112 3HD1 LEU 112 -6.524 -21.571 -16.524 1297 HD21 LEU 112 3HD2 LEU 112 -7.661 -19.017 -15.414 1298 HD22 LEU 112 1HD2 LEU 112 -6.218 -19.109 -16.430 1299 HD23 LEU 112 2HD2 LEU 112 -6.130 -18.290 -14.861 1300 H VAL 113 HN VAL 113 -4.037 -20.637 -11.349 1301 HA VAL 113 HA VAL 113 -1.895 -21.232 -13.126 1302 HB VAL 113 HB VAL 113 -1.893 -20.822 -10.104 1303 HG11 VAL 113 1HG1 VAL 113 0.174 -21.981 -10.592 1304 HG12 VAL 113 2HG1 VAL 113 0.488 -20.916 -11.979 1305 HG13 VAL 113 3HG1 VAL 113 0.525 -20.277 -10.322 1306 HG21 VAL 113 3HG2 VAL 113 -2.566 -18.856 -11.664 1307 HG22 VAL 113 1HG2 VAL 113 -1.254 -18.570 -10.507 1308 HG23 VAL 113 2HG2 VAL 113 -0.906 -18.891 -12.217 1309 H ARG 114 HN ARG 114 -3.098 -23.068 -10.275 1310 HA ARG 114 HA ARG 114 -1.224 -25.247 -10.504 1311 HE ARG 114 HE ARG 114 -1.892 -26.136 -6.660 1312 HB2 ARG 114 2HB ARG 114 -2.586 -24.793 -8.490 1313 HB3 ARG 114 3HB ARG 114 -4.064 -25.196 -9.365 1314 HG2 ARG 114 2HG ARG 114 -3.277 -27.520 -9.677 1315 HG3 ARG 114 3HG ARG 114 -1.754 -27.136 -8.866 1316 HD2 ARG 114 2HD ARG 114 -4.506 -26.875 -7.571 1317 HD3 ARG 114 3HD ARG 114 -3.480 -28.316 -7.446 1318 HH11 ARG 114 1HH1 ARG 114 -4.791 -27.715 -5.387 1319 HH12 ARG 114 2HH1 ARG 114 -4.333 -27.422 -3.737 1320 HH21 ARG 114 2HH2 ARG 114 -1.404 -25.712 -4.533 1321 HH22 ARG 114 1HH2 ARG 114 -2.563 -26.187 -3.292 1322 H HIS 115 HN HIS 115 -4.659 -24.947 -11.620 1323 HA HIS 115 HA HIS 115 -4.886 -27.279 -13.007 1324 HD1 HIS 115 1HD HIS 115 -6.982 -28.240 -14.281 1325 HD2 HIS 115 2HD HIS 115 -6.261 -24.692 -16.443 1326 HE1 HIS 115 1HE HIS 115 -7.444 -28.741 -16.745 1327 HB2 HIS 115 2HB HIS 115 -6.733 -25.736 -12.830 1328 HB3 HIS 115 3HB HIS 115 -5.915 -24.538 -13.838 1329 H HIS 116 HN HIS 116 -3.438 -24.263 -14.351 1330 HA HIS 116 HA HIS 116 -2.839 -25.272 -16.939 1331 HD1 HIS 116 1HD HIS 116 -4.300 -23.634 -17.910 1332 HD2 HIS 116 2HD HIS 116 -1.855 -20.688 -16.072 1333 HE1 HIS 116 1HE HIS 116 -5.113 -21.427 -18.675 1334 HB2 HIS 116 2HB HIS 116 -1.468 -23.199 -15.190 1335 HB3 HIS 116 3HB HIS 116 -0.930 -23.568 -16.818 1336 H ASN 117 HN ASN 117 -1.181 -25.748 -13.811 1337 HA ASN 117 HA ASN 117 1.283 -26.816 -14.912 1338 HB2 ASN 117 2HB ASN 117 0.707 -25.915 -12.499 1339 HB3 ASN 117 3HB ASN 117 0.184 -27.568 -12.183 1340 HD21 ASN 117 1HD2 ASN 117 2.250 -28.995 -13.691 1341 HD22 ASN 117 2HD2 ASN 117 3.751 -28.608 -12.807 1342 H MET 118 HN MET 118 -1.954 -28.095 -14.573 1343 HA MET 118 HA MET 118 -1.168 -30.929 -14.551 1344 HB2 MET 118 2HB MET 118 -3.870 -29.729 -15.304 1345 HB3 MET 118 3HB MET 118 -3.527 -31.378 -14.836 1346 HG2 MET 118 2HG MET 118 -2.977 -30.693 -12.557 1347 HG3 MET 118 3HG MET 118 -3.213 -28.995 -12.980 1348 HE1 MET 118 3HE MET 118 -4.854 -28.610 -10.961 1349 HE2 MET 118 1HE MET 118 -6.231 -29.672 -10.597 1350 HE3 MET 118 2HE MET 118 -4.572 -30.300 -10.478 1351 H HIS 119 HN HIS 119 -1.470 -28.394 -16.928 1352 HA HIS 119 HA HIS 119 -1.788 -30.302 -19.181 1353 HD1 HIS 119 1HD HIS 119 -3.892 -29.940 -20.635 1354 HD2 HIS 119 2HD HIS 119 -3.935 -26.201 -18.687 1355 HE1 HIS 119 1HE HIS 119 -6.338 -29.143 -20.566 1356 HB2 HIS 119 2HB HIS 119 -1.551 -27.266 -19.030 1357 HB3 HIS 119 3HB HIS 119 -1.557 -28.181 -20.528 Start of MODEL 20 1 H5 DC 124 5H C 124 -3.997 -31.359 -5.054 2 H6 DC 124 6H C 124 -5.909 -31.033 -6.537 3 H5' DC 124 H5' C 124 -9.006 -32.521 -9.777 4 H5'' DC 124 H5" C 124 -7.563 -32.305 -8.758 5 H4' DC 124 H4' C 124 -10.435 -32.464 -7.734 6 H3' DC 124 H3' C 124 -9.171 -30.304 -8.974 7 H2' DC 124 H2' C 124 -7.416 -30.068 -7.478 8 H2'' DC 124 H2" C 124 -8.591 -29.032 -6.620 9 H1' DC 124 H1' C 124 -9.402 -30.807 -5.258 10 H41 DC 124 1H4 C 124 -4.512 -32.233 -1.509 11 H42 DC 124 2H4 C 124 -3.360 -31.911 -2.791 12 H8 DG 125 8H G 125 -9.140 -26.924 -5.641 13 H1 DG 125 1H G 125 -6.427 -29.087 -0.239 14 H5' DG 125 H5' G 125 -12.882 -29.651 -6.366 15 H5'' DG 125 H5" G 125 -13.990 -28.333 -6.808 16 H4' DG 125 H4' G 125 -13.772 -28.558 -4.345 17 H3' DG 125 H3' G 125 -13.376 -26.112 -5.749 18 H2' DG 125 H2' G 125 -11.106 -25.955 -5.279 19 H2'' DG 125 H2" G 125 -11.677 -25.238 -3.743 20 H1' DG 125 H1' G 125 -11.542 -27.363 -2.596 21 H21 DG 125 1H2 G 125 -7.934 -29.297 1.320 22 H22 DG 125 2H2 G 125 -9.632 -28.958 1.023 23 H5 DC 126 5H C 126 -8.050 -23.980 -4.405 24 H6 DC 126 6H C 126 -10.016 -23.531 -2.996 25 H5' DC 126 H5' C 126 -13.753 -26.097 -1.195 26 H5'' DC 126 H5" C 126 -14.686 -24.753 -0.511 27 H4' DC 126 H4' C 126 -12.718 -25.187 0.861 28 H3' DC 126 H3' C 126 -13.310 -22.648 -0.286 29 H2' DC 126 H2' C 126 -11.379 -22.699 -1.664 30 H2'' DC 126 H2" C 126 -10.657 -21.929 -0.226 31 H1' DC 126 H1' C 126 -10.032 -24.163 0.712 32 H41 DC 126 1H4 C 126 -4.974 -25.367 -2.944 33 H42 DC 126 2H4 C 126 -5.793 -24.856 -4.405 34 H8 DG 127 8H G 127 -9.647 -21.609 1.674 35 H1 DG 127 1H G 127 -3.448 -22.966 0.626 36 H5' DG 127 H5' G 127 -11.996 -23.719 3.813 37 H5'' DG 127 H5" G 127 -12.546 -22.724 5.167 38 H4' DG 127 H4' G 127 -10.460 -23.804 5.817 39 H3' DG 127 H3' G 127 -10.705 -20.973 5.704 40 H2' DG 127 H2' G 127 -9.227 -20.527 4.074 41 H2'' DG 127 H2" G 127 -7.971 -20.796 5.330 42 H1' DG 127 H1' G 127 -7.631 -23.030 4.683 43 H21 DG 127 1H2 G 127 -2.455 -23.320 2.531 44 H22 DG 127 2H2 G 127 -3.288 -23.106 4.062 45 H8 DG 128 8H G 128 -7.473 -18.667 4.188 46 H1 DG 128 1H G 128 -2.646 -19.803 0.076 47 H5' DG 128 H5' G 128 -6.807 -21.899 7.688 48 H5'' DG 128 H5" G 128 -6.657 -21.024 9.218 49 H4' DG 128 H4' G 128 -4.604 -20.706 8.118 50 H3' DG 128 H3' G 128 -6.213 -18.449 8.599 51 H2' DG 128 H2' G 128 -6.764 -18.145 6.322 52 H2'' DG 128 H2" G 128 -5.271 -17.141 6.403 53 H1' DG 128 H1' G 128 -3.893 -19.036 5.754 54 H21 DG 128 1H2 G 128 -0.796 -20.075 1.172 55 H22 DG 128 2H2 G 128 -0.775 -20.201 2.920 56 H8 DG 129 8H G 129 -3.345 -16.242 5.619 57 H1 DG 129 1H G 129 -0.942 -16.697 -0.305 58 H5' DG 129 H5' G 129 -1.516 -18.344 8.712 59 H5'' DG 129 H5" G 129 -0.925 -17.224 9.927 60 H4' DG 129 H4' G 129 0.681 -17.265 8.148 61 H3' DG 129 H3' G 129 -0.669 -14.852 8.778 62 H2' DG 129 H2' G 129 -1.906 -14.844 6.785 63 H2'' DG 129 H2" G 129 -0.461 -14.013 6.165 64 H1' DG 129 H1' G 129 0.509 -16.101 5.346 65 H21 DG 129 1H2 G 129 1.190 -16.451 -0.285 66 H22 DG 129 2H2 G 129 2.091 -16.293 1.214 67 H8 DG 130 8H G 130 0.563 -13.440 4.258 68 H1 DG 130 1H G 130 -0.648 -12.869 -2.004 69 H5' DG 130 H5' G 130 2.969 -15.470 5.672 70 H5'' DG 130 H5" G 130 4.057 -14.539 6.713 71 H4' DG 130 H4' G 130 5.080 -14.456 4.619 72 H3' DG 130 H3' G 130 4.204 -12.100 5.867 73 H2' DG 130 H2' G 130 2.379 -11.784 4.505 74 H2'' DG 130 H2" G 130 3.507 -10.983 3.456 75 H1' DG 130 H1' G 130 3.687 -12.819 2.000 76 H21 DG 130 1H2 G 130 1.143 -12.372 -3.108 77 H22 DG 130 2H2 G 130 2.673 -12.071 -2.293 78 H8 DG 131 8H G 131 2.598 -9.619 2.325 79 H1 DG 131 1H G 131 -1.898 -9.434 -2.222 80 H5' DG 131 H5' G 131 5.921 -11.782 1.645 81 H5'' DG 131 H5" G 131 7.333 -10.735 1.882 82 H4' DG 131 H4' G 131 6.620 -10.313 -0.320 83 H3' DG 131 H3' G 131 6.556 -8.179 1.553 84 H2' DG 131 H2' G 131 4.220 -8.103 1.654 85 H2'' DG 131 H2" G 131 4.399 -7.060 0.249 86 H1' DG 131 H1' G 131 3.881 -8.862 -1.281 87 H21 DG 131 1H2 G 131 -1.016 -8.870 -4.137 88 H22 DG 131 2H2 G 131 0.682 -8.442 -4.287 89 H5 DC 132 5H C 132 1.324 -6.477 1.598 90 H6 DC 132 6H C 132 2.815 -5.812 -0.228 91 H5' DC 132 H5' C 132 5.210 -7.667 -2.876 92 H5'' DC 132 H5" C 132 6.281 -6.415 -3.550 93 H4' DC 132 H4' C 132 4.197 -6.095 -4.670 94 H3' DC 132 H3' C 132 5.272 -4.079 -2.895 95 H2' DC 132 H2' C 132 3.501 -4.206 -1.422 96 H2'' DC 132 H2" C 132 2.697 -3.165 -2.590 97 H1' DC 132 H1' C 132 1.571 -4.999 -3.657 98 H41 DC 132 1H4 C 132 -2.315 -6.653 1.072 99 H42 DC 132 2H4 C 132 -0.982 -6.945 2.167 100 H8 DG 133 8H G 133 1.242 -1.812 -3.110 101 H1 DG 133 1H G 133 -4.959 -2.632 -1.552 102 H5' DG 133 H5' G 133 2.708 -3.295 -6.631 103 H5'' DG 133 H5" G 133 3.366 -1.839 -7.386 104 H4' DG 133 H4' G 133 1.031 -2.099 -8.009 105 H3' DG 133 H3' G 133 2.089 0.228 -6.956 106 H2' DG 133 H2' G 133 1.305 -0.222 -4.769 107 H2'' DG 133 H2" G 133 -0.011 0.778 -5.336 108 H1' DG 133 H1' G 133 -1.341 -1.174 -5.970 109 H21 DG 133 1H2 G 133 -6.234 -2.380 -3.312 110 H22 DG 133 2H2 G 133 -5.577 -1.964 -4.880 111 H5' DT 134 H5' T 134 -2.551 -0.166 -7.198 112 H5'' DT 134 H5" T 134 -2.883 1.061 -8.410 113 H4' DT 134 H4' T 134 -4.779 1.122 -7.106 114 H3' DT 134 H3' T 134 -2.972 3.337 -7.178 115 H2' DT 134 H2' T 134 -2.367 3.288 -4.987 116 H2'' DT 134 H2" T 134 -3.882 4.173 -4.809 117 H1' DT 134 H1' T 134 -5.116 2.111 -4.256 118 H3 DT 134 3H T 134 -4.179 0.450 -0.192 119 H71 DT 134 1H7 T 134 0.602 0.991 -2.537 120 H72 DT 134 2H7 T 134 0.314 2.436 -1.542 121 H73 DT 134 3H7 T 134 0.399 0.840 -0.780 122 H6 DT 134 6H T 134 -1.422 1.705 -3.915 123 H5 DC 135 5H C 135 -3.605 4.964 -2.734 124 H6 DC 135 6H C 135 -5.468 5.390 -4.245 125 H5' DC 135 H5' C 135 -7.426 3.633 -7.316 126 H5'' DC 135 H5" C 135 -8.186 5.022 -8.053 127 H4' DC 135 H4' C 135 -9.579 4.223 -6.254 128 H3' DC 135 H3' C 135 -8.650 6.862 -6.464 129 H2' DC 135 H2' C 135 -7.007 6.610 -4.816 130 H2'' DC 135 H2" C 135 -8.284 7.213 -3.777 131 H1' DC 135 H1' C 135 -9.041 4.949 -3.208 132 H41 DC 135 1H4 C 135 -4.154 3.471 0.540 133 H42 DC 135 2H4 C 135 -3.011 4.087 -0.622 134 H5' DT 136 H5' T 136 -10.888 5.293 -2.465 135 H5'' DT 136 H5" T 136 -12.361 6.161 -2.920 136 H4' DT 136 H4' T 136 -12.480 6.112 -0.598 137 H3' DT 136 H3' T 136 -12.265 8.592 -1.860 138 H2' DT 136 H2' T 136 -10.110 9.084 -1.366 139 H2'' DT 136 H2" T 136 -10.715 9.631 0.158 140 H1' DT 136 H1' T 136 -10.236 7.678 1.375 141 H3 DT 136 3H T 136 -5.903 6.455 1.822 142 H71 DT 136 1H7 T 136 -5.255 7.690 -2.755 143 H72 DT 136 2H7 T 136 -6.576 8.868 -2.988 144 H73 DT 136 3H7 T 136 -5.169 9.294 -1.989 145 H6 DT 136 6H T 136 -8.457 8.258 -1.795 146 H8 DG 137 8H G 137 -9.633 10.370 1.707 147 H1 DG 137 1H G 137 -3.787 9.328 4.074 148 H5' DG 137 H5' G 137 -12.184 7.483 2.472 149 H5'' DG 137 H5" G 137 -13.617 8.259 3.150 150 H4' DG 137 H4' G 137 -12.275 7.923 4.995 151 H3' DG 137 H3' G 137 -12.908 10.544 4.191 152 H2' DG 137 H2' G 137 -10.858 11.102 3.385 153 H2'' DG 137 H2" G 137 -10.531 11.513 5.062 154 H1' DG 137 H1' G 137 -9.401 9.477 5.482 155 H21 DG 137 1H2 G 137 -3.893 8.845 6.184 156 H22 DG 137 2H2 G 137 -5.416 8.874 7.060 157 H5 DC 138 5H C 138 -8.528 13.170 4.047 158 H6 DC 138 6H C 138 -9.171 12.427 6.279 159 H5' DC 138 H5' C 138 -10.386 9.290 7.614 160 H5'' DC 138 H5" C 138 -11.305 9.791 9.037 161 H4' DC 138 H4' C 138 -9.112 9.561 9.825 162 H3' DC 138 H3' C 138 -10.397 12.035 9.913 163 H2' DC 138 H2' C 138 -9.288 13.104 8.218 164 H2'' DC 138 H2" C 138 -8.105 13.468 9.462 165 H1' DC 138 H1' C 138 -6.688 11.672 8.920 166 H41 DC 138 1H4 C 138 -5.014 13.201 3.021 167 H42 DC 138 2H4 C 138 -6.686 13.376 2.539 168 H8 DG 139 8H G 139 -6.401 14.571 9.616 169 H1 DG 139 1H G 139 -2.161 15.994 5.044 170 H5' DG 139 H5' G 139 -6.136 11.136 11.122 171 H5'' DG 139 H5" G 139 -6.221 11.372 12.870 172 H4' DG 139 H4' G 139 -3.937 11.527 12.387 173 H3' DG 139 H3' G 139 -5.203 13.744 13.517 174 H2' DG 139 H2' G 139 -5.390 14.953 11.561 175 H2'' DG 139 H2" G 139 -3.800 15.540 12.017 176 H1' DG 139 H1' G 139 -2.670 14.047 10.542 177 H21 DG 139 1H2 G 139 -0.158 15.410 5.649 178 H22 DG 139 2H2 G 139 0.175 14.813 7.267 179 H5 DC 140 5H C 140 -4.169 17.636 10.518 180 H6 DC 140 6H C 140 -2.155 16.807 11.625 181 H5' DC 140 H5' C 140 -0.783 13.423 12.178 182 H5'' DC 140 H5" C 140 0.149 13.767 13.645 183 H4' DC 140 H4' C 140 1.537 14.189 11.734 184 H3' DC 140 H3' C 140 1.235 16.042 13.753 185 H2' DC 140 H2' C 140 -0.333 17.395 12.641 186 H2'' DC 140 H2" C 140 1.156 18.194 12.084 187 H1' DC 140 H1' C 140 1.229 16.998 10.056 188 H41 DC 140 1H4 C 140 -4.026 18.988 7.124 189 H42 DC 140 2H4 C 140 -5.031 18.492 8.468 190 H8 DG 141 8H G 141 -3.452 21.524 0.848 191 H1 DG 141 1H G 141 -1.554 18.820 6.334 192 H5' DG 141 H5' G 141 -0.824 24.571 -0.598 193 H5'' DG 141 H5" G 141 -0.945 23.947 -2.253 194 H4' DG 141 H4' G 141 0.855 22.890 -0.919 195 H3' DG 141 H3' G 141 -0.885 21.448 -2.565 196 H2' DG 141 H2' G 141 -2.194 20.619 -0.828 197 H2'' DG 141 H2" G 141 -0.994 19.320 -0.818 198 H1' DG 141 H1' G 141 0.252 20.330 0.969 199 H21 DG 141 1H2 G 141 0.541 18.297 6.278 200 H22 DG 141 2H2 G 141 1.503 18.497 4.821 201 H5 DC 142 5H C 142 -2.646 17.655 0.394 202 H6 DC 142 6H C 142 -0.257 17.320 -0.009 203 H5' DC 142 H5' C 142 2.128 19.706 0.342 204 H5'' DC 142 H5" C 142 3.345 19.248 -0.852 205 H4' DC 142 H4' C 142 3.998 18.080 0.995 206 H3' DC 142 H3' C 142 3.217 16.590 -1.213 207 H2' DC 142 H2' C 142 1.174 15.919 -0.449 208 H2'' DC 142 H2" C 142 2.050 14.645 0.312 209 H1' DC 142 H1' C 142 1.996 15.630 2.452 210 H41 DC 142 1H4 C 142 -4.146 16.790 3.616 211 H42 DC 142 2H4 C 142 -4.372 17.519 2.043 212 H8 DG 143 8H G 143 1.571 12.975 1.304 213 H1 DG 143 1H G 143 -3.699 12.452 4.926 214 H5' DG 143 H5' G 143 4.315 15.336 3.325 215 H5'' DG 143 H5" G 143 5.760 14.403 2.904 216 H4' DG 143 H4' G 143 4.938 13.486 4.946 217 H3' DG 143 H3' G 143 5.324 11.926 2.680 218 H2' DG 143 H2' G 143 3.142 11.780 1.992 219 H2'' DG 143 H2" G 143 3.097 10.382 3.037 220 H1' DG 143 H1' G 143 2.124 11.561 4.849 221 H21 DG 143 1H2 G 143 -3.224 11.664 6.864 222 H22 DG 143 2H2 G 143 -1.578 11.237 7.308 223 H5 DC 144 5H C 144 0.819 9.690 2.004 224 H6 DC 144 6H C 144 1.790 8.835 4.080 225 H5' DC 144 H5' C 144 3.105 10.948 6.493 226 H5'' DC 144 H5" C 144 4.351 9.920 7.171 227 H4' DC 144 H4' C 144 2.466 9.430 8.406 228 H3' DC 144 H3' C 144 3.730 7.389 7.014 229 H2' DC 144 H2' C 144 2.208 7.210 5.305 230 H2'' DC 144 H2" C 144 1.376 6.156 6.411 231 H1' DC 144 H1' C 144 -0.261 7.778 7.022 232 H41 DC 144 1H4 C 144 -2.842 9.880 1.598 233 H42 DC 144 2H4 C 144 -1.271 10.221 0.897 234 H8 DA 145 8H A 145 -0.251 4.948 6.030 235 H2 DA 145 2H A 145 -6.343 6.218 4.395 236 H5' DA 145 H5' A 145 -0.007 7.240 9.603 237 H5'' DA 145 H5" A 145 0.160 5.947 10.802 238 H4' DA 145 H4' A 145 -2.185 6.332 10.396 239 H3' DA 145 H3' A 145 -1.029 3.783 10.214 240 H2' DA 145 H2' A 145 -0.923 3.879 7.869 241 H2'' DA 145 H2" A 145 -2.463 3.074 8.007 242 H1' DA 145 H1' A 145 -3.706 5.167 7.841 243 H61 DA 145 2H6 A 145 -1.936 5.901 1.587 244 H62 DA 145 1H6 A 145 -3.503 6.365 0.958 245 H8 DG 146 8H G 146 -3.919 1.682 7.180 246 H1 DG 146 1H G 146 -5.817 3.376 1.287 247 H5' DG 146 H5' G 146 -5.415 4.716 10.073 248 H5'' DG 146 H5" G 146 -6.655 4.299 11.230 249 H4' DG 146 H4' G 146 -7.870 3.988 9.395 250 H3' DG 146 H3' G 146 -6.820 1.453 10.337 251 H2' DG 146 H2' G 146 -5.763 0.981 8.374 252 H2'' DG 146 H2" G 146 -7.342 0.533 7.765 253 H1' DG 146 H1' G 146 -7.702 2.666 6.751 254 H21 DG 146 1H2 G 146 -7.932 3.769 1.290 255 H22 DG 146 2H2 G 146 -8.874 3.778 2.760 256 H8 DA 147 8H A 147 -6.841 -1.132 6.446 257 H2 DA 147 2H A 147 -6.482 0.394 0.216 258 H5' DA 147 H5' A 147 -10.061 1.865 7.477 259 H5'' DA 147 H5" A 147 -11.447 0.825 7.823 260 H4' DA 147 H4' A 147 -11.265 1.136 5.426 261 H3' DA 147 H3' A 147 -11.250 -1.445 6.625 262 H2' DA 147 H2' A 147 -9.047 -1.912 6.115 263 H2'' DA 147 H2" A 147 -9.734 -2.422 4.544 264 H1' DA 147 H1' A 147 -9.365 -0.255 3.574 265 H61 DA 147 2H6 A 147 -2.760 -0.706 3.751 266 H62 DA 147 1H6 A 147 -2.475 -0.171 2.098 267 H5 DC 148 5H C 148 -7.129 -3.533 3.262 268 H6 DC 148 6H C 148 -9.403 -3.491 2.370 269 H5' DC 148 H5' C 148 -12.478 -0.802 1.911 270 H5'' DC 148 H5" C 148 -13.826 -1.927 1.682 271 H4' DC 148 H4' C 148 -12.688 -1.605 -0.458 272 H3' DC 148 H3' C 148 -13.143 -4.123 0.778 273 H2' DC 148 H2' C 148 -10.942 -4.480 1.362 274 H2'' DC 148 H2" C 148 -10.844 -5.211 -0.244 275 H1' DC 148 H1' C 148 -10.109 -3.148 -1.264 276 H41 DC 148 1H4 C 148 -4.226 -3.136 1.052 277 H42 DC 148 2H4 C 148 -4.801 -3.437 2.686 278 H8 DG 149 8H G 149 -9.189 -6.826 -1.017 279 H1 DG 149 1H G 149 -2.866 -5.815 -1.138 280 H5' DG 149 H5' G 149 -10.799 -3.554 -3.053 281 H5'' DG 149 H5" G 149 -12.053 -4.115 -4.144 282 H4' DG 149 H4' G 149 -10.111 -4.412 -5.423 283 H3' DG 149 H3' G 149 -11.549 -6.694 -4.638 284 H2' DG 149 H2' G 149 -10.075 -7.256 -2.928 285 H2'' DG 149 H2" G 149 -9.301 -8.182 -4.191 286 H1' DG 149 H1' G 149 -7.625 -6.428 -4.577 287 H21 DG 149 1H2 G 149 -2.198 -5.610 -3.163 288 H22 DG 149 2H2 G 149 -3.310 -5.611 -4.517 289 H5 DC 150 5H C 150 -6.946 -9.552 -1.647 290 H6 DC 150 6H C 150 -7.131 -9.796 -4.059 291 H5' DC 150 H5' C 150 -8.220 -9.150 -5.739 292 H5'' DC 150 H5" C 150 -8.012 -7.454 -6.253 293 H4' DC 150 H4' C 150 -6.728 -8.193 -8.194 294 H3' DC 150 H3' C 150 -7.733 -10.708 -7.684 295 H2' DC 150 H2' C 150 -6.713 -11.125 -5.693 296 H2'' DC 150 H2" C 150 -5.402 -11.640 -6.715 297 H1' DC 150 H1' C 150 -4.120 -9.688 -6.343 298 H41 DC 150 1H4 C 150 -3.719 -9.138 -0.028 299 H42 DC 150 2H4 C 150 -5.462 -9.247 0.181 300 H5 DC 151 5H C 151 -5.128 -12.783 -4.381 301 H6 DC 151 6H C 151 -3.923 -12.810 -6.501 302 H5' DC 151 H5' C 151 -3.496 -10.263 -9.061 303 H5'' DC 151 H5" C 151 -3.243 -11.223 -10.526 304 H4' DC 151 H4' C 151 -1.109 -10.903 -9.512 305 H3' DC 151 H3' C 151 -2.108 -13.460 -9.988 306 H2' DC 151 H2' C 151 -2.722 -13.984 -7.803 307 H2'' DC 151 H2" C 151 -1.067 -14.577 -7.730 308 H1' DC 151 H1' C 151 -0.230 -12.538 -6.754 309 H41 DC 151 1H4 C 151 -3.336 -12.862 -1.198 310 H42 DC 151 2H4 C 151 -4.890 -12.729 -2.001 311 H5 DC 152 5H C 152 -3.074 -15.860 -4.973 312 H6 DC 152 6H C 152 -0.867 -15.774 -6.030 313 H5' DC 152 H5' C 152 1.589 -13.307 -7.477 314 H5'' DC 152 H5" C 152 2.882 -13.991 -8.467 315 H4' DC 152 H4' C 152 3.561 -14.686 -6.453 316 H3' DC 152 H3' C 152 2.445 -16.821 -7.961 317 H2' DC 152 H2' C 152 0.673 -17.243 -6.574 318 H2'' DC 152 H2" C 152 1.872 -18.175 -5.644 319 H1' DC 152 H1' C 152 2.311 -16.365 -4.131 320 H41 DC 152 1H4 C 152 -3.401 -16.204 -1.327 321 H42 DC 152 2H4 C 152 -4.225 -16.051 -2.869 322 H5 DC 153 5H C 153 -1.371 -19.541 -4.656 323 H6 DC 153 6H C 153 1.019 -20.014 -4.457 324 H5' DC 153 H5' C 153 4.450 -17.545 -4.055 325 H5'' DC 153 H5" C 153 5.856 -18.584 -4.354 326 H4' DC 153 H4' C 153 5.145 -19.194 -2.195 327 H3' DC 153 H3' C 153 4.858 -21.128 -4.304 328 H2' DC 153 H2' C 153 2.606 -21.275 -4.158 329 H2'' DC 153 H2" C 153 2.933 -22.362 -2.813 330 H1' DC 153 H1' C 153 2.704 -20.602 -1.161 331 H41 DC 153 1H4 C 153 -3.473 -19.152 -1.656 332 H42 DC 153 2H4 C 153 -3.469 -19.537 -3.367 333 H5 DC 154 5H C 154 -0.094 -22.792 -3.113 334 H6 DC 154 6H C 154 1.728 -23.422 -1.600 335 H5' DC 154 H5' C 154 4.708 -21.833 0.127 336 H5'' DC 154 H5" C 154 5.783 -23.175 0.561 337 H4' DC 154 H4' C 154 4.040 -23.039 2.211 338 H3' DC 154 H3' C 154 4.439 -25.367 0.622 339 H2' DC 154 H2' C 154 2.384 -25.419 -0.323 340 H2'' DC 154 H2" C 154 1.877 -26.073 1.266 341 H1' DC 154 H1' C 154 1.153 -23.986 2.059 342 H41 DC 154 1H4 C 154 -3.584 -22.784 -1.908 343 H42 DC 154 2H4 C 154 -2.503 -22.536 -3.263 344 H8 DG 155 8H G 155 0.508 -27.555 0.967 345 H1 DG 155 1H G 155 -5.542 -25.774 -0.259 346 H5' DG 155 H5' G 155 2.197 -25.484 4.579 347 H5'' DG 155 H5" G 155 2.710 -26.852 5.595 348 H4' DG 155 H4' G 155 0.317 -26.498 5.912 349 H3' DG 155 H3' G 155 1.429 -28.961 5.003 350 H2' DG 155 H2' G 155 0.477 -28.893 2.887 351 H2'' DG 155 H2" G 155 -0.950 -29.540 3.751 352 H1' DG 155 H1' G 155 -1.896 -27.370 4.042 353 H21 DG 155 1H2 G 155 -6.727 -25.853 1.526 354 H22 DG 155 2H2 G 155 -6.034 -26.296 3.080 355 H5 DC 156 5H C 156 -1.633 -30.539 1.084 356 H6 DC 156 6H C 156 -2.487 -30.918 3.355 357 H5' DC 156 H5' C 156 -2.697 -28.767 6.976 358 H5'' DC 156 H5" C 156 -3.023 -30.086 8.108 359 H4' DC 156 H4' C 156 -5.088 -29.408 6.989 360 H3' DC 156 H3' C 156 -4.038 -32.061 6.966 361 H2' DC 156 H2' C 156 -3.716 -32.182 4.683 362 H2'' DC 156 H2" C 156 -5.478 -32.484 4.695 363 H1' DC 156 H1' C 156 -6.050 -30.236 4.299 364 H41 DC 156 1H4 C 156 -3.864 -29.311 -1.559 365 H42 DC 156 2H4 C 156 -2.220 -29.699 -1.098 366 H8 DG 157 8H G 157 -6.429 -34.853 4.633 367 H1 DG 157 1H G 157 -6.881 -32.222 -1.189 368 H5' DG 157 H5' G 157 -8.780 -31.557 7.273 369 H5'' DG 157 H5" G 157 -9.539 -32.796 8.294 370 H4' DG 157 H4' G 157 -10.818 -32.408 6.205 371 H3' DG 157 H3' G 157 -10.143 -34.984 7.075 372 H2' DG 157 H2' G 157 -8.338 -35.287 5.595 373 H2'' DG 157 H2" G 157 -9.652 -35.894 4.529 374 H1' DG 157 H1' G 157 -9.964 -33.757 3.519 375 H21 DG 157 1H2 G 157 -8.982 -31.836 -1.653 376 H22 DG 157 2H2 G 157 -10.231 -31.978 -0.437 377 HA ALA 1 HA ALA 1 -8.908 27.685 -12.878 378 H1 ALA 1 HN ALA 1 -9.871 28.136 -15.247 379 HB1 ALA 1 1HB ALA 1 -9.502 25.283 -12.972 380 HB2 ALA 1 2HB ALA 1 -10.677 26.259 -13.871 381 HB3 ALA 1 3HB ALA 1 -9.441 25.328 -14.748 382 H SER 2 HN SER 2 -6.833 27.536 -15.519 383 HA SER 2 HA SER 2 -4.541 27.195 -15.669 384 HG SER 2 HG SER 2 -2.433 26.103 -13.562 385 HB2 SER 2 2HB SER 2 -4.578 27.892 -13.185 386 HB3 SER 2 3HB SER 2 -4.452 26.164 -12.794 387 H GLU 3 HN GLU 3 -6.177 24.600 -13.775 388 HA GLU 3 HA GLU 3 -6.173 22.289 -13.981 389 HB2 GLU 3 2HB GLU 3 -4.775 22.611 -16.710 390 HB3 GLU 3 3HB GLU 3 -5.496 21.183 -16.028 391 HG2 GLU 3 2HG GLU 3 -7.723 22.270 -15.993 392 HG3 GLU 3 3HG GLU 3 -7.027 23.724 -16.716 393 H LYS 4 HN LYS 4 -3.081 23.376 -15.504 394 HA LYS 4 HA LYS 4 -1.487 21.597 -13.781 395 HB2 LYS 4 2HB LYS 4 -0.800 23.757 -15.826 396 HB3 LYS 4 3HB LYS 4 0.409 22.984 -14.807 397 HG2 LYS 4 2HG LYS 4 0.478 21.877 -16.873 398 HG3 LYS 4 3HG LYS 4 -0.226 20.750 -15.715 399 HD2 LYS 4 2HD LYS 4 -2.455 21.097 -16.639 400 HD3 LYS 4 3HD LYS 4 -1.885 22.420 -17.671 401 HE2 LYS 4 2HE LYS 4 -0.960 19.518 -17.862 402 HE3 LYS 4 3HE LYS 4 -2.248 20.230 -18.850 403 HZ1 LYS 4 3HZ LYS 4 -0.153 20.244 -20.002 404 HZ2 LYS 4 1HZ LYS 4 0.554 21.136 -18.810 405 HZ3 LYS 4 2HZ LYS 4 -0.651 21.788 -19.721 406 H ARG 5 HN ARG 5 -0.628 22.118 -11.849 407 HA ARG 5 HA ARG 5 -0.597 24.977 -10.980 408 HE ARG 5 HE ARG 5 -5.545 25.092 -11.005 409 HB2 ARG 5 2HB ARG 5 -2.114 22.710 -9.627 410 HB3 ARG 5 3HB ARG 5 -1.722 24.194 -8.778 411 HG2 ARG 5 2HG ARG 5 -2.991 25.478 -10.536 412 HG3 ARG 5 3HG ARG 5 -3.434 23.934 -11.288 413 HD2 ARG 5 2HD ARG 5 -4.508 23.227 -9.152 414 HD3 ARG 5 3HD ARG 5 -4.180 24.847 -8.494 415 HH11 ARG 5 1HH1 ARG 5 -6.301 24.121 -7.707 416 HH12 ARG 5 2HH1 ARG 5 -7.992 24.532 -7.907 417 HH21 ARG 5 1HH2 ARG 5 -7.609 25.572 -11.182 418 HH22 ARG 5 2HH2 ARG 5 -8.734 25.343 -9.838 419 HA PRO 6 HA PRO 6 3.173 23.807 -9.115 420 HB2 PRO 6 2HB PRO 6 3.352 25.435 -6.888 421 HB3 PRO 6 3HB PRO 6 3.432 26.036 -8.566 422 HG2 PRO 6 2HG PRO 6 1.020 25.985 -6.731 423 HG3 PRO 6 3HG PRO 6 1.634 27.348 -7.721 424 HD2 PRO 6 2HD PRO 6 -0.389 25.780 -8.575 425 HD3 PRO 6 3HD PRO 6 0.844 26.375 -9.720 426 H PHE 7 HN PHE 7 3.380 21.772 -8.364 427 HA PHE 7 HA PHE 7 2.621 21.325 -5.473 428 HD1 PHE 7 1HD PHE 7 0.013 20.353 -5.097 429 HD2 PHE 7 2HD PHE 7 0.955 19.844 -9.256 430 HE1 PHE 7 1HE PHE 7 -2.337 20.880 -5.687 431 HE2 PHE 7 2HE PHE 7 -1.381 20.424 -9.860 432 HZ PHE 7 HZ PHE 7 -3.034 20.943 -8.073 433 HB2 PHE 7 2HB PHE 7 2.520 19.208 -7.647 434 HB3 PHE 7 3HB PHE 7 2.075 18.999 -5.960 435 H MET 8 HN MET 8 4.278 20.494 -4.210 436 HA MET 8 HA MET 8 6.423 18.990 -5.663 437 HB2 MET 8 2HB MET 8 8.148 19.956 -4.318 438 HB3 MET 8 3HB MET 8 7.255 21.262 -5.082 439 HG2 MET 8 2HG MET 8 6.952 20.357 -2.188 440 HG3 MET 8 3HG MET 8 7.905 21.721 -2.734 441 HE1 MET 8 3HE MET 8 5.507 21.505 -0.468 442 HE2 MET 8 1HE MET 8 6.577 22.914 -0.673 443 HE3 MET 8 2HE MET 8 4.811 23.132 -0.660 444 H CYS 9 HN CYS 9 7.400 17.315 -4.617 445 HA CYS 9 HA CYS 9 5.928 16.035 -2.435 446 HB2 CYS 9 2HB CYS 9 7.041 14.684 -4.143 447 HB3 CYS 9 3HB CYS 9 8.590 15.431 -3.805 448 H ALA 10 HN ALA 10 7.397 15.240 -0.514 449 HA ALA 10 HA ALA 10 9.255 17.361 0.418 450 HB1 ALA 10 1HB ALA 10 7.020 18.000 1.287 451 HB2 ALA 10 2HB ALA 10 6.853 16.401 2.043 452 HB3 ALA 10 3HB ALA 10 8.117 17.525 2.598 453 H TYR 11 HN TYR 11 8.761 14.151 -0.226 454 HA TYR 11 HA TYR 11 9.730 12.891 2.176 455 HD1 TYR 11 1HD TYR 11 8.443 10.882 2.659 456 HD2 TYR 11 2HD TYR 11 11.357 9.848 -0.335 457 HE1 TYR 11 1HE TYR 11 9.397 9.193 4.165 458 HE2 TYR 11 2HE TYR 11 12.210 8.013 1.123 459 HH TYR 11 HH TYR 11 10.951 7.466 4.411 460 HB2 TYR 11 2HB TYR 11 8.462 11.837 0.201 461 HB3 TYR 11 3HB TYR 11 10.013 11.805 -0.641 462 HA PRO 12 HA PRO 12 13.956 14.164 2.173 463 HB2 PRO 12 2HB PRO 12 14.432 11.373 3.257 464 HB3 PRO 12 3HB PRO 12 15.042 12.936 3.882 465 HG2 PRO 12 2HG PRO 12 12.953 11.728 5.090 466 HG3 PRO 12 3HG PRO 12 12.894 13.494 4.778 467 HD2 PRO 12 2HD PRO 12 11.586 11.263 3.227 468 HD3 PRO 12 3HD PRO 12 10.943 12.870 3.721 469 H GLY 13 HN GLY 13 12.967 11.243 0.479 470 HA2 GLY 13 2HA GLY 13 15.633 10.969 -0.837 471 HA3 GLY 13 3HA GLY 13 14.310 9.791 -0.900 472 H CYS 14 HN CYS 14 12.814 12.717 -1.317 473 HA CYS 14 HA CYS 14 13.155 12.703 -4.284 474 HB2 CYS 14 2HB CYS 14 11.265 11.279 -3.732 475 HB3 CYS 14 3HB CYS 14 10.591 12.531 -2.684 476 H ASN 15 HN ASN 15 10.552 14.381 -2.586 477 HA ASN 15 HA ASN 15 10.064 16.608 -2.324 478 HB2 ASN 15 2HB ASN 15 12.308 16.399 -0.979 479 HB3 ASN 15 3HB ASN 15 13.023 17.316 -2.295 480 HD21 ASN 15 1HD2 ASN 15 11.397 19.303 -2.870 481 HD22 ASN 15 2HD2 ASN 15 10.963 20.241 -1.400 482 H LYS 16 HN LYS 16 10.134 15.554 -4.991 483 HA LYS 16 HA LYS 16 11.376 17.687 -6.663 484 HB2 LYS 16 2HB LYS 16 10.554 14.870 -7.073 485 HB3 LYS 16 3HB LYS 16 9.969 15.908 -8.343 486 HG2 LYS 16 2HG LYS 16 12.092 15.098 -9.039 487 HG3 LYS 16 3HG LYS 16 12.249 16.817 -8.694 488 HD2 LYS 16 2HD LYS 16 14.201 15.747 -7.854 489 HD3 LYS 16 3HD LYS 16 13.249 16.202 -6.435 490 HE2 LYS 16 2HE LYS 16 12.423 13.891 -6.218 491 HE3 LYS 16 3HE LYS 16 13.252 13.429 -7.714 492 HZ1 LYS 16 3HZ LYS 16 15.348 14.009 -6.623 493 HZ2 LYS 16 1HZ LYS 16 14.535 12.833 -5.786 494 HZ3 LYS 16 2HZ LYS 16 14.517 14.381 -5.237 495 H ARG 17 HN ARG 17 10.059 18.527 -8.525 496 HA ARG 17 HA ARG 17 7.504 19.493 -7.367 497 HE ARG 17 HE ARG 17 10.010 21.696 -12.880 498 HB2 ARG 17 2HB ARG 17 7.749 21.381 -8.912 499 HB3 ARG 17 3HB ARG 17 9.192 21.156 -7.949 500 HG2 ARG 17 2HG ARG 17 10.267 21.494 -9.898 501 HG3 ARG 17 3HG ARG 17 9.984 19.778 -10.153 502 HD2 ARG 17 2HD ARG 17 7.801 20.497 -11.381 503 HD3 ARG 17 3HD ARG 17 8.406 22.140 -11.252 504 HH11 ARG 17 1HH1 ARG 17 8.597 18.578 -11.940 505 HH12 ARG 17 2HH1 ARG 17 9.327 17.774 -13.316 506 HH21 ARG 17 2HH2 ARG 17 10.885 20.578 -14.573 507 HH22 ARG 17 1HH2 ARG 17 10.579 18.867 -14.746 508 H TYR 18 HN TYR 18 5.612 19.008 -8.161 509 HA TYR 18 HA TYR 18 5.369 17.694 -10.820 510 HD1 TYR 18 2HD TYR 18 5.738 16.743 -7.036 511 HD2 TYR 18 1HD TYR 18 4.223 14.716 -10.540 512 HE1 TYR 18 2HE TYR 18 7.293 14.864 -6.640 513 HE2 TYR 18 1HE TYR 18 5.883 12.917 -10.201 514 HH TYR 18 HH TYR 18 8.119 12.886 -7.453 515 HB2 TYR 18 2HB TYR 18 3.727 17.548 -8.277 516 HB3 TYR 18 3HB TYR 18 3.224 16.819 -9.782 517 H PHE 19 HN PHE 19 3.213 18.070 -11.893 518 HA PHE 19 HA PHE 19 2.398 20.945 -11.549 519 HD1 PHE 19 1HD PHE 19 3.558 22.708 -13.018 520 HD2 PHE 19 2HD PHE 19 4.899 18.878 -14.480 521 HE1 PHE 19 1HE PHE 19 5.835 23.634 -13.359 522 HE2 PHE 19 2HE PHE 19 7.173 19.808 -14.819 523 HZ PHE 19 HZ PHE 19 7.640 22.191 -14.274 524 HB2 PHE 19 2HB PHE 19 2.576 19.227 -14.063 525 HB3 PHE 19 3HB PHE 19 1.968 20.877 -14.004 526 H LYS 20 HN LYS 20 1.304 17.662 -11.537 527 HA LYS 20 HA LYS 20 -1.542 18.579 -11.768 528 HB2 LYS 20 2HB LYS 20 -0.154 16.103 -12.737 529 HB3 LYS 20 3HB LYS 20 -1.877 16.009 -12.365 530 HG2 LYS 20 2HG LYS 20 -0.751 18.128 -14.245 531 HG3 LYS 20 3HG LYS 20 -0.985 16.472 -14.784 532 HD2 LYS 20 2HD LYS 20 -2.892 17.683 -15.470 533 HD3 LYS 20 3HD LYS 20 -3.401 16.595 -14.176 534 HE2 LYS 20 2HE LYS 20 -3.382 18.481 -12.577 535 HE3 LYS 20 3HE LYS 20 -2.786 19.570 -13.837 536 HZ1 LYS 20 3HZ LYS 20 -5.115 19.782 -13.571 537 HZ2 LYS 20 1HZ LYS 20 -5.380 18.170 -13.827 538 HZ3 LYS 20 2HZ LYS 20 -4.830 19.123 -15.054 539 H LEU 21 HN LEU 21 -2.862 18.158 -10.080 540 HA LEU 21 HA LEU 21 -1.784 17.430 -7.551 541 HG LEU 21 HG LEU 21 -4.546 16.141 -6.429 542 HB2 LEU 21 2HB LEU 21 -3.849 18.761 -7.822 543 HB3 LEU 21 3HB LEU 21 -4.670 17.390 -8.547 544 HD11 LEU 21 1HD1 LEU 21 -2.460 17.000 -5.438 545 HD12 LEU 21 2HD1 LEU 21 -3.811 17.259 -4.335 546 HD13 LEU 21 3HD1 LEU 21 -3.181 18.619 -5.284 547 HD21 LEU 21 3HD2 LEU 21 -6.455 17.643 -6.858 548 HD22 LEU 21 1HD2 LEU 21 -5.595 18.974 -6.052 549 HD23 LEU 21 2HD2 LEU 21 -6.087 17.536 -5.130 550 H SER 22 HN SER 22 -3.807 15.544 -9.859 551 HA SER 22 HA SER 22 -3.871 13.160 -8.273 552 HG SER 22 HG SER 22 -4.965 13.568 -12.166 553 HB2 SER 22 2HB SER 22 -4.635 12.109 -10.451 554 HB3 SER 22 3HB SER 22 -5.571 13.516 -9.912 555 H HIS 23 HN HIS 23 -1.610 14.339 -10.737 556 HA HIS 23 HA HIS 23 -0.333 11.733 -11.117 557 HD1 HIS 23 1HD HIS 23 2.396 13.641 -14.169 558 HD2 HIS 23 2HD HIS 23 1.593 15.811 -10.693 559 HE1 HIS 23 1HE HIS 23 3.936 15.675 -14.199 560 HB2 HIS 23 2HB HIS 23 0.586 12.663 -12.823 561 HB3 HIS 23 3HB HIS 23 -0.424 14.009 -12.628 562 H LEU 24 HN LEU 24 0.435 14.791 -9.386 563 HA LEU 24 HA LEU 24 2.625 13.773 -7.938 564 HG LEU 24 HG LEU 24 2.862 16.860 -6.171 565 HB2 LEU 24 2HB LEU 24 1.964 16.132 -8.071 566 HB3 LEU 24 3HB LEU 24 0.569 15.837 -7.101 567 HD11 LEU 24 1HD1 LEU 24 1.030 15.089 -4.518 568 HD12 LEU 24 2HD1 LEU 24 0.755 16.790 -4.951 569 HD13 LEU 24 3HD1 LEU 24 2.117 16.355 -3.903 570 HD21 LEU 24 3HD2 LEU 24 3.254 14.192 -4.908 571 HD22 LEU 24 1HD2 LEU 24 4.358 15.525 -5.130 572 HD23 LEU 24 2HD2 LEU 24 3.997 14.468 -6.500 573 H GLN 25 HN GLN 25 -0.888 13.509 -7.230 574 HA GLN 25 HA GLN 25 -0.671 12.247 -4.670 575 HB2 GLN 25 2HB GLN 25 -2.780 13.049 -5.455 576 HB3 GLN 25 3HB GLN 25 -2.754 12.057 -6.884 577 HG2 GLN 25 2HG GLN 25 -2.867 10.861 -4.100 578 HG3 GLN 25 3HG GLN 25 -4.303 11.395 -4.961 579 HE21 GLN 25 1HE2 GLN 25 -3.132 10.280 -7.724 580 HE22 GLN 25 2HE2 GLN 25 -3.444 8.565 -7.407 581 H MET 26 HN MET 26 -0.643 10.920 -8.018 582 HA MET 26 HA MET 26 -0.387 8.175 -7.261 583 HB2 MET 26 2HB MET 26 -0.980 9.113 -9.563 584 HB3 MET 26 3HB MET 26 0.731 9.484 -9.770 585 HG2 MET 26 2HG MET 26 0.419 7.459 -10.854 586 HG3 MET 26 3HG MET 26 1.197 6.997 -9.353 587 HE1 MET 26 3HE MET 26 0.342 5.433 -7.711 588 HE2 MET 26 1HE MET 26 -1.107 6.277 -7.095 589 HE3 MET 26 2HE MET 26 -1.241 4.631 -7.703 590 H HIS 27 HN HIS 27 2.046 10.730 -7.998 591 HA HIS 27 HA HIS 27 4.385 9.152 -7.673 592 HD1 HIS 27 1HD HIS 27 7.016 9.923 -7.369 593 HD2 HIS 27 2HD HIS 27 5.133 13.006 -5.197 594 HE1 HIS 27 1HE HIS 27 8.604 10.594 -5.466 595 HB2 HIS 27 2HB HIS 27 4.702 11.346 -8.530 596 HB3 HIS 27 3HB HIS 27 3.785 12.104 -7.223 597 H SER 28 HN SER 28 2.478 11.013 -5.253 598 HA SER 28 HA SER 28 4.066 10.563 -3.027 599 HG SER 28 HG SER 28 1.956 12.449 -4.226 600 HB2 SER 28 2HB SER 28 1.015 10.647 -3.057 601 HB3 SER 28 3HB SER 28 2.082 11.057 -1.709 602 H ARG 29 HN ARG 29 1.860 8.335 -4.672 603 HA ARG 29 HA ARG 29 1.320 6.509 -2.567 604 HE ARG 29 HE ARG 29 2.026 3.338 -5.924 605 HB2 ARG 29 2HB ARG 29 0.429 6.650 -4.993 606 HB3 ARG 29 3HB ARG 29 1.837 5.708 -5.455 607 HG2 ARG 29 2HG ARG 29 -0.352 4.855 -3.523 608 HG3 ARG 29 3HG ARG 29 -0.240 4.415 -5.225 609 HD2 ARG 29 2HD ARG 29 1.608 3.548 -2.996 610 HD3 ARG 29 3HD ARG 29 0.474 2.585 -3.936 611 HH11 ARG 29 2HH2 ARG 29 2.961 2.043 -2.786 612 HH12 ARG 29 1HH2 ARG 29 4.200 1.018 -3.479 613 HH21 ARG 29 1HH1 ARG 29 3.712 2.162 -6.704 614 HH22 ARG 29 2HH1 ARG 29 4.620 1.100 -5.639 615 H LYS 30 HN LYS 30 4.181 6.876 -4.695 616 HA LYS 30 HA LYS 30 5.525 4.421 -4.071 617 HB2 LYS 30 2HB LYS 30 6.175 6.008 -5.888 618 HB3 LYS 30 3HB LYS 30 6.687 7.179 -4.682 619 HG2 LYS 30 2HG LYS 30 8.587 6.005 -5.679 620 HG3 LYS 30 3HG LYS 30 8.505 5.771 -3.940 621 HD2 LYS 30 2HD LYS 30 9.157 3.712 -5.084 622 HD3 LYS 30 3HD LYS 30 7.620 3.488 -4.249 623 HE2 LYS 30 2HE LYS 30 6.403 3.789 -6.384 624 HE3 LYS 30 3HE LYS 30 7.934 4.094 -7.225 625 HZ1 LYS 30 3HZ LYS 30 8.629 1.878 -6.665 626 HZ2 LYS 30 1HZ LYS 30 7.200 1.812 -7.475 627 HZ3 LYS 30 2HZ LYS 30 7.238 1.584 -5.841 628 H HIS 31 HN HIS 31 5.290 7.505 -2.300 629 HA HIS 31 HA HIS 31 7.388 6.693 -0.378 630 HD1 HIS 31 1HD HIS 31 9.261 7.750 -1.112 631 HD2 HIS 31 2HD HIS 31 6.904 11.086 -2.146 632 HE1 HIS 31 1HE HIS 31 10.645 9.167 -2.741 633 HB2 HIS 31 2HB HIS 31 5.702 9.226 -0.615 634 HB3 HIS 31 3HB HIS 31 6.948 8.960 0.607 635 H THR 32 HN THR 32 4.111 5.829 -0.562 636 HA THR 32 HA THR 32 3.069 6.974 1.945 637 HB THR 32 HB THR 32 1.260 5.250 1.583 638 HG1 THR 32 1HG THR 32 2.510 4.820 -0.965 639 HG21 THR 32 3HG2 THR 32 0.203 6.392 -0.348 640 HG22 THR 32 1HG2 THR 32 1.716 7.300 -0.579 641 HG23 THR 32 2HG2 THR 32 0.806 7.469 0.921 642 H GLY 33 HN GLY 33 4.536 3.917 0.788 643 HA2 GLY 33 2HA GLY 33 4.219 2.716 3.483 644 HA3 GLY 33 3HA GLY 33 4.718 1.879 2.003 645 H GLU 34 HN GLU 34 6.220 4.962 2.872 646 HA GLU 34 HA GLU 34 8.864 3.831 2.859 647 HB2 GLU 34 2HB GLU 34 9.622 6.008 3.369 648 HB3 GLU 34 3HB GLU 34 8.258 6.217 2.309 649 HG2 GLU 34 2HG GLU 34 7.713 7.797 3.900 650 HG3 GLU 34 3HG GLU 34 6.868 6.439 4.591 651 H LYS 35 HN LYS 35 6.449 3.927 5.347 652 HA LYS 35 HA LYS 35 8.485 3.668 7.514 653 HB2 LYS 35 2HB LYS 35 6.331 5.327 7.378 654 HB3 LYS 35 3HB LYS 35 5.535 3.994 8.133 655 HG2 LYS 35 2HG LYS 35 8.032 5.440 9.122 656 HG3 LYS 35 3HG LYS 35 6.402 5.616 9.762 657 HD2 LYS 35 2HD LYS 35 8.107 3.088 9.925 658 HD3 LYS 35 3HD LYS 35 7.825 4.250 11.223 659 HE2 LYS 35 2HE LYS 35 5.387 3.768 11.135 660 HE3 LYS 35 3HE LYS 35 5.682 2.565 9.864 661 HZ1 LYS 35 3HZ LYS 35 5.570 1.524 12.002 662 HZ2 LYS 35 1HZ LYS 35 6.806 2.459 12.588 663 HZ3 LYS 35 2HZ LYS 35 7.079 1.368 11.374 664 HA PRO 36 HA PRO 36 7.016 -0.674 7.198 665 HB2 PRO 36 2HB PRO 36 9.373 -1.927 7.775 666 HB3 PRO 36 3HB PRO 36 9.080 -1.148 6.192 667 HG2 PRO 36 2HG PRO 36 10.517 0.029 8.601 668 HG3 PRO 36 3HG PRO 36 11.100 -0.057 6.907 669 HD2 PRO 36 2HD PRO 36 9.890 2.170 7.914 670 HD3 PRO 36 3HD PRO 36 9.639 1.639 6.215 671 H TYR 37 HN TYR 37 7.055 -2.519 8.801 672 HA TYR 37 HA TYR 37 7.568 -1.661 11.634 673 HD1 TYR 37 2HD TYR 37 4.734 -1.067 8.980 674 HD2 TYR 37 1HD TYR 37 4.462 -0.683 13.274 675 HE1 TYR 37 2HE TYR 37 3.442 1.032 8.719 676 HE2 TYR 37 1HE TYR 37 3.066 1.352 13.001 677 HH TYR 37 HH TYR 37 2.488 3.082 11.369 678 HB2 TYR 37 2HB TYR 37 5.009 -3.076 10.772 679 HB3 TYR 37 3HB TYR 37 5.488 -2.528 12.385 680 H GLN 38 HN GLN 38 7.539 -3.581 13.155 681 HA GLN 38 HA GLN 38 7.839 -6.223 11.812 682 HB2 GLN 38 2HB GLN 38 10.150 -5.165 12.385 683 HB3 GLN 38 3HB GLN 38 9.688 -5.396 14.074 684 HG2 GLN 38 2HG GLN 38 9.251 -7.917 13.292 685 HG3 GLN 38 3HG GLN 38 10.255 -7.459 11.924 686 HE21 GLN 38 1HE2 GLN 38 10.097 -7.975 15.442 687 HE22 GLN 38 2HE2 GLN 38 11.868 -8.035 15.629 688 H CYS 39 HN CYS 39 7.071 -7.960 13.022 689 HA CYS 39 HA CYS 39 5.397 -7.352 15.365 690 HB2 CYS 39 2HB CYS 39 4.883 -9.168 13.648 691 HB3 CYS 39 3HB CYS 39 6.258 -10.072 14.295 692 H ASP 40 HN ASP 40 5.693 -8.825 17.353 693 HA ASP 40 HA ASP 40 8.584 -9.116 18.078 694 HB2 ASP 40 2HB ASP 40 7.591 -6.984 19.016 695 HB3 ASP 40 3HB ASP 40 6.431 -7.969 19.909 696 H PHE 41 HN PHE 41 5.671 -10.638 17.586 697 HA PHE 41 HA PHE 41 5.314 -12.231 19.916 698 HD1 PHE 41 1HD PHE 41 2.477 -13.121 19.964 699 HD2 PHE 41 2HD PHE 41 4.779 -15.222 16.990 700 HE1 PHE 41 1HE PHE 41 1.317 -15.241 20.563 701 HE2 PHE 41 2HE PHE 41 3.587 -17.336 17.583 702 HZ PHE 41 HZ PHE 41 1.887 -17.345 19.366 703 HB2 PHE 41 2HB PHE 41 3.654 -11.950 18.121 704 HB3 PHE 41 3HB PHE 41 4.671 -12.813 17.001 705 H LYS 42 HN LYS 42 5.830 -14.454 20.341 706 HA LYS 42 HA LYS 42 8.559 -15.020 20.165 707 HB2 LYS 42 2HB LYS 42 7.065 -16.010 21.853 708 HB3 LYS 42 3HB LYS 42 6.227 -16.925 20.615 709 HG2 LYS 42 2HG LYS 42 7.587 -18.471 21.673 710 HG3 LYS 42 3HG LYS 42 8.420 -18.180 20.168 711 HD2 LYS 42 2HD LYS 42 9.132 -16.980 22.887 712 HD3 LYS 42 3HD LYS 42 9.884 -18.398 22.177 713 HE2 LYS 42 2HE LYS 42 10.117 -15.541 21.156 714 HE3 LYS 42 3HE LYS 42 11.350 -16.496 21.972 715 HZ1 LYS 42 3HZ LYS 42 11.240 -18.052 20.086 716 HZ2 LYS 42 1HZ LYS 42 11.755 -16.545 19.663 717 HZ3 LYS 42 2HZ LYS 42 10.228 -17.008 19.298 718 H ASP 43 HN ASP 43 6.001 -16.908 18.442 719 HA ASP 43 HA ASP 43 8.046 -18.029 16.637 720 HB2 ASP 43 2HB ASP 43 5.025 -18.458 16.534 721 HB3 ASP 43 3HB ASP 43 6.286 -19.460 15.833 722 H CYS 44 HN CYS 44 8.031 -15.305 16.298 723 HA CYS 44 HA CYS 44 6.989 -15.047 13.553 724 HB2 CYS 44 2HB CYS 44 5.223 -14.154 15.077 725 HB3 CYS 44 3HB CYS 44 6.367 -12.977 15.721 726 H GLU 45 HN GLU 45 7.758 -12.055 15.017 727 HA GLU 45 HA GLU 45 9.595 -10.644 14.880 728 HB2 GLU 45 2HB GLU 45 10.954 -12.802 15.622 729 HB3 GLU 45 3HB GLU 45 11.453 -12.857 13.926 730 HG2 GLU 45 2HG GLU 45 12.305 -10.502 14.160 731 HG3 GLU 45 3HG GLU 45 11.831 -10.539 15.859 732 H ARG 46 HN ARG 46 7.641 -11.317 12.810 733 HA ARG 46 HA ARG 46 9.152 -11.263 10.254 734 HE ARG 46 HE ARG 46 6.260 -15.855 9.656 735 HB2 ARG 46 2HB ARG 46 6.165 -11.305 10.857 736 HB3 ARG 46 3HB ARG 46 6.862 -11.375 9.240 737 HG2 ARG 46 2HG ARG 46 7.853 -13.542 9.647 738 HG3 ARG 46 3HG ARG 46 7.470 -13.476 11.368 739 HD2 ARG 46 2HD ARG 46 5.014 -13.380 10.762 740 HD3 ARG 46 3HD ARG 46 5.477 -13.660 9.083 741 HH11 ARG 46 1HH1 ARG 46 4.955 -14.349 12.572 742 HH12 ARG 46 2HH1 ARG 46 4.921 -15.892 13.350 743 HH21 ARG 46 1HH2 ARG 46 6.286 -17.681 10.936 744 HH22 ARG 46 2HH2 ARG 46 5.658 -17.555 12.574 745 H ARG 47 HN ARG 47 8.933 -9.573 8.726 746 HA ARG 47 HA ARG 47 8.198 -6.965 9.981 747 HE ARG 47 HE ARG 47 11.785 -10.338 7.318 748 HB2 ARG 47 2HB ARG 47 9.791 -5.935 8.453 749 HB3 ARG 47 3HB ARG 47 10.563 -7.133 9.448 750 HG2 ARG 47 2HG ARG 47 9.791 -8.434 6.962 751 HG3 ARG 47 3HG ARG 47 10.498 -6.874 6.576 752 HD2 ARG 47 2HD ARG 47 12.357 -8.228 6.557 753 HD3 ARG 47 3HD ARG 47 12.446 -7.590 8.195 754 HH11 ARG 47 1HH2 ARG 47 12.056 -8.275 10.233 755 HH12 ARG 47 2HH2 ARG 47 11.714 -9.690 11.229 756 HH21 ARG 47 1HH1 ARG 47 11.576 -12.007 8.798 757 HH22 ARG 47 2HH1 ARG 47 11.500 -11.563 10.509 758 H PHE 48 HN PHE 48 7.236 -5.359 8.691 759 HA PHE 48 HA PHE 48 5.902 -6.253 6.187 760 HD1 PHE 48 1HD PHE 48 3.351 -7.739 6.342 761 HD2 PHE 48 2HD PHE 48 5.042 -6.768 10.185 762 HE1 PHE 48 1HE PHE 48 3.062 -10.081 7.067 763 HE2 PHE 48 2HE PHE 48 4.753 -9.130 10.912 764 HZ PHE 48 HZ PHE 48 3.856 -10.796 9.310 765 HB2 PHE 48 2HB PHE 48 4.480 -4.984 8.572 766 HB3 PHE 48 3HB PHE 48 3.752 -5.371 7.017 767 H SER 49 HN SER 49 4.864 -4.344 5.069 768 HA SER 49 HA SER 49 6.713 -2.011 5.390 769 HG SER 49 HG SER 49 4.331 -3.636 3.392 770 HB2 SER 49 2HB SER 49 6.245 -1.558 3.024 771 HB3 SER 49 3HB SER 49 6.776 -3.234 3.233 772 H ARG 50 HN ARG 50 3.484 -2.891 6.047 773 HA ARG 50 HA ARG 50 2.755 -0.014 6.301 774 HE ARG 50 HE ARG 50 -0.793 -1.882 3.119 775 HB2 ARG 50 2HB ARG 50 1.056 -2.131 4.910 776 HB3 ARG 50 3HB ARG 50 0.438 -0.588 5.489 777 HG2 ARG 50 2HG ARG 50 2.145 0.574 4.013 778 HG3 ARG 50 3HG ARG 50 2.455 -1.000 3.259 779 HD2 ARG 50 2HD ARG 50 -0.264 0.389 3.451 780 HD3 ARG 50 3HD ARG 50 0.760 0.401 2.026 781 HH11 ARG 50 1HH1 ARG 50 1.423 -0.804 0.608 782 HH12 ARG 50 2HH1 ARG 50 0.879 -2.086 -0.471 783 HH21 ARG 50 2HH2 ARG 50 -1.294 -3.510 1.653 784 HH22 ARG 50 1HH2 ARG 50 -0.499 -3.529 0.124 785 H SER 51 HN SER 51 1.063 0.405 7.816 786 HA SER 51 HA SER 51 1.149 -1.131 10.196 787 HG SER 51 HG SER 51 1.055 1.951 9.810 788 HB2 SER 51 2HB SER 51 -1.330 0.440 9.750 789 HB3 SER 51 3HB SER 51 -0.140 0.567 11.045 790 H ASP 52 HN ASP 52 -1.338 -0.955 7.601 791 HA ASP 52 HA ASP 52 -3.121 -2.795 8.773 792 HB2 ASP 52 2HB ASP 52 -4.294 -2.717 6.807 793 HB3 ASP 52 3HB ASP 52 -3.433 -1.179 6.792 794 H GLN 53 HN GLN 53 -0.266 -3.360 6.707 795 HA GLN 53 HA GLN 53 -0.769 -6.138 6.159 796 HB2 GLN 53 2HB GLN 53 1.765 -4.469 6.299 797 HB3 GLN 53 3HB GLN 53 1.778 -6.188 5.911 798 HG2 GLN 53 2HG GLN 53 0.531 -5.870 3.902 799 HG3 GLN 53 3HG GLN 53 0.175 -4.186 4.300 800 HE21 GLN 53 1HE2 GLN 53 1.203 -4.002 1.963 801 HE22 GLN 53 2HE2 GLN 53 2.944 -3.722 2.001 802 H LEU 54 HN LEU 54 1.197 -4.460 8.693 803 HA LEU 54 HA LEU 54 1.882 -6.839 10.152 804 HG LEU 54 HG LEU 54 1.578 -5.396 13.052 805 HB2 LEU 54 2HB LEU 54 3.051 -4.702 10.474 806 HB3 LEU 54 3HB LEU 54 1.572 -3.938 11.042 807 HD11 LEU 54 1HD1 LEU 54 2.968 -7.303 12.045 808 HD12 LEU 54 2HD1 LEU 54 3.472 -6.768 13.662 809 HD13 LEU 54 3HD1 LEU 54 4.382 -6.281 12.234 810 HD21 LEU 54 3HD2 LEU 54 4.315 -4.160 12.854 811 HD22 LEU 54 1HD2 LEU 54 3.236 -4.228 14.234 812 HD23 LEU 54 2HD2 LEU 54 2.847 -3.135 12.889 813 H LYS 55 HN LYS 55 -0.841 -4.485 10.564 814 HA LYS 55 HA LYS 55 -1.969 -5.713 12.873 815 HB2 LYS 55 2HB LYS 55 -2.446 -3.421 12.023 816 HB3 LYS 55 3HB LYS 55 -3.411 -4.106 10.709 817 HG2 LYS 55 2HG LYS 55 -5.074 -4.927 12.259 818 HG3 LYS 55 3HG LYS 55 -3.991 -4.695 13.640 819 HD2 LYS 55 2HD LYS 55 -5.665 -2.954 13.667 820 HD3 LYS 55 3HD LYS 55 -4.081 -2.243 13.339 821 HE2 LYS 55 2HE LYS 55 -4.657 -2.206 10.889 822 HE3 LYS 55 3HE LYS 55 -6.263 -2.839 11.292 823 HZ1 LYS 55 3HZ LYS 55 -6.381 -0.500 11.109 824 HZ2 LYS 55 1HZ LYS 55 -5.125 -0.259 12.158 825 HZ3 LYS 55 2HZ LYS 55 -6.557 -0.869 12.698 826 H ARG 56 HN ARG 56 -2.645 -6.248 9.376 827 HA ARG 56 HA ARG 56 -4.731 -8.209 9.732 828 HE ARG 56 HE ARG 56 -2.173 -9.077 5.827 829 HB2 ARG 56 2HB ARG 56 -4.184 -7.082 7.576 830 HB3 ARG 56 3HB ARG 56 -2.643 -7.937 7.520 831 HG2 ARG 56 2HG ARG 56 -3.937 -10.117 7.393 832 HG3 ARG 56 3HG ARG 56 -5.435 -9.173 7.394 833 HD2 ARG 56 2HD ARG 56 -4.896 -9.752 5.103 834 HD3 ARG 56 3HD ARG 56 -4.652 -8.011 5.300 835 HH11 ARG 56 1HH2 ARG 56 -4.224 -9.356 2.916 836 HH12 ARG 56 2HH2 ARG 56 -2.793 -9.644 1.933 837 HH21 ARG 56 1HH1 ARG 56 -0.532 -9.401 4.490 838 HH22 ARG 56 2HH1 ARG 56 -0.779 -9.639 2.775 839 H HIS 57 HN HIS 57 -1.161 -8.436 9.449 840 HA HIS 57 HA HIS 57 -0.958 -11.253 9.565 841 HD1 HIS 57 1HD HIS 57 2.102 -12.563 10.344 842 HD2 HIS 57 2HD HIS 57 1.762 -8.920 12.409 843 HE1 HIS 57 1HE HIS 57 3.347 -12.851 12.529 844 HB2 HIS 57 2HB HIS 57 1.046 -10.294 8.981 845 HB3 HIS 57 3HB HIS 57 0.844 -8.913 10.020 846 H GLN 58 HN GLN 58 -1.138 -8.825 12.230 847 HA GLN 58 HA GLN 58 -0.575 -10.475 14.434 848 HB2 GLN 58 2HB GLN 58 -2.489 -8.116 14.167 849 HB3 GLN 58 3HB GLN 58 -2.249 -8.968 15.676 850 HG2 GLN 58 2HG GLN 58 -0.135 -7.445 14.130 851 HG3 GLN 58 3HG GLN 58 -0.801 -7.070 15.707 852 HE21 GLN 58 1HE2 GLN 58 2.000 -8.098 14.372 853 HE22 GLN 58 2HE2 GLN 58 2.576 -9.199 15.589 854 H ARG 59 HN ARG 59 -3.512 -10.426 12.419 855 HA ARG 59 HA ARG 59 -5.339 -11.718 14.191 856 HE ARG 59 HE ARG 59 -6.921 -10.471 14.813 857 HB2 ARG 59 2HB ARG 59 -5.104 -12.086 11.187 858 HB3 ARG 59 3HB ARG 59 -6.513 -12.441 12.162 859 HG2 ARG 59 2HG ARG 59 -5.367 -9.625 11.829 860 HG3 ARG 59 3HG ARG 59 -6.636 -10.317 10.836 861 HD2 ARG 59 2HD ARG 59 -7.627 -8.867 12.472 862 HD3 ARG 59 3HD ARG 59 -8.095 -10.528 12.813 863 HH11 ARG 59 1HH1 ARG 59 -5.915 -7.563 13.093 864 HH12 ARG 59 2HH1 ARG 59 -5.197 -6.901 14.537 865 HH21 ARG 59 1HH2 ARG 59 -5.856 -9.666 16.472 866 HH22 ARG 59 2HH2 ARG 59 -5.200 -8.032 16.424 867 H ARG 60 HN ARG 60 -2.640 -13.004 12.268 868 HA ARG 60 HA ARG 60 -3.187 -15.812 12.437 869 HE ARG 60 HE ARG 60 2.911 -16.648 11.720 870 HB2 ARG 60 2HB ARG 60 -1.425 -14.945 11.028 871 HB3 ARG 60 3HB ARG 60 -0.612 -14.226 12.423 872 HG2 ARG 60 2HG ARG 60 0.116 -16.325 13.290 873 HG3 ARG 60 3HG ARG 60 -0.749 -17.208 12.016 874 HD2 ARG 60 2HD ARG 60 0.607 -15.889 10.305 875 HD3 ARG 60 3HD ARG 60 1.379 -15.037 11.613 876 HH11 ARG 60 1HH1 ARG 60 0.095 -18.470 10.629 877 HH12 ARG 60 2HH1 ARG 60 1.103 -19.757 10.003 878 HH21 ARG 60 1HH2 ARG 60 4.059 -18.294 10.994 879 HH22 ARG 60 2HH2 ARG 60 3.283 -19.700 10.281 880 H HIS 61 HN HIS 61 -1.653 -13.548 14.767 881 HA HIS 61 HA HIS 61 -0.974 -15.740 16.614 882 HD1 HIS 61 1HD HIS 61 1.210 -15.844 15.883 883 HD2 HIS 61 2HD HIS 61 1.469 -11.636 16.028 884 HE1 HIS 61 1HE HIS 61 3.266 -15.175 14.522 885 HB2 HIS 61 2HB HIS 61 -0.793 -12.706 16.941 886 HB3 HIS 61 3HB HIS 61 -0.124 -13.907 18.048 887 H THR 62 HN THR 62 -3.202 -12.923 16.551 888 HA THR 62 HA THR 62 -4.350 -13.536 19.122 889 HB THR 62 HB THR 62 -5.997 -11.778 18.556 890 HG1 THR 62 1HG THR 62 -4.678 -11.684 16.066 891 HG21 THR 62 3HG2 THR 62 -4.481 -9.911 18.205 892 HG22 THR 62 1HG2 THR 62 -3.221 -10.966 17.538 893 HG23 THR 62 2HG2 THR 62 -3.681 -11.094 19.243 894 H GLY 63 HN GLY 63 -4.791 -15.097 16.130 895 HA2 GLY 63 2HA GLY 63 -6.298 -16.706 15.429 896 HA3 GLY 63 3HA GLY 63 -6.913 -16.745 17.091 897 H VAL 64 HN VAL 64 -7.204 -13.576 16.041 898 HA VAL 64 HA VAL 64 -10.068 -13.737 16.060 899 HB VAL 64 HB VAL 64 -8.115 -11.496 15.422 900 HG11 VAL 64 1HG1 VAL 64 -11.152 -11.337 15.634 901 HG12 VAL 64 2HG1 VAL 64 -10.085 -9.940 15.892 902 HG13 VAL 64 3HG1 VAL 64 -10.098 -10.725 14.330 903 HG21 VAL 64 3HG2 VAL 64 -9.900 -12.019 17.837 904 HG22 VAL 64 1HG2 VAL 64 -8.160 -12.333 17.767 905 HG23 VAL 64 2HG2 VAL 64 -8.748 -10.677 17.649 906 H LYS 65 HN LYS 65 -11.185 -14.658 14.451 907 HA LYS 65 HA LYS 65 -10.630 -13.756 11.643 908 HB2 LYS 65 2HB LYS 65 -11.694 -16.399 12.710 909 HB3 LYS 65 3HB LYS 65 -11.886 -15.922 11.027 910 HG2 LYS 65 2HG LYS 65 -9.544 -15.871 10.635 911 HG3 LYS 65 3HG LYS 65 -9.139 -16.034 12.341 912 HD2 LYS 65 2HD LYS 65 -10.802 -18.230 11.120 913 HD3 LYS 65 3HD LYS 65 -9.145 -18.081 10.554 914 HE2 LYS 65 2HE LYS 65 -9.279 -19.677 12.390 915 HE3 LYS 65 3HE LYS 65 -8.259 -18.294 12.813 916 HZ1 LYS 65 3HZ LYS 65 -9.987 -17.411 14.135 917 HZ2 LYS 65 1HZ LYS 65 -9.783 -18.971 14.576 918 HZ3 LYS 65 2HZ LYS 65 -11.075 -18.559 13.636 919 HA PRO 66 HA PRO 66 -14.681 -12.153 13.044 920 HB2 PRO 66 2HB PRO 66 -14.462 -9.563 12.243 921 HB3 PRO 66 3HB PRO 66 -13.514 -10.204 13.620 922 HG2 PRO 66 2HG PRO 66 -12.605 -9.838 10.746 923 HG3 PRO 66 3HG PRO 66 -11.763 -9.338 12.244 924 HD2 PRO 66 2HD PRO 66 -11.239 -11.692 10.903 925 HD3 PRO 66 3HD PRO 66 -11.038 -11.516 12.666 926 H PHE 67 HN PHE 67 -13.291 -12.247 9.806 927 HA PHE 67 HA PHE 67 -15.718 -11.241 8.464 928 HD1 PHE 67 2HD PHE 67 -15.017 -9.587 6.172 929 HD2 PHE 67 1HD PHE 67 -11.564 -11.008 8.317 930 HE1 PHE 67 2HE PHE 67 -14.011 -7.318 6.069 931 HE2 PHE 67 1HE PHE 67 -10.525 -8.761 8.149 932 HZ PHE 67 HZ PHE 67 -11.761 -6.905 7.034 933 HB2 PHE 67 2HB PHE 67 -13.164 -12.558 7.455 934 HB3 PHE 67 3HB PHE 67 -14.419 -12.050 6.386 935 H GLN 68 HN GLN 68 -17.050 -12.931 9.777 936 HA GLN 68 HA GLN 68 -16.898 -15.629 8.767 937 HB2 GLN 68 2HB GLN 68 -17.486 -15.050 11.090 938 HB3 GLN 68 3HB GLN 68 -18.975 -14.275 10.534 939 HG2 GLN 68 2HG GLN 68 -19.847 -16.412 9.737 940 HG3 GLN 68 3HG GLN 68 -18.300 -17.206 10.084 941 HE21 GLN 68 1HE2 GLN 68 -21.428 -17.227 11.307 942 HE22 GLN 68 2HE2 GLN 68 -20.915 -17.310 12.993 943 H CYS 69 HN CYS 69 -17.948 -16.615 7.150 944 HA CYS 69 HA CYS 69 -19.767 -15.203 5.404 945 HB2 CYS 69 2HB CYS 69 -18.443 -17.168 4.634 946 HB3 CYS 69 3HB CYS 69 -19.313 -18.212 5.775 947 H LYS 70 HN LYS 70 -21.840 -14.660 5.823 948 HA LYS 70 HA LYS 70 -23.313 -15.652 8.031 949 HB2 LYS 70 2HB LYS 70 -24.257 -14.292 5.480 950 HB3 LYS 70 3HB LYS 70 -25.269 -14.537 6.900 951 HG2 LYS 70 2HG LYS 70 -22.695 -12.877 6.876 952 HG3 LYS 70 3HG LYS 70 -24.325 -12.256 6.696 953 HD2 LYS 70 2HD LYS 70 -24.024 -11.852 8.918 954 HD3 LYS 70 3HD LYS 70 -24.824 -13.412 8.987 955 HE2 LYS 70 2HE LYS 70 -23.053 -13.411 10.589 956 HE3 LYS 70 3HE LYS 70 -22.530 -14.485 9.291 957 HZ1 LYS 70 3HZ LYS 70 -20.842 -12.903 10.093 958 HZ2 LYS 70 1HZ LYS 70 -21.726 -11.659 9.469 959 HZ3 LYS 70 2HZ LYS 70 -21.093 -12.828 8.482 960 H THR 71 HN THR 71 -22.639 -17.182 5.047 961 HA THR 71 HA THR 71 -25.148 -18.723 4.895 962 HB THR 71 HB THR 71 -22.687 -19.572 3.374 963 HG1 THR 71 1HG THR 71 -22.346 -17.590 3.040 964 HG21 THR 71 3HG2 THR 71 -24.235 -19.815 1.534 965 HG22 THR 71 1HG2 THR 71 -25.546 -19.119 2.508 966 HG23 THR 71 2HG2 THR 71 -24.830 -20.687 2.963 967 H CYS 72 HN CYS 72 -21.713 -19.852 4.970 968 HA CYS 72 HA CYS 72 -22.629 -22.306 6.346 969 HB2 CYS 72 2HB CYS 72 -20.309 -23.080 5.764 970 HB3 CYS 72 3HB CYS 72 -21.250 -22.540 4.346 971 H GLN 73 HN GLN 73 -21.261 -19.306 7.226 972 HA GLN 73 HA GLN 73 -20.516 -18.513 9.276 973 HB2 GLN 73 2HB GLN 73 -20.557 -21.319 10.487 974 HB3 GLN 73 3HB GLN 73 -20.597 -19.770 11.274 975 HG2 GLN 73 2HG GLN 73 -22.843 -21.140 9.803 976 HG3 GLN 73 3HG GLN 73 -22.810 -20.509 11.440 977 HE21 GLN 73 1HE2 GLN 73 -24.158 -19.932 8.404 978 HE22 GLN 73 2HE2 GLN 73 -24.387 -18.219 8.567 979 H ARG 74 HN ARG 74 -18.900 -19.906 7.031 980 HA ARG 74 HA ARG 74 -16.410 -20.761 8.209 981 HE ARG 74 HE ARG 74 -14.651 -22.816 7.892 982 HB2 ARG 74 2HB ARG 74 -17.287 -19.729 5.507 983 HB3 ARG 74 3HB ARG 74 -15.598 -19.760 5.856 984 HG2 ARG 74 2HG ARG 74 -17.102 -22.299 6.436 985 HG3 ARG 74 3HG ARG 74 -16.777 -21.854 4.757 986 HD2 ARG 74 2HD ARG 74 -15.002 -23.289 5.586 987 HD3 ARG 74 3HD ARG 74 -14.407 -21.693 5.144 988 HH11 ARG 74 1HH1 ARG 74 -13.475 -20.044 5.959 989 HH12 ARG 74 2HH1 ARG 74 -12.594 -19.445 7.353 990 HH21 ARG 74 1HH2 ARG 74 -13.436 -21.858 9.542 991 HH22 ARG 74 2HH2 ARG 74 -12.670 -20.304 9.202 992 H LYS 75 HN LYS 75 -15.504 -19.481 9.747 993 HA LYS 75 HA LYS 75 -15.451 -16.608 9.431 994 HB2 LYS 75 2HB LYS 75 -14.176 -16.704 11.589 995 HB3 LYS 75 3HB LYS 75 -15.779 -17.417 11.580 996 HG2 LYS 75 2HG LYS 75 -14.788 -19.694 11.525 997 HG3 LYS 75 3HG LYS 75 -13.171 -18.983 11.514 998 HD2 LYS 75 2HD LYS 75 -13.731 -19.724 13.736 999 HD3 LYS 75 3HD LYS 75 -13.589 -17.968 13.744 1000 HE2 LYS 75 2HE LYS 75 -16.306 -19.271 13.370 1001 HE3 LYS 75 3HE LYS 75 -15.584 -19.219 14.983 1002 HZ1 LYS 75 3HZ LYS 75 -16.047 -16.845 13.310 1003 HZ2 LYS 75 1HZ LYS 75 -15.486 -16.852 14.858 1004 HZ3 LYS 75 2HZ LYS 75 -17.032 -17.332 14.513 1005 H PHE 76 HN PHE 76 -13.984 -15.385 8.497 1006 HA PHE 76 HA PHE 76 -11.281 -16.550 7.936 1007 HD1 PHE 76 1HD PHE 76 -10.891 -17.372 5.213 1008 HD2 PHE 76 2HD PHE 76 -14.841 -15.699 5.734 1009 HE1 PHE 76 1HE PHE 76 -11.853 -19.192 3.866 1010 HE2 PHE 76 2HE PHE 76 -15.808 -17.557 4.472 1011 HZ PHE 76 HZ PHE 76 -14.343 -19.325 3.546 1012 HB2 PHE 76 2HB PHE 76 -12.874 -14.452 6.378 1013 HB3 PHE 76 3HB PHE 76 -11.265 -15.009 5.972 1014 H SER 77 HN SER 77 -9.510 -14.974 7.800 1015 HA SER 77 HA SER 77 -9.859 -12.756 9.769 1016 HG SER 77 HG SER 77 -6.481 -14.889 8.925 1017 HB2 SER 77 2HB SER 77 -7.291 -12.813 9.742 1018 HB3 SER 77 3HB SER 77 -8.082 -14.244 10.408 1019 H ARG 78 HN ARG 78 -10.072 -13.163 6.485 1020 HA ARG 78 HA ARG 78 -9.130 -10.383 5.973 1021 HE ARG 78 HE ARG 78 -4.368 -12.372 5.659 1022 HB2 ARG 78 2HB ARG 78 -8.535 -12.737 4.145 1023 HB3 ARG 78 3HB ARG 78 -8.115 -11.038 3.898 1024 HG2 ARG 78 2HG ARG 78 -6.586 -11.160 5.876 1025 HG3 ARG 78 3HG ARG 78 -6.933 -12.909 5.984 1026 HD2 ARG 78 2HD ARG 78 -6.248 -13.173 3.606 1027 HD3 ARG 78 3HD ARG 78 -5.846 -11.456 3.529 1028 HH11 ARG 78 1HH2 ARG 78 -4.505 -13.573 2.313 1029 HH12 ARG 78 2HH2 ARG 78 -2.757 -13.513 2.183 1030 HH21 ARG 78 2HH1 ARG 78 -2.244 -12.497 5.466 1031 HH22 ARG 78 1HH1 ARG 78 -1.575 -13.047 3.922 1032 H SER 79 HN SER 79 -10.305 -9.246 4.500 1033 HA SER 79 HA SER 79 -12.929 -10.186 3.739 1034 HG SER 79 HG SER 79 -11.110 -6.652 2.927 1035 HB2 SER 79 2HB SER 79 -12.914 -8.045 2.364 1036 HB3 SER 79 3HB SER 79 -12.628 -7.835 4.099 1037 H ASP 80 HN ASP 80 -9.748 -9.939 2.095 1038 HA ASP 80 HA ASP 80 -10.671 -10.522 -0.534 1039 HB2 ASP 80 2HB ASP 80 -8.287 -11.235 -0.949 1040 HB3 ASP 80 3HB ASP 80 -8.550 -9.619 -0.288 1041 H HIS 81 HN HIS 81 -9.660 -12.734 2.123 1042 HA HIS 81 HA HIS 81 -9.999 -15.179 0.569 1043 HD1 HIS 81 1HD HIS 81 -7.788 -16.017 4.651 1044 HD2 HIS 81 2HD HIS 81 -7.588 -14.715 0.661 1045 HE1 HIS 81 1HE HIS 81 -5.407 -15.929 4.107 1046 HB2 HIS 81 2HB HIS 81 -9.961 -14.639 3.577 1047 HB3 HIS 81 3HB HIS 81 -10.087 -16.239 2.863 1048 H LEU 82 HN LEU 82 -12.085 -13.204 2.753 1049 HA LEU 82 HA LEU 82 -14.324 -14.996 2.751 1050 HG LEU 82 HG LEU 82 -16.437 -13.999 3.260 1051 HB2 LEU 82 2HB LEU 82 -14.050 -13.137 4.311 1052 HB3 LEU 82 3HB LEU 82 -14.247 -11.951 3.028 1053 HD11 LEU 82 1HD1 LEU 82 -15.912 -13.537 5.563 1054 HD12 LEU 82 2HD1 LEU 82 -17.501 -12.944 5.133 1055 HD13 LEU 82 3HD1 LEU 82 -16.188 -11.769 5.296 1056 HD21 LEU 82 3HD2 LEU 82 -16.493 -10.956 2.964 1057 HD22 LEU 82 1HD2 LEU 82 -17.892 -12.046 2.870 1058 HD23 LEU 82 2HD2 LEU 82 -16.645 -12.115 1.628 1059 H LYS 83 HN LYS 83 -13.515 -12.186 0.628 1060 HA LYS 83 HA LYS 83 -15.837 -12.401 -1.069 1061 HB2 LYS 83 2HB LYS 83 -14.313 -10.419 -0.893 1062 HB3 LYS 83 3HB LYS 83 -13.046 -11.324 -1.727 1063 HG2 LYS 83 2HG LYS 83 -14.491 -11.480 -3.746 1064 HG3 LYS 83 3HG LYS 83 -15.790 -10.634 -2.879 1065 HD2 LYS 83 2HD LYS 83 -14.293 -8.647 -2.624 1066 HD3 LYS 83 3HD LYS 83 -13.023 -9.504 -3.526 1067 HE2 LYS 83 2HE LYS 83 -14.569 -9.697 -5.473 1068 HE3 LYS 83 3HE LYS 83 -15.802 -8.798 -4.571 1069 HZ1 LYS 83 3HZ LYS 83 -13.143 -7.785 -5.331 1070 HZ2 LYS 83 1HZ LYS 83 -14.274 -6.936 -4.478 1071 HZ3 LYS 83 2HZ LYS 83 -14.569 -7.369 -6.039 1072 H THR 84 HN THR 84 -12.613 -13.948 -1.106 1073 HA THR 84 HA THR 84 -12.897 -15.250 -3.653 1074 HB THR 84 HB THR 84 -11.300 -15.903 -1.166 1075 HG1 THR 84 1HG THR 84 -10.599 -14.108 -2.044 1076 HG21 THR 84 3HG2 THR 84 -10.817 -17.197 -3.849 1077 HG22 THR 84 1HG2 THR 84 -11.434 -18.036 -2.398 1078 HG23 THR 84 2HG2 THR 84 -9.832 -17.300 -2.359 1079 H HIS 85 HN HIS 85 -13.489 -16.373 -0.288 1080 HA HIS 85 HA HIS 85 -14.576 -18.913 -0.981 1081 HD1 HIS 85 1HD HIS 85 -15.858 -20.816 0.837 1082 HD2 HIS 85 2HD HIS 85 -17.086 -17.134 2.508 1083 HE1 HIS 85 1HE HIS 85 -18.176 -21.184 1.857 1084 HB2 HIS 85 2HB HIS 85 -13.916 -18.597 1.254 1085 HB3 HIS 85 3HB HIS 85 -14.798 -17.080 1.410 1086 H THR 86 HN THR 86 -16.032 -15.683 -0.712 1087 HA THR 86 HA THR 86 -18.764 -16.331 -0.803 1088 HB THR 86 HB THR 86 -17.305 -14.015 -2.141 1089 HG1 THR 86 1HG THR 86 -17.076 -14.209 0.150 1090 HG21 THR 86 3HG2 THR 86 -19.551 -14.069 -3.075 1091 HG22 THR 86 1HG2 THR 86 -19.305 -12.728 -1.942 1092 HG23 THR 86 2HG2 THR 86 -20.232 -14.164 -1.424 1093 H ARG 87 HN ARG 87 -16.336 -16.209 -3.470 1094 HA ARG 87 HA ARG 87 -18.249 -16.422 -5.630 1095 HE ARG 87 HE ARG 87 -13.194 -16.325 -7.238 1096 HB2 ARG 87 2HB ARG 87 -15.288 -17.171 -5.463 1097 HB3 ARG 87 3HB ARG 87 -16.256 -17.257 -6.920 1098 HG2 ARG 87 2HG ARG 87 -16.862 -14.810 -6.601 1099 HG3 ARG 87 3HG ARG 87 -15.639 -14.740 -5.333 1100 HD2 ARG 87 2HD ARG 87 -15.142 -15.544 -8.231 1101 HD3 ARG 87 3HD ARG 87 -14.849 -13.933 -7.575 1102 HH11 ARG 87 1HH2 ARG 87 -13.792 -13.180 -5.762 1103 HH12 ARG 87 2HH2 ARG 87 -12.183 -13.165 -5.049 1104 HH21 ARG 87 1HH1 ARG 87 -11.356 -16.264 -6.317 1105 HH22 ARG 87 2HH1 ARG 87 -10.855 -14.952 -5.229 1106 H THR 88 HN THR 88 -16.946 -18.772 -3.344 1107 HA THR 88 HA THR 88 -17.545 -21.161 -4.902 1108 HB THR 88 HB THR 88 -17.219 -22.400 -2.917 1109 HG1 THR 88 1HG THR 88 -17.408 -20.023 -1.393 1110 HG21 THR 88 3HG2 THR 88 -15.123 -21.626 -1.925 1111 HG22 THR 88 1HG2 THR 88 -15.332 -20.029 -2.681 1112 HG23 THR 88 2HG2 THR 88 -15.117 -21.460 -3.689 1113 H HIS 89 HN HIS 89 -19.398 -19.039 -2.703 1114 HA HIS 89 HA HIS 89 -21.749 -20.851 -2.744 1115 HD1 HIS 89 1HD HIS 89 -22.557 -21.693 -0.682 1116 HD2 HIS 89 2HD HIS 89 -20.451 -18.456 1.005 1117 HE1 HIS 89 1HE HIS 89 -21.862 -22.402 1.687 1118 HB2 HIS 89 2HB HIS 89 -21.168 -18.131 -1.505 1119 HB3 HIS 89 3HB HIS 89 -22.803 -18.769 -1.597 1120 H THR 90 HN THR 90 -20.372 -18.224 -4.566 1121 HA THR 90 HA THR 90 -22.941 -17.463 -5.802 1122 HB THR 90 HB THR 90 -20.147 -16.535 -6.558 1123 HG1 THR 90 1HG THR 90 -20.511 -16.219 -4.284 1124 HG21 THR 90 3HG2 THR 90 -21.842 -15.681 -8.108 1125 HG22 THR 90 1HG2 THR 90 -21.256 -14.381 -7.070 1126 HG23 THR 90 2HG2 THR 90 -22.833 -15.125 -6.738 1127 H GLY 91 HN GLY 91 -20.593 -19.896 -6.297 1128 HA2 GLY 91 2HA GLY 91 -20.231 -21.384 -8.043 1129 HA3 GLY 91 3HA GLY 91 -21.694 -20.763 -8.830 1130 H GLU 92 HN GLU 92 -19.292 -18.395 -7.978 1131 HA GLU 92 HA GLU 92 -19.037 -17.696 -10.808 1132 HB2 GLU 92 2HB GLU 92 -19.451 -15.988 -9.108 1133 HB3 GLU 92 3HB GLU 92 -17.986 -16.407 -8.249 1134 HG2 GLU 92 2HG GLU 92 -17.804 -14.310 -9.527 1135 HG3 GLU 92 3HG GLU 92 -16.608 -15.485 -10.016 1136 H LYS 93 HN LYS 93 -17.599 -18.785 -12.032 1137 HA LYS 93 HA LYS 93 -14.830 -19.154 -10.948 1138 HB2 LYS 93 2HB LYS 93 -16.432 -21.025 -12.731 1139 HB3 LYS 93 3HB LYS 93 -14.701 -21.199 -12.432 1140 HG2 LYS 93 2HG LYS 93 -15.039 -21.586 -10.084 1141 HG3 LYS 93 3HG LYS 93 -16.761 -21.213 -10.182 1142 HD2 LYS 93 2HD LYS 93 -15.371 -23.566 -11.527 1143 HD3 LYS 93 3HD LYS 93 -16.290 -23.647 -10.027 1144 HE2 LYS 93 2HE LYS 93 -17.425 -22.875 -12.752 1145 HE3 LYS 93 3HE LYS 93 -17.581 -24.453 -11.974 1146 HZ1 LYS 93 3HZ LYS 93 -19.532 -23.150 -11.608 1147 HZ2 LYS 93 1HZ LYS 93 -18.685 -21.913 -10.946 1148 HZ3 LYS 93 2HZ LYS 93 -18.763 -23.367 -10.168 1149 HA PRO 94 HA PRO 94 -14.830 -16.628 -14.787 1150 HB2 PRO 94 2HB PRO 94 -13.365 -14.492 -13.936 1151 HB3 PRO 94 3HB PRO 94 -15.067 -14.734 -13.442 1152 HG2 PRO 94 2HG PRO 94 -12.561 -15.424 -11.882 1153 HG3 PRO 94 3HG PRO 94 -14.025 -14.567 -11.307 1154 HD2 PRO 94 2HD PRO 94 -13.584 -17.261 -10.961 1155 HD3 PRO 94 3HD PRO 94 -15.221 -16.563 -11.108 1156 H PHE 95 HN PHE 95 -12.169 -17.861 -12.788 1157 HA PHE 95 HA PHE 95 -10.051 -17.094 -14.677 1158 HD1 PHE 95 2HD PHE 95 -7.999 -16.041 -13.182 1159 HD2 PHE 95 1HD PHE 95 -10.933 -17.807 -10.585 1160 HE1 PHE 95 2HE PHE 95 -7.793 -14.106 -11.637 1161 HE2 PHE 95 1HE PHE 95 -10.710 -15.881 -9.017 1162 HZ PHE 95 HZ PHE 95 -9.137 -14.036 -9.544 1163 HB2 PHE 95 2HB PHE 95 -10.014 -19.092 -12.368 1164 HB3 PHE 95 3HB PHE 95 -8.621 -18.499 -13.254 1165 H SER 96 HN SER 96 -11.110 -17.969 -16.620 1166 HA SER 96 HA SER 96 -11.232 -20.899 -16.923 1167 HG SER 96 HG SER 96 -13.036 -18.497 -17.353 1168 HB2 SER 96 2HB SER 96 -11.455 -18.708 -19.031 1169 HB3 SER 96 3HB SER 96 -11.964 -20.400 -19.192 1170 H CYS 97 HN CYS 97 -9.806 -22.196 -18.022 1171 HA CYS 97 HA CYS 97 -7.091 -21.289 -18.260 1172 HB2 CYS 97 2HB CYS 97 -7.897 -23.662 -17.782 1173 HB3 CYS 97 3HB CYS 97 -8.334 -23.752 -19.487 1174 H ARG 98 HN ARG 98 -5.752 -21.465 -20.215 1175 HA ARG 98 HA ARG 98 -7.206 -20.404 -22.618 1176 HE ARG 98 HE ARG 98 -8.275 -19.240 -21.250 1177 HB2 ARG 98 2HB ARG 98 -4.432 -19.638 -21.635 1178 HB3 ARG 98 3HB ARG 98 -5.256 -18.952 -23.026 1179 HG2 ARG 98 2HG ARG 98 -6.168 -18.593 -20.128 1180 HG3 ARG 98 3HG ARG 98 -5.145 -17.485 -21.025 1181 HD2 ARG 98 2HD ARG 98 -7.314 -16.562 -21.096 1182 HD3 ARG 98 3HD ARG 98 -6.992 -17.198 -22.721 1183 HH11 ARG 98 1HH2 ARG 98 -9.281 -16.066 -22.377 1184 HH12 ARG 98 2HH2 ARG 98 -10.960 -16.571 -22.444 1185 HH21 ARG 98 1HH1 ARG 98 -10.222 -19.805 -21.415 1186 HH22 ARG 98 2HH1 ARG 98 -11.524 -18.695 -21.885 1187 H TRP 99 HN TRP 99 -5.755 -23.101 -21.537 1188 HA TRP 99 HA TRP 99 -3.706 -23.608 -23.507 1189 HD1 TRP 99 1HD TRP 99 -3.658 -23.231 -20.242 1190 HE1 TRP 99 1HE TRP 99 -1.353 -23.566 -19.180 1191 HE3 TRP 99 3HE TRP 99 -2.207 -27.424 -22.788 1192 HZ2 TRP 99 2HZ TRP 99 0.867 -25.381 -19.447 1193 HZ3 TRP 99 3HZ TRP 99 0.033 -28.416 -22.389 1194 HH2 TRP 99 2HH TRP 99 1.580 -27.399 -20.732 1195 HB2 TRP 99 2HB TRP 99 -5.290 -25.245 -21.538 1196 HB3 TRP 99 3HB TRP 99 -4.365 -26.093 -22.744 1197 HA PRO 100 HA PRO 100 -5.533 -24.714 -27.271 1198 HB2 PRO 100 2HB PRO 100 -4.632 -27.591 -26.754 1199 HB3 PRO 100 3HB PRO 100 -4.531 -26.641 -28.272 1200 HG2 PRO 100 2HG PRO 100 -2.364 -26.842 -26.689 1201 HG3 PRO 100 3HG PRO 100 -2.817 -25.232 -27.337 1202 HD2 PRO 100 2HD PRO 100 -3.288 -26.361 -24.586 1203 HD3 PRO 100 3HD PRO 100 -2.787 -24.707 -25.062 1204 H SER 101 HN SER 101 -7.731 -24.489 -27.116 1205 HA SER 101 HA SER 101 -9.953 -25.094 -27.118 1206 HG SER 101 HG SER 101 -11.139 -27.487 -26.802 1207 HB2 SER 101 2HB SER 101 -9.142 -26.857 -28.694 1208 HB3 SER 101 3HB SER 101 -8.919 -27.968 -27.324 1209 H CYS 102 HN CYS 102 -8.278 -25.148 -24.486 1210 HA CYS 102 HA CYS 102 -9.694 -27.039 -22.775 1211 HB2 CYS 102 2HB CYS 102 -7.406 -26.148 -22.265 1212 HB3 CYS 102 3HB CYS 102 -8.115 -24.537 -21.990 1213 H GLN 103 HN GLN 103 -11.128 -26.431 -21.029 1214 HA GLN 103 HA GLN 103 -12.520 -23.845 -21.226 1215 HB2 GLN 103 2HB GLN 103 -13.853 -26.512 -21.843 1216 HB3 GLN 103 3HB GLN 103 -14.792 -25.182 -21.181 1217 HG2 GLN 103 2HG GLN 103 -13.299 -25.084 -23.813 1218 HG3 GLN 103 3HG GLN 103 -15.033 -25.245 -23.574 1219 HE21 GLN 103 1HE2 GLN 103 -12.327 -23.002 -23.488 1220 HE22 GLN 103 2HE2 GLN 103 -13.355 -21.555 -23.279 1221 H LYS 104 HN LYS 104 -10.776 -25.442 -19.295 1222 HA LYS 104 HA LYS 104 -12.605 -26.098 -17.063 1223 HB2 LYS 104 2HB LYS 104 -9.570 -26.054 -17.389 1224 HB3 LYS 104 3HB LYS 104 -10.352 -26.220 -15.821 1225 HG2 LYS 104 2HG LYS 104 -10.024 -28.424 -16.331 1226 HG3 LYS 104 3HG LYS 104 -11.690 -28.195 -16.854 1227 HD2 LYS 104 2HD LYS 104 -10.851 -27.913 -19.213 1228 HD3 LYS 104 3HD LYS 104 -9.204 -28.200 -18.615 1229 HE2 LYS 104 2HE LYS 104 -9.867 -30.445 -17.851 1230 HE3 LYS 104 3HE LYS 104 -11.515 -30.165 -18.452 1231 HZ1 LYS 104 3HZ LYS 104 -10.587 -29.878 -20.655 1232 HZ2 LYS 104 1HZ LYS 104 -10.165 -31.358 -20.057 1233 HZ3 LYS 104 2HZ LYS 104 -9.067 -30.126 -20.097 1234 H LYS 105 HN LYS 105 -13.171 -24.759 -15.444 1235 HA LYS 105 HA LYS 105 -11.960 -22.025 -15.453 1236 HB2 LYS 105 2HB LYS 105 -14.916 -22.635 -14.983 1237 HB3 LYS 105 3HB LYS 105 -14.127 -21.063 -15.200 1238 HG2 LYS 105 2HG LYS 105 -13.460 -21.850 -17.537 1239 HG3 LYS 105 3HG LYS 105 -14.536 -23.229 -17.277 1240 HD2 LYS 105 2HD LYS 105 -16.485 -21.825 -17.155 1241 HD3 LYS 105 3HD LYS 105 -15.490 -20.359 -17.106 1242 HE2 LYS 105 2HE LYS 105 -16.364 -20.624 -19.359 1243 HE3 LYS 105 3HE LYS 105 -14.610 -20.852 -19.363 1244 HZ1 LYS 105 3HZ LYS 105 -15.017 -23.255 -19.372 1245 HZ2 LYS 105 1HZ LYS 105 -15.682 -22.524 -20.695 1246 HZ3 LYS 105 2HZ LYS 105 -16.638 -22.997 -19.440 1247 H PHE 106 HN PHE 106 -11.516 -21.108 -13.544 1248 HA PHE 106 HA PHE 106 -12.281 -22.652 -11.081 1249 HD1 PHE 106 1HD PHE 106 -10.321 -24.525 -10.134 1250 HD2 PHE 106 2HD PHE 106 -9.139 -22.455 -13.728 1251 HE1 PHE 106 1HE PHE 106 -9.814 -26.695 -11.220 1252 HE2 PHE 106 2HE PHE 106 -8.660 -24.622 -14.825 1253 HZ PHE 106 HZ PHE 106 -9.032 -26.749 -13.581 1254 HB2 PHE 106 2HB PHE 106 -9.653 -21.212 -11.684 1255 HB3 PHE 106 3HB PHE 106 -10.056 -22.039 -10.187 1256 H ALA 107 HN ALA 107 -12.203 -21.382 -9.057 1257 HA ALA 107 HA ALA 107 -13.264 -18.646 -9.561 1258 HB1 ALA 107 1HB ALA 107 -14.228 -18.862 -7.290 1259 HB2 ALA 107 2HB ALA 107 -14.719 -20.225 -8.300 1260 HB3 ALA 107 3HB ALA 107 -13.438 -20.442 -7.086 1261 H ARG 108 HN ARG 108 -10.325 -20.018 -8.926 1262 HA ARG 108 HA ARG 108 -9.428 -17.586 -7.462 1263 HE ARG 108 HE ARG 108 -9.039 -19.079 -3.232 1264 HB2 ARG 108 2HB ARG 108 -8.214 -20.297 -6.854 1265 HB3 ARG 108 3HB ARG 108 -8.107 -18.790 -5.952 1266 HG2 ARG 108 2HG ARG 108 -10.442 -19.008 -5.218 1267 HG3 ARG 108 3HG ARG 108 -10.642 -20.470 -6.168 1268 HD2 ARG 108 2HD ARG 108 -10.335 -21.188 -3.953 1269 HD3 ARG 108 3HD ARG 108 -8.845 -21.576 -4.814 1270 HH11 ARG 108 1HH1 ARG 108 -7.402 -22.234 -3.478 1271 HH12 ARG 108 2HH1 ARG 108 -6.214 -21.717 -2.299 1272 HH21 ARG 108 1HH2 ARG 108 -7.566 -18.581 -1.854 1273 HH22 ARG 108 2HH2 ARG 108 -6.262 -19.649 -1.445 1274 H SER 109 HN SER 109 -7.612 -16.677 -8.265 1275 HA SER 109 HA SER 109 -6.715 -17.316 -10.859 1276 HG SER 109 HG SER 109 -5.823 -14.602 -8.202 1277 HB2 SER 109 2HB SER 109 -4.712 -15.805 -10.169 1278 HB3 SER 109 3HB SER 109 -6.326 -15.104 -10.129 1279 H ASP 110 HN ASP 110 -5.331 -18.158 -7.662 1280 HA ASP 110 HA ASP 110 -2.974 -19.441 -8.718 1281 HB2 ASP 110 2HB ASP 110 -2.665 -20.287 -6.493 1282 HB3 ASP 110 3HB ASP 110 -3.092 -18.584 -6.432 1283 H GLU 111 HN GLU 111 -6.311 -20.561 -8.024 1284 HA GLU 111 HA GLU 111 -5.809 -23.400 -8.234 1285 HB2 GLU 111 2HB GLU 111 -8.250 -21.647 -8.616 1286 HB3 GLU 111 3HB GLU 111 -8.268 -23.297 -9.180 1287 HG2 GLU 111 2HG GLU 111 -7.835 -24.172 -6.989 1288 HG3 GLU 111 3HG GLU 111 -7.687 -22.546 -6.327 1289 H LEU 112 HN LEU 112 -6.581 -20.829 -10.638 1290 HA LEU 112 HA LEU 112 -6.533 -22.603 -12.911 1291 HG LEU 112 HG LEU 112 -5.098 -20.550 -14.824 1292 HB2 LEU 112 2HB LEU 112 -7.552 -20.402 -13.022 1293 HB3 LEU 112 3HB LEU 112 -6.002 -19.604 -12.713 1294 HD11 LEU 112 1HD1 LEU 112 -6.468 -21.667 -16.414 1295 HD12 LEU 112 2HD1 LEU 112 -7.937 -21.483 -15.442 1296 HD13 LEU 112 3HD1 LEU 112 -6.620 -22.586 -14.967 1297 HD21 LEU 112 3HD2 LEU 112 -7.689 -19.054 -15.299 1298 HD22 LEU 112 1HD2 LEU 112 -6.295 -19.155 -16.381 1299 HD23 LEU 112 2HD2 LEU 112 -6.138 -18.314 -14.829 1300 H VAL 113 HN VAL 113 -3.977 -20.573 -11.332 1301 HA VAL 113 HA VAL 113 -1.827 -21.203 -13.081 1302 HB VAL 113 HB VAL 113 -1.814 -20.739 -10.062 1303 HG11 VAL 113 1HG1 VAL 113 0.582 -20.126 -10.331 1304 HG12 VAL 113 2HG1 VAL 113 0.277 -21.841 -10.584 1305 HG13 VAL 113 3HG1 VAL 113 0.533 -20.772 -11.985 1306 HG21 VAL 113 3HG2 VAL 113 -1.221 -18.475 -10.497 1307 HG22 VAL 113 1HG2 VAL 113 -0.955 -18.796 -12.222 1308 HG23 VAL 113 2HG2 VAL 113 -2.585 -18.800 -11.578 1309 H ARG 114 HN ARG 114 -3.086 -22.981 -10.237 1310 HA ARG 114 HA ARG 114 -1.164 -25.121 -10.314 1311 HE ARG 114 HE ARG 114 -1.832 -25.993 -6.544 1312 HB2 ARG 114 2HB ARG 114 -2.649 -24.661 -8.386 1313 HB3 ARG 114 3HB ARG 114 -4.061 -25.160 -9.321 1314 HG2 ARG 114 2HG ARG 114 -3.173 -27.436 -9.544 1315 HG3 ARG 114 3HG ARG 114 -1.672 -26.976 -8.737 1316 HD2 ARG 114 2HD ARG 114 -4.426 -26.809 -7.440 1317 HD3 ARG 114 3HD ARG 114 -3.359 -28.221 -7.324 1318 HH11 ARG 114 1HH1 ARG 114 -4.647 -27.709 -5.267 1319 HH12 ARG 114 2HH1 ARG 114 -4.209 -27.383 -3.617 1320 HH21 ARG 114 1HH2 ARG 114 -1.359 -25.551 -4.408 1321 HH22 ARG 114 2HH2 ARG 114 -2.499 -26.081 -3.173 1322 H HIS 115 HN HIS 115 -4.533 -24.929 -11.654 1323 HA HIS 115 HA HIS 115 -4.621 -27.327 -12.995 1324 HD1 HIS 115 1HD HIS 115 -7.007 -28.229 -14.424 1325 HD2 HIS 115 2HD HIS 115 -5.919 -24.754 -16.543 1326 HE1 HIS 115 1HE HIS 115 -7.637 -28.610 -16.877 1327 HB2 HIS 115 2HB HIS 115 -6.509 -25.827 -12.953 1328 HB3 HIS 115 3HB HIS 115 -5.674 -24.619 -13.915 1329 H HIS 116 HN HIS 116 -3.248 -24.269 -14.332 1330 HA HIS 116 HA HIS 116 -2.410 -25.305 -16.830 1331 HD1 HIS 116 1HD HIS 116 -4.052 -23.588 -17.749 1332 HD2 HIS 116 2HD HIS 116 -1.658 -20.665 -15.812 1333 HE1 HIS 116 1HE HIS 116 -4.997 -21.376 -18.321 1334 HB2 HIS 116 2HB HIS 116 -1.162 -23.166 -15.066 1335 HB3 HIS 116 3HB HIS 116 -0.672 -23.491 -16.717 1336 H ASN 117 HN ASN 117 -0.842 -25.490 -13.594 1337 HA ASN 117 HA ASN 117 1.713 -26.473 -14.641 1338 HB2 ASN 117 2HB ASN 117 0.496 -26.129 -11.876 1339 HB3 ASN 117 3HB ASN 117 1.921 -27.139 -12.091 1340 HD21 ASN 117 1HD2 ASN 117 0.718 -23.773 -12.642 1341 HD22 ASN 117 2HD2 ASN 117 2.382 -23.142 -12.605 1342 H MET 118 HN MET 118 -1.394 -27.891 -14.058 1343 HA MET 118 HA MET 118 -0.197 -30.643 -14.022 1344 HB2 MET 118 2HB MET 118 -3.033 -29.719 -13.384 1345 HB3 MET 118 3HB MET 118 -2.446 -31.387 -13.300 1346 HG2 MET 118 2HG MET 118 -0.762 -30.659 -11.588 1347 HG3 MET 118 3HG MET 118 -1.512 -29.069 -11.573 1348 HE1 MET 118 3HE MET 118 -4.159 -28.756 -11.064 1349 HE2 MET 118 1HE MET 118 -4.782 -30.234 -11.832 1350 HE3 MET 118 2HE MET 118 -5.111 -29.922 -10.112 1351 H HIS 119 HN HIS 119 -1.155 -28.380 -16.231 1352 HA HIS 119 HA HIS 119 -3.155 -29.775 -17.731 1353 HD1 HIS 119 1HD HIS 119 -3.343 -29.477 -20.635 1354 HD2 HIS 119 2HD HIS 119 -4.472 -26.184 -18.282 1355 HE1 HIS 119 1HE HIS 119 -5.771 -28.813 -21.340 1356 HB2 HIS 119 2HB HIS 119 -2.277 -27.248 -17.698 1357 HB3 HIS 119 3HB HIS 119 -1.338 -27.804 -19.085
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